CPD_ID SUPPLIER CATALOG # CHEMICAL NAME STRUCTURE O

N N N PWT000001 PRESTWICK Prestw-1 Azaguanine-8 N H2N N

O H2N N O N N PWT000002 PRESTWICK Prestw-2 Allantoin O

N N O N S S O PWT000003 PRESTWICK Prestw-3 H2N O H3C

ClH

CH HN 3 N N PWT000004 PRESTWICK Prestw-4 Metformin hydrochloride CH H N 3 2 HN

O O O O S S O O

O O O O H3C CH3 + + H C N O O N CH3 3 O O CH CH PWT000005 PRESTWICK Prestw-5 Atracurium besylate 3 3 O O

CH3 O O CH3 H3C CH3

O Chiral O O CH3 CH HO 3 OH

CH3 H

PWT000006 PRESTWICK Prestw-6 Isoflupredone acetate F H O ClH

OH 2 OH2

O NH Cl N N NH PWT000007 PRESTWICK Prestw-7 hydrochloride dihydrate 2

H2N N NH2

Cl ClH

N CH3

N

+ NH N 2 CH PWT000008 PRESTWICK Prestw-8 Amprolium hydrochloride 3

O O O NH2 S S N O PWT000009 PRESTWICK Prestw-9 N Cl

O O S NH H N N PWT000010 PRESTWICK Prestw-10 Sulfaguanidine 2 NH2

O O O H N 2 S S O PWT000011 PRESTWICK Prestw-11 H3C

O O O 9CH3

H C N PWT000012 PRESTWICK Prestw-12 Benzonatate 3

F F F N O N PWT000013 PRESTWICK Prestw-13 S S H N 2 O O O OH2

Na O

H2N N PWT000014 PRESTWICK Prestw-14 Sulfacetamide sodic hydrate S CH O 3 O

ClH

HO NH PWT000015 PRESTWICK Prestw-15 Heptaminol hydrochloride 2 H3C CH3 CH3

N H N 2 N S S PWT000016 PRESTWICK Prestw-16 Sulfathiazole O O

O Chiral

OH

NH2 PWT000017 PRESTWICK Prestw-17 Levodopa HO OH

I Chiral

O O N N PWT000018 PRESTWICK Prestw-18 Idoxuridine HO O HO

Chiral O N OH H C 3 O PWT000019 PRESTWICK Prestw-19 Captopril HS

H2N

HO N N PWT000020 PRESTWICK Prestw-20 N HN NH2

N N PWT000021 PRESTWICK Prestw-21 Sulfaphenazole N S O O

OH Chiral

HO N OH

H3C PWT000022 PRESTWICK Prestw-22 Panthenol (D) CH3 O

N H N 2 N S N PWT000023 PRESTWICK Prestw-23 Sulfadiazine O O

CH Chiral

CH3 OH

H

PWT000024 PRESTWICK Prestw-24 Norethynodrel H H O

Cl OH Chiral N Cl O O PWT000025 PRESTWICK Prestw-25 Thiamphenicol HO S CH O 3

S N N N N H C 3 N PWT000026 PRESTWICK Prestw-26 N CH3

O O OH HO

N

H C O PWT000027 PRESTWICK Prestw-27 succinate 3 N H3C CH3 ClH ClH

HO Chiral

H C N 3 N CH PWT000028 PRESTWICK Prestw-28 Ethambutol dihydrochloride 3 OH

H3C

N CH3 N PWT000029 PRESTWICK Prestw-29 Antipyrine O

H3C CH N 3 N PWT000030 PRESTWICK Prestw-30 Antipyrine, 4-hydroxy OH O

Cl Cl Chiral O + N O N O PWT000031 PRESTWICK Prestw-31 Chloramphenicol OH OH

CH O 3

H C 3 O N

N N CH3 PWT000032 PRESTWICK Prestw-32 Epirizole N

H3C

O CH3 N HO O N PWT000033 PRESTWICK Prestw-33 Diprophylline HO N N CH3

NH N 2 N H2N N N PWT000034 PRESTWICK Prestw-34 NH2 H2N NH2

PWT000035 PRESTWICK Prestw-35 Dapsone S O O

O Chiral

H3C O CH3 CH H3C O 3 O O CH3 CH3 H3C H3C O O N

H3C O CH3 O O

CH3 O O

CH3 H C O PWT000036 PRESTWICK Prestw-36 Troleandomycin 3 H3C O

O

Cl NH2

N

N NH PWT000037 PRESTWICK Prestw-37 Pyrimethamine 2

CH3

Br Br OH2 OH2

H3C H3C + + CH3 PWT000038 PRESTWICK Prestw-38 Hexamethonium dibromide dihydrate N N H3C CH3 CH3

O

HO F

PWT000039 PRESTWICK Prestw-39 Diflunisal HO F

OH O Cl O + PWT000040 PRESTWICK Prestw-40 Niclosamide N N Cl O

ClH

CH O 3 N CH O 3 PWT000041 PRESTWICK Prestw-41 hydrochloride

H2N O CH3 CH3 O ClH

O

H C CH PWT000042 PRESTWICK Prestw-42 Moxisylyte hydrochoride 3 3 N H3C CH3

ClH ClH

N N PWT000043 PRESTWICK Prestw-43 Betazole hydrochloride

NH2

O O S CH N 3 N N O PWT000044 PRESTWICK Prestw-44 Isoxicam OH O

CH3

H3C

O CH3 PWT000045 PRESTWICK Prestw-45 Naproxen O OH

ClH

N

N PWT000046 PRESTWICK Prestw-46 Naphazoline hydrochloride

ClH

Cl S

PWT000047 PRESTWICK Prestw-47 Ticlopidine hydrochloride N

H C ClH O 3

N O CH3 PWT000048 PRESTWICK Prestw-48 Dicyclomine hydrochloride ClH

H3C O

H3C PWT000049 PRESTWICK Prestw-49 Amyleine hydrochloride O N CH3 H3C

ClH

CH CH3 3 N PWT000050 PRESTWICK Prestw-50 hydrochloride N O H C CH3 3

OH Chiral HO H O O H C O H C 3 3 O H OH H C PWT000051 PRESTWICK Prestw-1795 Mupirocin 3 OH O

N PWT000052 PRESTWICK Prestw-52 H2N O

ClH

F

F S F N H C PWT000053 PRESTWICK Prestw-53 hydrochloride 3 N

H3C

HO CH3 O H C 3 N PWT000054 PRESTWICK Prestw-54

H3C O

N N S PWT000055 PRESTWICK Prestw-55 O O O O N N

O CH CH 3 O 3 PWT000056 PRESTWICK Prestw-56 Sulpiride S H N 2 O

ClH

O

H2N O CH3 O N CH PWT000057 PRESTWICK Prestw-57 Benoxinate hydrochloride 3

H3C

OH

N O O

H C CH 3 N N 3 PWT000058 PRESTWICK Prestw-58 Oxethazaine CH 3 H3C CH 3 H3C

OH

O O

OH

PWT000059 PRESTWICK Prestw-59 maleate N

N H3C CH3

ClH

PWT000060 PRESTWICK Prestw-60 Tolazoline hydrochloride N N

O OH

HO OH

HO O

CH3 N

N PWT000061 PRESTWICK Prestw-61 Morantel tartrate S

H3C

BrH

H3C N H O PWT000062 PRESTWICK Prestw-62 hydrobromide (R,S) O H OH H3C N CH3

O O CH H3C 3 O O + PWT000063 PRESTWICK Prestw-63 N O O

ClH

Cl S

H C PWT000064 PRESTWICK Prestw-64 hydrochloride 3 N N

H3C

ClH

H3C N O H C PWT000065 PRESTWICK Prestw-65 hydrochloride 3

ClH ClH

O

N N N PWT000066 PRESTWICK Prestw-66 Minaprine dihydrochloride N

CH3

Cl

Cl Cl

O PWT000067 PRESTWICK Prestw-67 Miconazole N Cl N

ClH

OH

N PWT000068 PRESTWICK Prestw-68 Isoxsuprine hydrochloride HO O H3C H3C

ClH

H3C N

CH3 OH O O PWT000069 PRESTWICK Prestw-69 Acebutolol hydrochloride O H3C N

CH3 CH3 N O H3C

PWT000070 PRESTWICK Prestw-70 Tolnaftate S

ClH

O N H C O PWT000071 PRESTWICK Prestw-71 Todralazine hydrochloride 3 N N N

ClH

H C PWT000072 PRESTWICK Prestw-72 hydrochloride 3 N N

H3C

CH3 S O

CH3 Prestw-73 Sulindac O PWT000073 PRESTWICK F OH

ClH

H3C PWT000074 PRESTWICK Prestw-74 Amitryptiline hydrochloride N

H3C

ClH

CH3 O PWT000075 PRESTWICK Prestw-75 Adiphenine hydrochloride N O CH3

CH3

O

H3C N N N H C Prestw-76 Dibucaine 3 PWT000076 PRESTWICK O OHChiral O CH OH O 3

CH3 H

PWT000077 PRESTWICK Prestw-77 Prednisone H H O

ClH CH3 S

CH 3 S N PWT000078 PRESTWICK Prestw-78 hydrochloride N

CH O 3 O S O O

CH3 + PWT000079 PRESTWICK Prestw-79 Diphemanil methylsulfate N CH3

ClH

O H C 3 N O O PWT000080 PRESTWICK Prestw-80 Trimethobenzamide hydrochloride H3C N O CH3 O H3C CH3

O + N O N N PWT000081 PRESTWICK Prestw-81 Metronidazole HO CH3

OH CH3 Chiral

H O H H F F S F HO F PWT000082 PRESTWICK Prestw-1424 Fulvestrant F

Cl

H3C

+ PWT000083 PRESTWICK Prestw-83 Edrophonium chloride HO N CH3 H3C ClH

HN HN PWT000084 PRESTWICK Prestw-84 Moroxidine hydrochloride N N O H2N

Cl

O PWT000085 PRESTWICK Prestw-85 (R,S) H2N OH

NH2 N HO N O N PWT000086 PRESTWICK Prestw-86 Acyclovir N O

N CH3

N Cl S PWT000087 PRESTWICK Prestw-87 O O

H3C CH3 N N CH3 N PWT000088 PRESTWICK Prestw-88 Amidopyrine O CH3

O H C O 3 O S S O O PWT000089 PRESTWICK Prestw-1179 Busulfan CH3 O

CH3

H3C N OH

O PWT000090 PRESTWICK Prestw-90 Pindolol

N H C 3 O O

O PWT000091 PRESTWICK Prestw-91 Khellin O H3C O CH3

ClH

OH2 ClH

Br

CH3 N CH PWT000092 PRESTWICK Prestw-92 Zimelidine dihydrochloride monohydrate 3

N

OH

PWT000093 PRESTWICK Prestw-93 Azacyclonol N

O + N N O

N S

H3C PWT000094 PRESTWICK Prestw-94 Azathioprine N N N N

CH Chiral

CH3 OH H H

PWT000095 PRESTWICK Prestw-95 H H

O

H3C OH

N NH2 Cl N PWT000096 PRESTWICK Prestw-96 Guanabenz acetate NH

Cl

S CH3

H3C S N S N CH3 PWT000097 PRESTWICK Prestw-97 Disulfiram H C 3 S O

O

HO PWT000098 PRESTWICK Prestw-98 Acetylsalicylsalicylic acid O O

H3C O

ClH

PWT000099 PRESTWICK Prestw-99 Mianserine hydrochloride N N

CH3

N N S O N H C PWT000100 PRESTWICK Prestw-100 Nocodazole 3 O O

ClH OH2 ClH

Chiral

N CH3 H N HO CH3 H Prestw-101 R(-) Apomorphine hydrochloride hemihydrate HO PWT000101 PRESTWICK HO

HO

N

N N PWT000102 PRESTWICK Prestw-102 Cl O

ClH

H C N PWT000103 PRESTWICK Prestw-103 hydrochloride 3

S N N H2N S NH NH2

N O PWT000104 PRESTWICK Prestw-104 S O NH2 CHChiral HO H3C

CH3 H

PWT000105 PRESTWICK Prestw-105 N H H O

O

O + O N N PWT000106 PRESTWICK Prestw-106 O N

CH3

N N O O PWT000107 PRESTWICK Prestw-1314 Pioglitazone S O

O OH O

OH N PWT000108 PRESTWICK Prestw-108 Nomifensine maleate CH3

NH2

O OH HO O

CH3 Chiral CH3 O O O

NH2 O O H C PWT000109 PRESTWICK Prestw-1810 Aliskiren hemifumarate 3 N NH2 H C CH3 OH 3 CH3 H3C CH3

Chiral OHCH CH3 3

H CH3 O PWT000110 PRESTWICK Prestw-1192 Oxandrolone H H O H

ClH CH Chiral N 2

OH PWT000111 PRESTWICK Prestw-111 hydrochloride HO O O Cl N CH3 O N S H2N PWT000112 PRESTWICK Prestw-112 O O H3C

ClH OH2

O O F OH PWT000113 PRESTWICK Prestw-113 Ciprofloxacin hydrochloride monohydrate N N N

OH OH2 OH2 2

Chiral

N S H2N CH3 O N CH PWT000114 PRESTWICK Prestw-114 Ampicillin trihydrate 3 O O HO

Cl O F

PWT000115 PRESTWICK Prestw-115 N HO

OH2 OH2 ClH

N Chiral

OH PWT000116 PRESTWICK Prestw-116 hydrochloride dihydrate

HO O O

O

OH O

OH H C CH3 3 N

PWT000117 PRESTWICK Prestw-117 Chlorpheniramine maleate N

Cl

ClH

Chiral

N

OH PWT000118 PRESTWICK Prestw-118 hydrochloride

HO O OH OH2 O N

N

H C O N PWT000119 PRESTWICK Prestw-119 Picotamide monohydrate 3 O N

HO Chiral HO CH3 HO O

CH3 H OH

PWT000120 PRESTWICK Prestw-120 Triamcinolone F H O

O

H3C S OH O

CH3 Chiral OH H3C O N O N H N O O CH3 N CH3 CH PWT000121 PRESTWICK Prestw-121 Bromocryptine mesylate H 3

N Br

ClH

CH3 H3C PWT000122 PRESTWICK Prestw-1471 Amfepramone hydrochloride N H C 3 O

O Chiral

H3C OH O CH3

CH3 H PWT000123 PRESTWICK Prestw-123 Dehydrocholic acid H H O O H

S Cl O Cl

PWT000124 PRESTWICK Prestw-1184 Tioconazole N N Cl

HO

N N

PWT000125 PRESTWICK Prestw-125 N Cl

S ClH

HO N

F PWT000126 PRESTWICK Prestw-126 hydrochloride N F F F F F

N

N Cl

PWT000127 PRESTWICK Prestw-127 Isoconazole O Cl Cl Cl

O Chiral

O H3C

CH3 H O PWT000128 PRESTWICK Prestw-128 H H

O S CH3

ClH ClH

N N

N N O N H3C PWT000129 PRESTWICK Prestw-129 dihydrochloride O

O Chiral H3C

O OH CH3 HO O

CH3 H CH3

PWT000130 PRESTWICK Prestw-130 Dexamethasone acetate F H O

O N

O N S O O N PWT000131 PRESTWICK Prestw-131 N

H3C N

O OH O

OH

CH3 N

N Prestw-132 succinate N PWT000132 PRESTWICK Cl

O ClH

ClH Cl

N O N OH PWT000133 PRESTWICK Prestw-133 dihydrochloride

ClH

O Chiral CH3

S

O

N O OH C PWT000134 PRESTWICK Prestw-134 hydrochloride 3 N H3C CH3

N CH3 O N

O O O PWT000135 PRESTWICK Prestw-1811 Azilsartan kamedoxomil O N O O N CH3 O

N H3C N O N

N PWT000136 PRESTWICK Prestw-136 F

ClH

Cl O Chiral CH3

H3C HO N N

H3C PWT000137 PRESTWICK Prestw-137 Clindamycin hydrochloride HO O

HO S CH3

H3C CH3

CH3 N OH PWT000138 PRESTWICK Prestw-138 HO

+ Na

CH3 Chiral O N N H N H 2 N S S O N O PWT000139 PRESTWICK Prestw-139 Cefotaxime sodium salt O O O O

CH3 ClH

Chiral H3C CH3 H C N 3 OH H H OH PWT000140 PRESTWICK Prestw-140 Tetracycline hydrochloride O OH OH O OH O NH2

ClH

NH3C CH CH 3 CH3 3 O N

O CH Prestw-141 hydrochloride 3 PWT000141 PRESTWICK O

CH3 O CH3

OH

N N N N OH HO N N N PWT000142 PRESTWICK Prestw-142 Dipyridamole N OH

Cl NH NH N N N N N N NH NH Cl PWT000143 PRESTWICK Prestw-143 Chlorhexidine

Cl

HO ClH

N

O

N CH PWT000144 PRESTWICK Prestw-144 hydrochloride 3

CH3

ClH

Chiral H3C CH3 Cl HO CH N H3 H OH

NH PWT000145 PRESTWICK Prestw-145 Chlortetracycline hydrochloride 2 OH OH O OH O O

HO O OH OH O O OH

O CH N 3 H3C PWT000146 PRESTWICK Prestw-146 Tamoxifen citrate H C 3 N Chiral

Br O

O CH3 O N CH3 PWT000147 PRESTWICK Prestw-147 H N

H3C

+ K

Chiral O OH CH3 O

CH3 H H PWT000148 PRESTWICK Prestw-148 salt H

O

HO O O HO S O O S

CH3 CH3 H3C N N O O N S CH PWT000149 PRESTWICK Prestw-149 Thioproperazine dimesylate N 3

CH3 S

OH OH HO O O HO

O

N Chiral O N O CH3 N O HHO H O N

CH3 N H N O O CH3 N N HHO H PWT000150 PRESTWICK Prestw-150 Dihydroergotamine tartrate O N CH3 H

N

O Chiral

H3C CH3 CH3 HO OH CH3 H3C OH O H C CH O 3 O N 3 CH OH CH 3O O 3

CH3 O CH PWT000151 PRESTWICK Prestw-151 3 O H3C CH3 OH

OH N Cl

PWT000152 PRESTWICK Prestw-1474 Chloroxine Cl

N Chiral N O

O N N PWT000153 PRESTWICK Prestw-153 Didanosine HO CH3 Chiral HO OH CH O 3 O N CH3

H3C O O O O O CH O 3 CH3 O PWT000154 PRESTWICK Prestw-154 Josamycin O CH3 O O H C CH 3 CH 3 3 H C OH 3

O Chiral

O CH3 H C O O 3 O CH OH CH 3 N O 3 CH3 OH HO H H O O O O CH PWT000155 PRESTWICK Prestw-155 Paclitaxel 3 O

CH O 3 Chiral

HO CH O 3 H3C O O

CH 3 CH3 O O H3C O

O CH3 H H3C CH O O 3 PWT000156 PRESTWICK Prestw-156 Ivermectin OH

O CH H 3 OH

I I I

CH3 CH3 + CH3 CH3 N CH3 + O N O O CH3

CH3 + PWT000157 PRESTWICK Prestw-157 Gallamine triethiodide N

CH3 CH3

O O S HO OH

NH2 Chiral

HO NH O HO 2 O OH O HO O O O NH2 OH H N PWT000158 PRESTWICK Prestw-158 Neomycin sulfate 2 OH HO H2N

NH2

HN NH2 H C N OH N 3 NHHO O O OH H2N N O OH OH O O O O O O O HO HO S S S CH3O HO OH HO OH HO OH

HN NH 2 Chiral H C N OH N 3 NHHO Prestw-159 Dihydrostreptomycin sulfate O O OH PWT000159 PRESTWICK H N 2 O N OH OH O HO HO

CH3O

O NH NH 2 Chiral 2 HO S OH O

NH NH O 2 2 O O H2N OH H O O CH O H2N 3 H2N OH H HO O O H C H C OH 3 N CH 3 3 N CH3 HO OH H3C NH2 NH2 N O CH3

O H2N OH O O Prestw-160 Gentamicine sulfate NH PWT000160 PRESTWICK 2

HO OH H3C N CH3 N NH N 2 PWT000161 PRESTWICK Prestw-161 Isoniazid O

N N N PWT000162 PRESTWICK Prestw-162 Pentylenetetrazole N

N Cl O PWT000163 PRESTWICK Prestw-163 O

O + N O OH N Cl N PWT000164 PRESTWICK Prestw-164 Ornidazole CH3

CH3 CH3

PWT000165 PRESTWICK Prestw-165 O O N

ClH

O PWT000166 PRESTWICK Prestw-166 Mafenide hydrochloride O S NH2 H2N

ClH

N F F NH PWT000167 PRESTWICK Prestw-167 hydrochloride 2 F O S O

O + O N N N N PWT000168 PRESTWICK Prestw-168 Nitrofurantoin O O

ClH

N PWT000169 PRESTWICK Prestw-169 Hydralazine hydrochloride N

H2N N

O O S HO OH

PWT000170 PRESTWICK Prestw-170 Phenelzine sulfate N

H2N

O Chiral NH2 PWT000171 PRESTWICK Prestw-171 Tranexamic acid HO

O CH3 N HO O N PWT000172 PRESTWICK Prestw-172 Etofylline N N CH3

ClH

PWT000173 PRESTWICK Prestw-173 Tranylcypromine hydrochloride

H2N

HO O OH OH O O OH

H3C PWT000174 PRESTWICK Prestw-174 citrate salt N OH O O O N PWT000175 PRESTWICK Prestw-175 Aceclofenac Cl Cl

HO OH P HO O

O

N CH PWT000176 PRESTWICK Prestw-176 Iproniazide phosphate N 3 N

CH3

N O N NH2 H C S PWT000177 PRESTWICK Prestw-177 Sulfamethoxazole 3 O O

HO O PWT000178 PRESTWICK Prestw-178 Mephenesin HO H3C

ClH

PWT000179 PRESTWICK Prestw-179 Phenformin hydrochloride HN N N NH NH2

CH3 F F N H3C F

O + O PWT000180 PRESTWICK Prestw-180 Flutamide N O

H3C CH N 3 N

PWT000181 PRESTWICK Prestw-181 Ampyrone NH2 O ClH S N Chiral

PWT000182 PRESTWICK Prestw-182 Levamisole hydrochloride N

ClH

PWT000183 PRESTWICK Prestw-183 Pargyline hydrochloride N HC CH3

NH2

O O O PWT000184 PRESTWICK Prestw-184 Methocarbamol OH O CH3

Chiral S O CH3 OH H2N N N N S O N O O O O PWT000185 PRESTWICK Prestw-185 Aztreonam H C 3 CH3OH

+ Na O Chiral O O CH N 3

Cl S CH3 N H PWT000186 PRESTWICK Prestw-186 Cloxacillin sodium salt O N

O CH3

O Chiral

O N CH N CH PWT000187 PRESTWICK Prestw-1812 3 3 O

O OH O OH O O HO HO OH O OH O

+ + PWT000188 PRESTWICK Prestw-188 Pentolinium bitartrate N N

CH3 CH3 N N N PWT000189 PRESTWICK Prestw-189 Aminopurine, 6-benzyl N N

CH3 H3C N N PWT000190 PRESTWICK Prestw-190 S O O O

ClH

H3C

O CH3 O O PWT000191 PRESTWICK Prestw-191 Midodrine hydrochloride N HO NH2

O

N O PWT000192 PRESTWICK Prestw-192 Thalidomide N O O

O OH

O O

O N PWT000193 PRESTWICK Prestw-193 Oxolinic acid

CH3

CH3 O S O N

+ O O N PWT000194 PRESTWICK Prestw-194 O

COOH CH3 COOH N

H H PWT000195 PRESTWICK Prestw-1231 maleate Cl O CH3 N O O N N CH PWT000196 PRESTWICK Prestw-196 Pentoxifylline N 3 H C 3 O

OH OH Chiral HO O OH OH O HO O HO OH O

OH OH PWT000197 PRESTWICK Prestw-197 Metaraminol bitartrate H N 2

CH3

OH

N CH HO 3

H3C CH PWT000198 PRESTWICK Prestw-198 Salbutamol 3 OH

CH3

ClH O N N CH CH3 PWT000199 PRESTWICK Prestw-199 hydrochloride 3

Chiral O N N O PWT000200 PRESTWICK Prestw-200 Camptothecine (S,+) OH O CH3

O + N ClH O CH3 N N

S PWT000201 PRESTWICK Prestw-201 hydrochloride O N H3C CH3

OH OH O I

I O PWT000202 PRESTWICK Prestw-202 Tiratricol, 3,3',5-triiodothyroacetic acid I HO O F F N F PWT000203 PRESTWICK Prestw-203

CH3

N

O PWT000204 PRESTWICK Prestw-204 Flumequine F O OH

O CH3 Cl N OH PWT000205 PRESTWICK Prestw-205

+ OH2 Na

O O Cl H C N PWT000206 PRESTWICK Prestw-206 sodium salt monohydrate 3 Cl

OH CHChiral CH3

H PWT000207 PRESTWICK Prestw-1181 H H

O CH3

H3C O CH3 H N N 2 O N PWT000208 PRESTWICK Prestw-208 Trimethoprim O NH2 CH3

CH3

H3C N

ClH O N

O CH PWT000209 PRESTWICK Prestw-209 monohydrochloride 3 Cl

NH2

S N O

CH3 N N O S N O

CH3 N N O PWT000210 PRESTWICK Prestw-210 Fenbendazole

N

OH N

O PWT000211 PRESTWICK Prestw-211 Piroxicam N S CH3 O O

OH O

HO OH

O OH

N

N PWT000212 PRESTWICK Prestw-212 Pyrantel tartrate CH 3

S

ClH

N

O O N PWT000213 PRESTWICK Prestw-213 Fenspiride hydrochloride

CH3

O

CH3 O H C PWT000214 PRESTWICK Prestw-214 Gemfibrozil 3 OH CH3

ClH

CH3 O H3C CH3 N PWT000215 PRESTWICK Prestw-215 Mefexamide hydrochloride O N O

ClH

CH3

N CH3

CH N O 3 S O PWT000216 PRESTWICK Prestw-216 Tiapride hydrochloride O O

CH3 N N O N H C PWT000217 PRESTWICK Prestw-217 Mebendazole 3 O O

HO O

PWT000218 PRESTWICK Prestw-218 Fenbufen O

OH

O

PWT000219 PRESTWICK Prestw-219 Ketoprofen CH 3 O

N CH3 N O

Prestw-220 O PWT000220 PRESTWICK S NH2 Cl O

CH3 N N N

O PWT000221 PRESTWICK Prestw-221 Norfloxacin F O OH

O O O CH O CH N 3 3 H N O CH OH O 3 H C PWT000222 PRESTWICK Prestw-222 Antimycin A 3 O

O CH3

ClH

CH3 H3C

CH3 H3C PWT000223 PRESTWICK Prestw-223 Xylometazoline hydrochloride N N CH3 ClH

CH3 CH3 H3C N H C Prestw-224 Oxymetazoline hydrochloride 3 N PWT000224 PRESTWICK HO

CH3

N

N O O N H C PWT000225 PRESTWICK Prestw-225 Nifenazone 3 N

CH3

H C Chiral 3 Cl O O O CH3 O PWT000226 PRESTWICK Prestw-226 Griseofulvin CHO3 O CH3

ClH

N N

N PWT000227 PRESTWICK Prestw-227 hydrochloride

Cl

O

N N

PWT000228 PRESTWICK Prestw-228 H3C OH

ClH

PWT000229 PRESTWICK Prestw-229 hydrochloride N CH3 O

HO

N ClH N N PWT000230 PRESTWICK Prestw-230 Phentolamine hydrochloride

CH3 O CH N 3 H C PWT000231 PRESTWICK Prestw-231 Etodolac 3 O HO

BrH

Chiral CH3 O + N H H

O O H H PWT000232 PRESTWICK Prestw-232 Scopolamin-N-oxide hydrobromide O

OH

Chiral CH3 N H

HO H PWT000233 PRESTWICK Prestw-233 (L) O O

Cl O

H N O O PWT000234 PRESTWICK Prestw-234 Chlorphensin carbamate 2 OH

H3C

F N N O PWT000235 PRESTWICK Prestw-1771 Carmofur O N O

ClH ClH

O O CH CH N 3 O 3 O O

O N CH3 H C PWT000236 PRESTWICK Prestw-236 Dilazep dihydrochloride 3 O CH O 3 H C O 3 O

O O F OH

N N PWT000237 PRESTWICK Prestw-237 Ofloxacin N O H3C CH3 ClH

O O F OH

H3C PWT000238 PRESTWICK Prestw-238 Lomefloxacin hydrochloride N N N F H3C

ClH

H3C N O

H3C CH PWT000239 PRESTWICK Prestw-239 hydrochloride 3

H3C

CH3 N O

O OH N O PWT000240 PRESTWICK Prestw-240

ClH

CH 3 NH2 O CH PWT000241 PRESTWICK Prestw-241 hydrochloride 3

CH3

ClH N

O O PWT000242 PRESTWICK Prestw-242 hydrochloride O CH3 O

N HO O O CH PWT000243 PRESTWICK Prestw-243 Bufexamac 3

H3C

PWT000244 PRESTWICK Prestw-244 Glutethimide, para-amino NH2 O N O N N OH PWT000245 PRESTWICK Prestw-245 Dropropizine (R,S) HO

N

N CH3 CH N N 3

H3C CH PWT000246 PRESTWICK Prestw-246 3 N

CH3 O O

N N PWT000247 PRESTWICK Prestw-247 Albendazole H C N 3 S

ClH

N

N N PWT000248 PRESTWICK Prestw-248 Clonidine hydrochloride Cl Cl

ClH

O

Cl N CH3 PWT000249 PRESTWICK Prestw-249 Bupropion hydrochloride H C CH3 CH33

ClH

CH2

H3C

CH3 N PWT000250 PRESTWICK Prestw-250 Alprenolol hydrochloride O

OH

N Cl O N S Prestw-251 S O PWT000251 PRESTWICK O O H2N ClH

HO PWT000252 PRESTWICK Prestw-252 Diphenidol hydrochloride N

HC Chiral

CH3 OH

H H PWT000253 PRESTWICK Prestw-253 Norethindrone HH O

ClH

PWT000254 PRESTWICK Prestw-254 hydrochloride CH N 3

O

OH

N N

PWT000255 PRESTWICK Prestw-255 F F F

O OH H3C

PWT000256 PRESTWICK Prestw-256 Isotretinoin CH 3 CH H C 3 3 CH3

CH3 CH3 OH H3C CH3

O PWT000257 PRESTWICK Prestw-257 Retinoic acid CH3

ClH

N PWT000258 PRESTWICK Prestw-258 hydrochloride N N O H2C CH3

HO O PWT000259 PRESTWICK Prestw-259 Ethacrynic acid O Cl Cl

O

N

N PWT000260 PRESTWICK Prestw-260 Praziquantel O

OH Chiral CH 3 CH

CH3 H PWT000261 PRESTWICK Prestw-261 H H O

ClH

CH3

PWT000262 PRESTWICK Prestw-262 hydrochloride N N

ClH

CH3 N H3C PWT000263 PRESTWICK Prestw-263 hydrochloride

O

ClH

O

N PWT000264 PRESTWICK Prestw-264 Dyclonine hydrochloride H C 3 O

O

H3C N N Cl O N N

CH3

Prestw-265 CH PWT000265 PRESTWICK 3 O N

CH3 H2N O N

CH3

N CH PWT000266 PRESTWICK Prestw-266 3

H3C CH3

PWT000267 PRESTWICK Prestw-267 Clotrimazole Cl N N

Chiral

H N N

H3C O PWT000268 PRESTWICK Prestw-268 Vinpocetine O CH3

ClH

N Cl Prestw-269 hydrochloride PWT000269 PRESTWICK CH N 3

CH3

ClH

N CH PWT000270 PRESTWICK Prestw-270 hydrochloride 3

Chiral

H N

N O

PWT000271 PRESTWICK Prestw-271 Vincamine CH O OH 3 H3C

O

H3C HO O

H3C N PWT000272 PRESTWICK Prestw-272 Indomethacin Cl O HO Chiral

O CH O 3 OH

CH3 H

PWT000273 PRESTWICK Prestw-273 Cortisone H H O

OHChiral O CH OH HO 3

CH3 H

PWT000274 PRESTWICK Prestw-274 Prednisolone H H O

H C CH O 3 3 O O

CH PWT000275 PRESTWICK Prestw-275 Fenofibrate Cl O 3 CH3

O OH CH3

O N S NH2 PWT000276 PRESTWICK Prestw-276 O O

ClH

O H2N H3C HO PWT000277 PRESTWICK Prestw-277 Labetalol hydrochloride N OH

N PWT000278 PRESTWICK Prestw-278 N

Chiral O OH CH OH HO 3

CH3 H

H H PWT000279 PRESTWICK Prestw-279 Methylprednisolone, 6-alpha O

CH3 OH 2 ClH

CH2Chiral

H

N HO H PWT000280 PRESTWICK Prestw-280 hydrochloride monohydrate O H3C

N

O Chiral

CH O 3

O CH OH HO 3 CH H PWT000281 PRESTWICK Prestw-281 Fludrocortisone acetate 3 F H O

BrH

OH

OH PWT000282 PRESTWICK Prestw-282 Fenoterol hydrobromide HO N CH3

OH

ClH ClH

Cl

CH3 N N PWT000283 PRESTWICK Prestw-283 dihydrochloride

HO O OH OH O O OH

O

N N PWT000284 PRESTWICK Prestw-284 Diethylcarbamazine citrate H C 3 N CH3

H3C

H3C OHChiral

CH3 O

CH3 H PWT000285 PRESTWICK Prestw-285 Chenodiol H H HO OH H

O HO O HO

N PWT000286 PRESTWICK Prestw-286 maleate ClH

CH3 O N

HO CH3 PWT000287 PRESTWICK Prestw-287 chloride O

O

N N N F PWT000288 PRESTWICK Prestw-288 Spiperone O

HO O O HO

N N H C PWT000289 PRESTWICK Prestw-289 Pyrilamine maleate 3 O N H3C CH3

O O

N S N O PWT000290 PRESTWICK Prestw-290 Sulfinpyrazone

+ Na

O + O N N O O PWT000291 PRESTWICK Prestw-291 Dantrolene sodium salt N N O

ClH

N N N

O N PWT000292 PRESTWICK Prestw-292 hydrochloride N Cl

O OH

ClH O OH N PWT000293 PRESTWICK Prestw-293 Glafenine hydrochloride N Cl O

OH O

CH3 OH N PWT000294 PRESTWICK Prestw-294 maleate

S

O O S OH

CH3 CH3 Chiral S

H N CH3 PWT000295 PRESTWICK Prestw-295 Pergolide mesylate H

N

O

H3C O O HO H3C O N PWT000296 PRESTWICK Prestw-296 Acemetacin Cl O

ClH

N PWT000297 PRESTWICK Prestw-297 hydrochloride N H C O 3 N CH3

Cl ClH

O O

N

N

PWT000298 PRESTWICK Prestw-298 Fipexide hydrochloride O

O

CH3 Chiral N CH OH 3 H3C H CH3

H

PWT000299 PRESTWICK Prestw-299 H O

ClH

N

O O O O N

PWT000300 PRESTWICK Prestw-300 Diperodon hydrochloride N OH2 OH2

Chiral OH N N O PWT000301 PRESTWICK Prestw-301 Lisinopril O NH HO O 2

ClH

HO CH Chiral O 3 H3C CH3 N O S N PWT000302 PRESTWICK Prestw-302 Lincomycin hydrochloride HO OH OH H3C

ClH ClH

O CH3 N N CH3 S N PWT000303 PRESTWICK Prestw-303 dihydrochloride N O

O + O N OH N N

PWT000304 PRESTWICK Prestw-304 Econazole nitrate O Cl Cl Cl

ClH

O N CH3 PWT000305 PRESTWICK Prestw-305 hydrochloride N

H3C H3C

Cl Chiral

O

OH CH3 HO O Prestw-306 fumarate O PWT000306 PRESTWICK N

H3C

OH2 OH2

Chiral H3C CH3 H C OH OH N 3 H H OH PWT000307 PRESTWICK Prestw-307 Oxytetracycline dihydrate O OH OH O OH O NH2 F

O N N PWT000308 PRESTWICK Prestw-308 N F

ClH OH2

ClH OH2

Cl N CH3

H3C N PWT000309 PRESTWICK Prestw-309 Amodiaquin dihydrochloride dihydrate N

OH

ClH CH O 3

H C O 3 N O

H C CH3 PWT000310 PRESTWICK Prestw-310 hydrochloride 3 O O H3C

OH OH O O OH OH

OH HO N

PWT000311 PRESTWICK Prestw-311 tartrate H3C

ClH ClH F

N N PWT000312 PRESTWICK Prestw-312 dihydrochloride

F

ClH ClH

F F

F S

H C N PWT000313 PRESTWICK Prestw-313 dihydrochloride 3 N N

O O HO OH

Chiral

O N N Prestw-314 Enalapril maleate CH PWT000314 PRESTWICK 3 O O HO

O H3C ClH

OH Chiral O OH O NH OH 2

O

H OH PWT000315 PRESTWICK Prestw-315 Minocycline hydrochloride N H H3C CH N 3 H C 3 CH3

Cl O O N O N PWT000316 PRESTWICK Prestw-316 O S N

H3C O

N N NH

OH H2N O S O OH N PWT000317 PRESTWICK Prestw-317 Guanethidine sulfate N NH

H2N

OH2 ClH ClH OH2

Cl CH N N 3

CH CH PWT000318 PRESTWICK Prestw-318 Quinacrine dihydrochloride hydrate N 3 3 O

CH3

O

H3C S O O

CH3

+ N Cl H C PWT000319 PRESTWICK Prestw-319 Clofilium tosylate 3

CH3

ClH ClH

F F F S HO N PWT000320 PRESTWICK Prestw-320 dihydrochloride N N

O O O O O O S S S HO OH HO OH HO OH

HO OH Chiral NH2 HN HO OH NH2 N NHHO N HN OH H N H C O 2 3 NHHO N N N O O H C O OH H2N 3 N O O HO OH O O PWT000321 PRESTWICK Prestw-321 Streptomycin sulfate OH HO OH O O CH3 OH

CH3 ClH

NH2 O H3C N O H C O PWT000322 PRESTWICK Prestw-322 Alfuzosin hydrochloride 3 O N N N

CH3

O N N H3C S O O PWT000323 PRESTWICK Prestw-323 Cl

H C ClH 3

NH2 HO

PWT000324 PRESTWICK Prestw-324 Phenylpropanolamine hydrochloride

HO Chiral

O O HO PWT000325 PRESTWICK Prestw-325 Ascorbic acid HO OH

O Chiral

NH2

HO CH3

PWT000326 PRESTWICK Prestw-326 Methyldopa (L,-) HO OH

OH2 OH2

H3C H C 3 N N O H S N H S O N N N N N N O O O OH PWT000327 PRESTWICK Prestw-327 Cefoperazone dihydrate O

OH

N Cl H2N PWT000328 PRESTWICK Prestw-328 O ClH

N PWT000329 PRESTWICK Prestw-329 Tacrine hydrochloride

NH2

OH

H3C N O CH3 O CH3 O O CH O 3 HO OH OHHC N O CH PWT000330 PRESTWICK Prestw-330 Bisoprolol fumarate 3 3 O CH3 O CH3

Chiral

O

H3C N HO N O H3C N O O CH PWT000331 PRESTWICK Prestw-1813 Lopinavir N 3

H3C

OH

O N CH3 CH PWT000332 PRESTWICK Prestw-332 Practolol 3 CH3 O N

OH Chiral

O CH3 N N O + N PWT000333 PRESTWICK Prestw-333 Zidovudine, AZT N O N

CH3

NH2 H3C N N O S PWT000334 PRESTWICK Prestw-334 Sulfisoxazole O O

O

N N N N N

O PWT000335 PRESTWICK Prestw-335 Zaprinast

CH3 O CH N 3

S PWT000336 PRESTWICK Prestw-336 Chlormezanone O O Cl

ClH

O CH PWT000337 PRESTWICK Prestw-337 hydrochloride 3 N N H N 2 CH3

OH Chiral N O N N CH3 PWT000338 PRESTWICK Prestw-338 N6-methyladenosine N N HO OH

ClH

Cl

N NH2 PWT000339 PRESTWICK Prestw-339 Guanfacine hydrochloride O NH Cl

O N

N Cl

N PWT000340 PRESTWICK Prestw-340 N N O

O OH O N

O PWT000341 PRESTWICK Prestw-341 S H N 2 O Cl

ClH

CH3

H3C N

PWT000342 PRESTWICK Prestw-342 hydrochloride S N N ClH

N PWT000343 PRESTWICK Prestw-343 hydrochloride N

CH3

ClH

Cl

CH3 O PWT000344 PRESTWICK Prestw-344 Clorgyline hydrochloride N CH Cl

CH3 H3C N ClH H3C HO

PWT000345 PRESTWICK Prestw-345 Clenbuterol hydrochloride Cl Cl

NH2

ClH

H

PWT000346 PRESTWICK Prestw-346 hydrochloride CH N 3

HO N Chiral O N SH

N N PWT000347 PRESTWICK Prestw-347 Thioguanosine HO OH NH2

ClH

CH3 N H3C

PWT000348 PRESTWICK Prestw-348 hydrochloride Cl

S

ClH

H3C N

PWT000349 PRESTWICK Prestw-349 Ritodrine hydrochloride OH OH

HO CH3 N

N

N

PWT000350 PRESTWICK Prestw-350 Cl N

O

N

HO Cl

PWT000351 PRESTWICK Prestw-351 Chlorthalidone O S O

NH2

ClH

OH

HO N PWT000352 PRESTWICK Prestw-352 Dobutamine hydrochloride CH HO 3

Cl

O Prestw-353 Moclobemide PWT000353 PRESTWICK N O N

H C O 3 O O S N H2N N PWT000354 PRESTWICK Prestw-354 CH Cl 3

H3C

N CH3 O N

PWT000355 PRESTWICK Prestw-355 Hycanthone S

OH

OH2

NH Chiral N 2

HO N N O P O O N PWT000356 PRESTWICK Prestw-356 Adenosine 5'-monophosphate monohydrate OH OH HO OH Chiral

H2N O

N S CH3 Prestw-357 Amoxicillin N CH PWT000357 PRESTWICK 3 O OH O

O N N N N N

N + PWT000358 PRESTWICK Prestw-1603 Pemirolast potassium K CH3

BrH OH2

Chiral H3C O

H C PWT000359 PRESTWICK Prestw-359 hydrobromide monohydrate 3 N H

N O

N

N O PWT000360 PRESTWICK Prestw-360

F

ClH

CH3 CH3 N O O N H C 3 CH3 O O

PWT000361 PRESTWICK Prestw-361 Bambuterol hydrochloride HO N CH3

H C 3 CH3

HO Chiral

O HO CH3 OH

H C F H 3 CH3 PWT000362 PRESTWICK Prestw-362 Betamethasone H O

Chiral H3C O H3C O O O H3C

O N PWT000363 PRESTWICK Prestw-363 Colchicine H3C O H3C Chiral

N O

O H N CH3 PWT000364 PRESTWICK Prestw-364 Metergoline H N H3C

O O H3C S S O O N S

O NH2 PWT000365 PRESTWICK Prestw-365 Brinzolamide N CH3

HO

ClH

N NH2 PWT000366 PRESTWICK Prestw-366 Ambroxol hydrochloride Br

Br

O F F N O F CH PWT000367 PRESTWICK Prestw-367 Benfluorex 3

ClH

CH3 N O N H C PWT000368 PRESTWICK Prestw-368 hydrochloride 3

O O

S CH3 N N N S PWT000369 PRESTWICK Prestw-369 Meloxicam CH OH O 3

Br

O OH

Br PWT000370 PRESTWICK Prestw-370 Benzbromarone

O CH3 O OH

HO O

O PWT000371 PRESTWICK Prestw-371 fumarate S N

H3C

NH

N NH2

O O S OH HO NH PWT000372 PRESTWICK Prestw-372 Debrisoquin sulfate N NH2

N N H2N CH3

N N OH N N NH2 O PWT000373 PRESTWICK Prestw-373 Amethopterin (R,S) O O OH

CH3 Chiral

HO O OH O O N OH

N CH3 PWT000374 PRESTWICK Prestw-374 Methylergometrine maleate H

N

O

HO HO

O H3C N

N

PWT000375 PRESTWICK Prestw-375 Methiothepin maleate H C 3 S S

Cl

N N

N N

H C CH PWT000376 PRESTWICK Prestw-376 Clofazimine 3 3

Cl

CH3

N HO O H3C

O OH O O

O PWT000377 PRESTWICK Prestw-377 Nafronyl oxalate

N CH3 O Cl O O OH CH3 N CH3 O Cl O O OH CH3 PWT000378 PRESTWICK Prestw-378 Bezafibrate

ClH

H3C N N Cl N N N PWT000379 PRESTWICK Prestw-1152 hydrochloride O O

HO

O HO O

Cl N N

H2N PWT000380 PRESTWICK Prestw-380 maleate O O

H3C

F

H3C O F CH PWT000381 PRESTWICK Prestw-381 N 3 N N

ClH

O

H3C PWT000382 PRESTWICK Prestw-382 hydrochloride O H C N 3 OH

ClH

H3C N CH3

O O N H3C

O O CH3 PWT000383 PRESTWICK Prestw-383 hydrochloride + O N O

CH3 S S

CH3 CH3 CH3 H3C CH3

CH3 CH3 HC3CH3 PWT000384 PRESTWICK Prestw-384 Probucol HO OH H3C CH3 CH3C ClH ClH

N OH O N OH PWT000385 PRESTWICK Prestw-385 Mitoxantrone dihydrochloride OH O N OH N

ClH ClH

N N O F PWT000386 PRESTWICK Prestw-386 GBR 12909 dihydrochloride

F

OH O HO O H C 3 OH N HO O

O CH3

PWT000387 PRESTWICK Prestw-387 Carbetapentane citrate O O

Cl Cl

CH3 H2N + + PWT000388 PRESTWICK Prestw-388 Dequalinium dichloride N N NH2 H3C

N

N O O H C 3 N N O Cl O PWT000389 PRESTWICK Prestw-389

Cl

H3C Chiral CH3

+ Na O

H HO O CH CH3 3 O

CH3 CH PWT000390 PRESTWICK Prestw-390 Fusidic acid sodium salt H 3 O HO

CH3

CH3

OHH3C CH3 HO N

CH3 OHHC CH OH 3 3 HO N PWT000391 PRESTWICK Prestw-391 Terbutaline hemisulfate O HO S OH

O OH O OH OH OH2 HO N O OH O

N

O N O PWT000392 PRESTWICK Prestw-392 tartrate hydrate

F

Br Br

OH H3C CH O + 3 N

PWT000393 PRESTWICK Prestw-393 Hemicholinium bromide + N O H3C CH3 HO

O O S HO OH

OH Chiral

HO H N NH O 2 H2 O OH

H2N O O OH PWT000394 PRESTWICK Prestw-394 Kanamycin A sulfate OH OH O

H2N

HO NH2 Chiral

H N HO O 2 O NH HO O N 2 OH HO O O OH OH PWT000395 PRESTWICK Prestw-395 Amikacin hydrate 2 2 OH HO

HO NH2

OH Chiral O O H3C CH3

O H O O O H O O PWT000396 PRESTWICK Prestw-396 Etoposide O

H3C O OH OH

HO O

OH OH O O OH

O N Cl CH3

PWT000397 PRESTWICK Prestw-397 Clomiphene citrate (Z,E) CH 3

O

OH

OH OH OH

OH OH CH3 O N

N CH PWT000398 PRESTWICK Prestw-398 Oxantel pamoate 3 N

N O OH O OH O O

OH OH H3C N N

PWT000399 PRESTWICK Prestw-399 dimaleate N Cl

S

OH Chiral HO CH3

O HO O

HO OH O O CH3 HO O O PWT000400 PRESTWICK Prestw-400 Hesperidin OH

OH O

O Chiral H3C O CH3

CH3 H

PWT000401 PRESTWICK Prestw-401 Testosterone propionate H H O

Cl

I Cl O PWT000402 PRESTWICK Prestw-1269 Haloprogin Cl

I Chiral HO O H2N I OH I PWT000403 PRESTWICK Prestw-403 Thyroxine (L) O I

CH3 O O

O CH PWT000404 PRESTWICK Prestw-1288 Idebenone 3 CH3 O HO

H C CH Chiral O 3 3 O OH O N CH3 HO N CH3 H3C CH3 CH3

H3C N N O N PWT000405 PRESTWICK Prestw-405 Pepstatin A O

CH3 O OH H3C CH3 CH3

H3C N N

N

O N N PWT000406 PRESTWICK Prestw-1796 Delavirdine S H C 3 O O N

HO O

NH2 NH2 O OH H H H PWT000407 PRESTWICK Prestw-407 Adamantamine fumarate H H H

O + N HO O

N N Cl

PWT000408 PRESTWICK Prestw-408 Butoconazole nitrate S Cl Cl

O ClH

CH O 3 I

CH3

PWT000409 PRESTWICK Prestw-409 hydrochloride O N I H3C

OH O Chiral

OH OH OH OH OH

O OH H OH O O O CH OH H C 3 O PWT000410 PRESTWICK Prestw-410 Amphotericin B 3 HO H3C NH2

CH3 OH

O Chiral CH3

CH3 H

H H PWT000411 PRESTWICK Prestw-411 Androsterone HO H

OH O P OH S N PWT000412 PRESTWICK Prestw-1489 Amifostine H2N OH NH2 O As O PWT000413 PRESTWICK Prestw-413 Carbarsone N OH

Cl O O

H3C O O CH3

H3C N PWT000414 PRESTWICK Prestw-1219 O

NH2

O NH2 S O

PWT000415 PRESTWICK Prestw-1147 Modafinil

ClH

O H H N S CH3 NH CH 2 N 3 O O O PWT000416 PRESTWICK Prestw-416 Bacampicillin hydrochloride O O O H C 3 CH3

NH2

N

O N PWT000417 PRESTWICK Prestw-1298 Lamivudine O S OH

HO Chiral O

H N PWT000418 PRESTWICK Prestw-418 Biotin O S N H

N

O CH PWT000419 PRESTWICK Prestw-419 Bisacodyl 3 O O CH3 O N HC O CH3 Prestw-1242 Erlotinib N O PWT000420 PRESTWICK O N O CH3

H3C CH3Chiral

S CH3

H C N PWT000421 PRESTWICK Prestw-421 Suloctidil 3 OH

H3C N CH3

O

PWT000422 PRESTWICK Prestw-1368 Cl S

O

H3C O N

O O CH CH3HC 3 PWT000423 PRESTWICK Prestw-423 Carisoprodol 3

NH2

HO Chiral O O CH3 N O PWT000424 PRESTWICK Prestw-424 Cephalosporanic acid, 7-amino O H2N H S

+ + + + Na Na Na Na

O O O O NH O S 2 S OH O N N N N O HO PWT000425 PRESTWICK Prestw-425 Chicago sky blue 6B O S O O H N S O H C 2 O 3 O O CH3

ClH

O N CH3 O O H C PWT000426 PRESTWICK Prestw-426 Buflomedil hydrochloride 3 O CH3 ClH

CH3 N O H3C N Prestw-1393 Dibenzepine hydrochloride PWT000427 PRESTWICK N

CH3

ClH

O H3C O N PWT000428 PRESTWICK Prestw-428 hydrochloride N O O

ClH

N O Chiral

N O O N H3C N O PWT000429 PRESTWICK Prestw-1505 Valacyclovir hydrochloride NH H3C 2 NH2

CH3

CH O NH2 O 3 N Cl N O

PWT000430 PRESTWICK Prestw-430 O

F

CH3

H C N N 3 N

O PWT000431 PRESTWICK Prestw-1303 Pefloxacine F O OH

OHChiral O

CH3 HO

CH3 H

PWT000432 PRESTWICK Prestw-432 Corticosterone H H O

H N O NH 2 O 2 Chiral NH2 H C CH3 3 O O H3C H N N 2 N N H C + O 3 Co H N N CH H2N 3

CH3 CH3 CH3 O NH N O 2 OH CH H3C 3 Prestw-433 Cyanocobalamin CH PWT000433 PRESTWICK 3 O O O P O O N OH N NH2 Chiral H N S HO O N CH PWT000434 PRESTWICK Prestw-434 Cefadroxil O 3 HO O

H C 3 Chiral

CH3 HO H C CH O CH O 3 3 H 3

H3C N N CH3 N N N

H C O CH3 O 3 O H C CH H C 3 3 CH 3 3 O CH N O 3 CH H C H C 3 3 3 O O N CH3 PWT000435 PRESTWICK Prestw-435 Cyclosporin A N N H3C N N CH3 O CH3 O CH3 H3C CH3

O OChiral

CH3

H3C H PWT000436 PRESTWICK Prestw-436 Digitoxigenin H OH HO H

O O Chiral

OH CH3

H CH3

H OH O H O

OH OH H3C PWT000437 PRESTWICK Prestw-437 Digoxin O OH OH O O O CH3

CH3

ClH

O OH Chiral OH OH

O O O OH H C 3 O H C O PWT000438 PRESTWICK Prestw-438 Doxorubicin hydrochloride 3 HO

NH2

H C 3 O N N CH3 PWT000439 PRESTWICK Prestw-439 Carbimazole O S

O Chiral CH3

CH3 H PWT000440 PRESTWICK Prestw-440 Epiandrosterone H H HO H OHChiral CH3

H

PWT000441 PRESTWICK Prestw-441 -17 beta H H HO

ClH Cl

CH3 CH3 N PWT000442 PRESTWICK Prestw-1380 Clobutinol hydrochloride H3C

H3C OH

ClH

F

F O Prestw-1814 Nebivolol hydrochloride PWT000443 PRESTWICK N O OH OH

O

N PWT000444 PRESTWICK Prestw-1156

O NH2

ClH

PWT000445 PRESTWICK Prestw-445 hydrochloride CH N 3

CH3

ClH

N O

OH H C N O PWT000446 PRESTWICK Prestw-446 Carteolol hydrochloride 3 H3C CH3

HO Chiral

O CH HO 3 OH H CH3 PWT000447 PRESTWICK Prestw-447 Hydrocortisone base H H O HO O 2+ O OH Chiral OCa OH O HO F F

N PWT000448 PRESTWICK Prestw-1815 Pitavastatin calcium N

OHChiral + O N O

CH3 N H C PWT000449 PRESTWICK Prestw-449 nitrate 3 N O O

+ Na OH2

Chiral Cl

N O Cl N S H3C CH3 O PWT000450 PRESTWICK Prestw-450 Dicloxacillin sodium salt hydrate N CH 3 O O O

H2C N N N N

ClH N Prestw-451 hydrochloride PWT000451 PRESTWICK O O CH3

HO Chiral CH3 CH3

CH3 H

H H PWT000452 PRESTWICK Prestw-1161 Stanozolol N N H

H C H C 3 3 OH H

PWT000453 PRESTWICK Prestw-1257 Calcipotriene H2C OH OH

O Chiral O

N N CH3

O PWT000454 PRESTWICK Prestw-1429 Linezolid N O F OH O S O

O S O CH3 CH3 N OH N PWT000455 PRESTWICK Prestw-455 Mebhydroline 1,5-naphtalenedisulfonate N N

O OH

HO

O S OH O

CH H C 3 Chiral Cl CH OH3 N 2 H PWT000456 PRESTWICK Prestw-456 Meclocycline sulfosalicylate OH NH2 OH OH O OH O O

ClH ClH

Cl

N CH N 3 PWT000457 PRESTWICK Prestw-457 Meclozine dihydrochloride

N

H3C N PWT000458 PRESTWICK Prestw-458 Melatonin O O CH3

H C 2 O

N H3C PWT000459 PRESTWICK Prestw-1251 Butalbital H C 3 O N O

NH2 HO OH O CH3 OH Chiral

O

OH PWT000460 PRESTWICK Prestw-460 Dinoprost trometamol HO

HO CH3

H N H3C ClH

O H O PWT000461 PRESTWICK Prestw-461 Tropisetron hydrochloride N Chiral NH2 O HO CH2 S N O N N S H H N O O PWT000462 PRESTWICK Prestw-462 Cefixime OH

O

Chiral O CH3 HO OH N I

H3C N I O OH O HO PWT000463 PRESTWICK Prestw-463 Metrizamide N I CH3 O

O OH HO O

OH O OH O N N N PWT000464 PRESTWICK Prestw-1323 hemifumarate N N N S S

ClH

F

H2N F PWT000465 PRESTWICK Prestw-1464 Tosufloxacin hydrochloride N N N O F O OH

Chiral

F F F Cl PWT000466 PRESTWICK Prestw-1400 Efavirenz O N O

OH Chiral

CH3 H3C

O H3C O CH3 OH OH OH N H C CH 3 H3C O 3 N O N O OH PWT000467 PRESTWICK Prestw-1157 Rifapentine CH O N 3 O CH3

Br

O CH H C + 3 PWT000468 PRESTWICK Prestw-468 Neostigmine bromide 3 N O N CH3 H3C CH3 O O N + N S N PWT000469 PRESTWICK Prestw-469 Niridazole O N

O Chiral O H H S OH N N S N O N PWT000470 PRESTWICK Prestw-470 Ceforanide NH2 N N HO O

Cl

N

N N PWT000471 PRESTWICK Prestw-1358 Vatalanib N

O CH N 3

O N CH3

H3C PWT000472 PRESTWICK Prestw-1295 O O CH3

OH3C Chiral O H S O S CH N 3 N S N H N S 2 O N PWT000473 PRESTWICK Prestw-473 Cefotetan N N HO O HO O

N Cl S PWT000474 PRESTWICK Prestw-1254 Fentiazac HO O

O O

OH OH

Br PWT000475 PRESTWICK Prestw-475 maleate N N H3C CH3 HO OH HO OH P P HO O HO O

CH O 3

CH3 NH PWT000476 PRESTWICK Prestw-476 Primaquine diphosphate N 2 N

Chiral H3C O CH3 CH3 H O H PWT000477 PRESTWICK Prestw-477 H

CH3

O

O CH3

N PWT000478 PRESTWICK Prestw-478 Cl ClO CH3

H3C O

Cl Chiral OH

N Cl N PWT000479 PRESTWICK Prestw-1325 Raclopride O O H3C H3C

I OH

N Cl Cl I O H C PWT000480 PRESTWICK Prestw-1385 Closantel 3

N

ClH

OH

H2N PWT000481 PRESTWICK Prestw-481 Serotonin hydrochloride

N

ClH

S O H2N H H CH N S 3 N N ClH N S N CH3 PWT000482 PRESTWICK Prestw-482 Cefotiam hydrochloride O N N N HO O O

O

PWT000483 PRESTWICK Prestw-1336 Rofecoxib H3C S O O

O F

N N PWT000484 PRESTWICK Prestw-484 Benperidol N O

Chiral

N S H2N O N PWT000485 PRESTWICK Prestw-485 Cefaclor hydrate O Cl

OH2 HO O

O HO S OH O

CH3 Chiral

H3C H2N O OH C CH3 N 3 N N O O H2N N N O NH2 H2N N O N O O N N Prestw-486 Colistin sulfate CH PWT000486 PRESTWICK 3 N O HO N H C O H 3 O H C NH 3 OH 2 H3C

ClH

O OH O

CH3 OH

O O O OH H NH H3C 2 PWT000487 PRESTWICK Prestw-487 Daunorubicin hydrochloride O OH

H3C

ClH

S

CH PWT000488 PRESTWICK Prestw-488 hydrochloride N 3

CH3

OH 2 OH2

OH OH2 2 OH2

O O Chiral

O + N N NH O 2 N S N S H PWT000489 PRESTWICK Prestw-489 Ceftazidime pentahydrate N O HO CH CH 3 O 3 O HO S OH O

N NH PWT000490 PRESTWICK Prestw-490 Iobenguane sulfate I

NH2

ClH

N CH3 PWT000491 PRESTWICK Prestw-491 hydrochloride S

O + O N O N N PWT000492 PRESTWICK Prestw-492 Nitrofural O NH2

N O S N H3C CH O N 3

O PWT000493 PRESTWICK Prestw-493 Omeprazole H3C H3C

S N CH N 3 PWT000494 PRESTWICK Prestw-494 Propylthiouracil O

Cl

Cl CH3 N O N CH3 O PWT000495 PRESTWICK Prestw-495 Terconazole N O N N

O CH3 S COOH PWT000496 PRESTWICK Prestw-496 Tiaprofenic acid ClH CH 3 Chiral H H3C O N H C OH 3 NH2 HO Cl N CH3

H C O O O N O 3 H HO O O

O N HO O O NH2 Cl H HO N O H O

N HO O OH OH PWT000497 PRESTWICK Prestw-497 Vancomycin hydrochloride H OH O N

OH

Chiral CH3 H O O O O CH H H 3 PWT000498 PRESTWICK Prestw-498 Artemisinin O CH3

ClH

O OH O N PWT000499 PRESTWICK Prestw-499 hydrochloride CH 3

OH H3C

H C N 3 O PWT000500 PRESTWICK Prestw-500 Ethamivan O CH3

ClH

O

H C OH PWT000501 PRESTWICK Prestw-501 Vigabatrin hydrochloride 2

NH2

ClH

H

N HO PWT000502 PRESTWICK Prestw-502 hydrochloride H

ClH ClH O Cl O N OH N PWT000503 PRESTWICK Prestw-503 dihydrochloride OH

O O N OH

O N

PWT000504 PRESTWICK Prestw-504 Etifenin H C CH 3 3

OH HO N CH3

CH3 O O OH S HO OH OH HO N CH PWT000505 PRESTWICK Prestw-505 Metaproterenol sulfate, orciprenaline sulfate 3

CH3 OH

O O Chiral S HO OH

NH HO 2

H2N H C O NH2 3 O N Prestw-506 Sisomicin sulfate O PWT000506 PRESTWICK O CH3 OH OH NH2

ClH

CH PWT000507 PRESTWICK Prestw-1159 Sibutramine hydrochloride 3 N CH3 Cl H3C CH3

O + O O N O

OH CH PWT000508 PRESTWICK Prestw-110 Acenocoumarol 3 O

HO N

PWT000509 PRESTWICK Prestw-509 Bromperidol Br F O

ClH

N N CH PWT000510 PRESTWICK Prestw-510 hydrochloride 3 ClH

N CH3 O

PWT000511 PRESTWICK Prestw-511 hydrochloride F

F F

OH O N OH

I I O O H3C N I N PWT000512 PRESTWICK Prestw-512 Iohexol OH OH OH OH

PWT000513 PRESTWICK Prestw-513 Norcyclobenzaprine N

CH3

H2N N

PWT000514 PRESTWICK Prestw-514 Pyrazinamide O N

CH O O 3 CH N 3 PWT000515 PRESTWICK Prestw-515 H3C O

HO OChiral

O O H C 3 O H CH H C 3 PWT000516 PRESTWICK Prestw-516 Lovastatin 3

H3C

OH Chiral CH3 H2N

O HO CH3 HO O

CH OH 3 OH H3C O PWT000517 PRESTWICK Prestw-517 Nystatine O

O OH OH OH OH O OH OH O Chiral HO

CH3 O HO CH3 H O CH3 PWT000518 PRESTWICK Prestw-518 Budesonide H H O

O Chiral OH O N HO S N PWT000519 PRESTWICK Prestw-519 Imipenem H HN H H CH3

O OH HO

N N

PWT000520 PRESTWICK Prestw-520 Sulfasalazine O S O N N

Cl

N O PWT000521 PRESTWICK Prestw-1430 Lofexidine N CH3Cl

H C S 3 Chiral O N HO N N O HO CH3 HO N CH N 3S O CHO3 S N N S N

OH H C O O 3 N

H3C O N N N CH3

H2C S N OH O N H C N O H C O PWT000522 PRESTWICK Prestw-522 Thiostrepton 3 2 N N O N O CH3 H3C O

H2N CH2

HO Chiral HO

HO N PWT000523 PRESTWICK Prestw-1169 Miglitol OH HO

N N

S PWT000524 PRESTWICK Prestw-524 Tiabendazole N CH 3 CH3 Chiral HO

O OH O CH3 O CH OH OH 3 CH CH 3 3 N O H3C

H3C O OH N Prestw-525 Rifampicin O PWT000525 PRESTWICK O N CH 3 N CH3

H2N S

PWT000526 PRESTWICK Prestw-526 Ethionamide CH N 3

O O

S CH3 N

S O

OH N PWT000527 PRESTWICK Prestw-527 Tenoxicam N

COOH

O CH3

O

PWT000528 PRESTWICK Prestw-528 Triflusal F F F

OH O S O N CH3

O N S CH PWT000529 PRESTWICK Prestw-529 besylate 3

S

H3C OH CH3 O O OH H C PWT000530 PRESTWICK Prestw-530 Trolox 3 CH3

O

O N N F PWT000531 PRESTWICK Prestw-531 Pirenperone

N CH3 N N N H3C O PWT000532 PRESTWICK Prestw-1797 Grepafloxacin F

CH3 O OH

H3C H C 3 O O PWT000533 PRESTWICK Prestw-533 Phenacetin N

Cl

O

PWT000534 PRESTWICK Prestw-534 Atovaquone OH O

ClH

CH3 HO NH2 O CH PWT000535 PRESTWICK Prestw-535 Methoxamine hydrochloride 3 H3C O

Chiral O NH2

N O PWT000536 PRESTWICK Prestw-953 (S)-(-)-Atenolol OH H3C CH3

NH2

O N PWT000537 PRESTWICK Prestw-537 Piracetam O

O

PWT000538 PRESTWICK Prestw-538 Phenindione O HO HO

O HO O HO N H C 3 O O H C O 3 CH PWT000539 PRESTWICK Prestw-539 Thiocolchicoside 3 O S

H3C

NH O 2 Cl S O Cl

Cl O PWT000540 PRESTWICK Prestw-540 Clorsulon S O NH2 NH2

NH2

HO

OH O N PWT000541 PRESTWICK Prestw-541 Ciclopirox ethanolamine

CH3

H3C O

CH3 HO N PWT000542 PRESTWICK Prestw-542 Probenecid S O O

O O O O S S H C OH 3 H3C OH

PWT000543 PRESTWICK Prestw-543 mesylate CH3 N N

HO Chiral HO

H2N O

HO O

H2N HO O HO O NH PWT000544 PRESTWICK Prestw-544 Tobramycin 2

NH2 H2N

ClH

N PWT000545 PRESTWICK Prestw-545 Tetramisole hydrochloride N S Chiral H3C

CH3 O CH 3 H

H PWT000546 PRESTWICK Prestw-546 HO H

CH O 3 N

+ O N N O PWT000547 PRESTWICK Prestw-547 Molsidomine O N

OH O P OH OH OH O P OH

OH CH3 CH3 N CH N 3 PWT000548 PRESTWICK Prestw-548 Chloroquine diphosphate

Cl N

ClH ClH

H C 3 O O N H3C N PWT000549 PRESTWICK Prestw-549 Trimetazidine dihydrochloride O

CH3

Chiral

CH3 ClH N N

PWT000550 PRESTWICK Prestw-1816 hydrochloride H3C O H3C

H3C NH2

H3C CH3

H3C N N CH3 PWT000551 PRESTWICK Prestw-551 Hexetidine

ClH Chiral CH3 HC N PWT000552 PRESTWICK Prestw-552 Selegiline hydrochloride CH3 HO

O HO S OH O O HN NH S 2 OH O

O PWT000553 PRESTWICK Prestw-553 Pentamidine isethionate O

H2N

NH

CH O 3 S N O O N PWT000554 PRESTWICK Prestw-554 N

O + O N O N PWT000555 PRESTWICK Prestw-555 Nifuroxazide O N OH

H3C N

N N PWT000556 PRESTWICK Prestw-1144

H C 3 CH Chiral H C 3 O 3 OH O N

H C N 3 OH CH O CH3 3 O CH O 3 O H C HO 3 O CH 3 CH3 PWT000557 PRESTWICK Prestw-557 Dirithromycin OH H3C HO CH O 3 H3C H3C O

O N N N S O O PWT000558 PRESTWICK Prestw-558 CH3

O

O CH3

H3C CH3 N PWT000559 PRESTWICK Prestw-1817 Tazarotene S OH CH O 3 OH

CH3

PWT000560 PRESTWICK Prestw-560 lactate N

ClH

S N N N PWT000561 PRESTWICK Prestw-1188 Hydrochloride O Cl N

HO OChiral

O O

H C O 3 H CH CH PWT000562 PRESTWICK Prestw-1441 Mevastatin 3 3

I

CH3 N O H3C O

+ PWT000563 PRESTWICK Prestw-1322 Pyridostigmine iodide N

CH3

OH3C

CH3 N

PWT000564 PRESTWICK Prestw-1491 Pentobarbital O N O CH3

H3C N O

O O OH HO S OH H C O 3 N PWT000565 PRESTWICK Prestw-565 sulfate monohydrate O

OH2 O OH

CH3 N H CH3 N O

H3C N O

CH3 CH3 N H O CH3 N O S OH O PWT000566 PRESTWICK Prestw-566 Eserine hemisulfate salt OH H C 3 N O

CH3 N N N O Cl O O

N Cl N

N PWT000567 PRESTWICK Prestw-1139 Itraconazole N N O CH3

H3C

OH Chiral OH HO OH HO O HO OH OH HO CH3 O O N O Prestw-1174 Acarbose PWT000568 PRESTWICK HO O OH OH OH

O O + N O N CH3

HO H C PWT000569 PRESTWICK Prestw-1403 Entacapone N 3 OH

O

PWT000570 PRESTWICK Prestw-1449 Nicotinamide N NH2

ClH

O N O CH PWT000571 PRESTWICK Prestw-571 Tetracaïne hydrochloride 3 H3C N

CH3

O O Cl CH 3 O HO O

CH3 H CH3

PWT000572 PRESTWICK Prestw-572 furoate Cl H O

S O CH3 CH3 N H3C O O O PWT000573 PRESTWICK Prestw-1467 Troglitazone HO

CH3 O

N NH2 CH N 3 PWT000574 PRESTWICK Prestw-574 Dacarbazine N N N CH3

CH3 N N O O CH3 H3C S N O N PWT000575 PRESTWICK Prestw-1351 Tenatoprazole H3C

OH

O HO O

CH3 N H3C O N PWT000576 PRESTWICK Prestw-576 Acetopromazine maleate salt CH3

S

O HO OH O

N Chiral

O

CH3 N CH PWT000577 PRESTWICK Prestw-1271 Escitalopram oxalate 3

F

ClH

H C CH 3 N 3 PWT000578 PRESTWICK Prestw-1158 Ropinirole hydrochloride O N

H3C N CH3

H3C O O CH3 O O O

O H C PWT000579 PRESTWICK Prestw-1297 3 CH3 H3C

OH Chiral CH O 3 O N O O N S N NH N 2 H3C PWT000580 PRESTWICK Prestw-1228 Argatroban NH O Chiral

H3C S OH O

N H3C O O O PWT000581 PRESTWICK Prestw-1328 Reboxetine mesylate H

ClH

ClH

N

N O H3C O CH PWT000582 PRESTWICK Prestw-1498 Camylofine chlorhydrate 3

CH3 H3C

ClH

CH3 O

N O

CH3

H C PWT000583 PRESTWICK Prestw-583 hydrochloride 3 O O CH3

ClH

Chiral

N H N H

H O PWT000584 PRESTWICK Prestw-584 Yohimbine hydrochloride OH O

H3C

Chiral N N N F

HO F N

PWT000585 PRESTWICK Prestw-1500 Voriconazole N CH3 F

Chiral H3C CH3

H3C

CH3

H

PWT000586 PRESTWICK Prestw-1211 Alfacalcidol CH 2

HO OH

N O

N N O PWT000587 PRESTWICK Prestw-587 Cilostazol N N BrH

H C O Chiral 3 O OH

Prestw-588 Galanthamine hydrobromide PWT000588 PRESTWICK N

CH3

ClH

CH N 3 O

N PWT000589 PRESTWICK Prestw-1130 hydrochloride N Cl

O CH3 CH3 CH3

CH3 H3C O

H C O PWT000590 PRESTWICK Prestw-1409 Etretinate 3 CH3

O HO OH O

O H3C HO O OH O

CH3 PWT000591 PRESTWICK Prestw-1274 N N N N

OH

O O O N PWT000592 PRESTWICK Prestw-1407 Etofenamate F F F

O

H3C CH3 N N N N PWT000593 PRESTWICK Prestw-1369 Zaleplon N

+ Na

Cl O N PWT000594 PRESTWICK Prestw-594 Diclofenac sodium O Cl O Chiral CH3

CH3 H

H H PWT000595 PRESTWICK Prestw-1410 Exemestane O

CH2

N CH N 3 PWT000596 PRESTWICK Prestw-1499 Fomepizole

O H2N N N N N N PWT000597 PRESTWICK Prestw-1183 Temozolomide CH3 O

CH3 S N

PWT000598 PRESTWICK Prestw-598 Xylazine N H3C

ClH

CH3

N N CH3 CH H C 3 3 O H C N O PWT000599 PRESTWICK Prestw-1132 Celiprolol hydrochloride 3 OH O CH3

CH3 N

N

O O N PWT000600 PRESTWICK Prestw-1367 Zopiclone N Cl N N O

O O CH3

N O

CH3 PWT000601 PRESTWICK Prestw-1198 Tranilast O HO ClH

N

N N PWT000602 PRESTWICK Prestw-1182 Tizanidine hydrochloride Cl N S N

O O O H3C S O N CH3 O O

N

PWT000603 PRESTWICK Prestw-1364 Zafirlukast N

H3C

ClH

CH3 H3C

CH3

H3C PWT000604 PRESTWICK Prestw-1252 Butenafine Hydrochloride N

O + N N O N H3C + PWT000605 PRESTWICK Prestw-1121 Carbadox O N O

ClH

H3C NH2

H PWT000606 PRESTWICK Prestw-1331 Rimantadine Hydrochloride H

H

ClH

O Chiral N OH

N O S O

PWT000607 PRESTWICK Prestw-1818 Tirofiban hydrochloride O

H3C

O O H3C N CH N N O 3 PWT000608 PRESTWICK Prestw-1460 Oxibendazol N N O N O S N PWT000609 PRESTWICK Prestw-1292 Ipsapirone O N

O OH S HO O OH

N

N H3C Cl CH PWT000610 PRESTWICK Prestw-1284 Hydroxychloroquine sulfate 3

N

NH2 N

O N O Cl PWT000611 PRESTWICK Prestw-1431 Loracarbef O OH

H3C PWT000612 PRESTWICK Prestw-1501 Fenipentol HO

OH Chiral

HO CH3

O HO O OH O HO O

HO O O PWT000613 PRESTWICK Prestw-1503 Diosmin OH O OH CH3

O Chiral

N NH2

HO CH3

PWT000614 PRESTWICK Prestw-1177 Carbidopa HO OH

Chiral NH2 F N

N O PWT000615 PRESTWICK Prestw-1604 (-)-Emtricitabine O S HO Br Br

CH C3 H + 3 O CH3 CH3 N + H C N O N 3 O N CH CH 3 PWT000616 PRESTWICK Prestw-616 Demecarium bromide 3 CH3 O

HO Chiral Cl

N

O

PWT000617 PRESTWICK Prestw-1819 CH H3C 3 N O

O N OH

+ PWT000618 PRESTWICK Prestw-1127 Acipimox H3C N O

O

O CH3 O O CH 3 O CH HO 3

CH3 H CH3 PWT000619 PRESTWICK Prestw-619 Diflorasone Diacetate F H O F

O O 2+ Ca H3C N S O O

O O PWT000620 PRESTWICK Prestw-1502 Acamprosate calcium H C N S 3 O O

F

N O N N N PWT000621 PRESTWICK Prestw-1506 N N CH3

CH3 O

N CH 3 NH2 O PWT000622 PRESTWICK Prestw-1217 Amisulpride N S CH3 O O ClH

N CH3

HO PWT000623 PRESTWICK Prestw-623 Pyridoxine hydrochloride OH HO

N N N PWT000624 PRESTWICK Prestw-1469 Mercaptopurine N S

OH Chiral

O

HO N PWT000625 PRESTWICK Prestw-1134 Cytarabine OH NH O N 2

S CH3 O N O O O PWT000626 PRESTWICK Prestw-626

OH O Chiral

O OH O N

H2N N N

PWT000627 PRESTWICK Prestw-627 Folic acid N N N O

ClH

Chiral

H3C O O

O N PWT000628 PRESTWICK Prestw-1129 Benazepril hydrochloride N O OH

N O

O

PWT000629 PRESTWICK Prestw-1178 Aniracetam O

CH3 ClH

CH3 N O CH3 PWT000630 PRESTWICK Prestw-630 Dimethisoquin hydrochloride N

CH3

+ Na

O O P P HO OH HO O PWT000631 PRESTWICK Prestw-1210 Alendronate sodium OH

NH2

ClH

OH N O CH3 H C 3 O CH H3C 3 H3C PWT000632 PRESTWICK Prestw-632 Dipivefrin hydrochloride CH3 O H3C O

O OH HS N O PWT000633 PRESTWICK Prestw-633

ClH

CH3Chiral N CH3 O PWT000634 PRESTWICK Prestw-1463 Tomoxetine hydrochloride

ClH

H

H3C O PWT000635 PRESTWICK Prestw-1511 Hydrochloride N O

O N N

N H2N N PWT000636 PRESTWICK Prestw-1488 Penciclovir OH OH Chiral

O N

NH2 PWT000637 PRESTWICK Prestw-1427 CH3 O

ClH

F Chiral F CH3 F PWT000638 PRESTWICK Prestw-1392 Dexfenfluramine hydrochloride N

CH3

O CH S 3 O Cl

PWT000639 PRESTWICK Prestw-1408 Etoricoxib N N

CH3

F N N N N O PWT000640 PRESTWICK Prestw-1341 Cl

N CH3 S N N O PWT000641 PRESTWICK Prestw-641 Sulmazole H3C O

F

N Cl N O N

PWT000642 PRESTWICK Prestw-1270 Gefitinib O O N

CH3

O CH3 HO CH O 3 CH HO O 3

CH3 H

H H PWT000643 PRESTWICK Prestw-643 Flunisolide O F S O O PWT000644 PRESTWICK Prestw-644 N-Acetyl-DL-homocysteine Thiolactone N CH3

O CH3 Chiral HO CH O CH3 HO 3 O

CH3 H

H H PWT000645 PRESTWICK Prestw-645 Flurandrenolide O F

Cl N

O N N Cl Cl

Prestw-1125 Oxiconazole Nitrate HO + O PWT000646 PRESTWICK N Cl O

N O

Cl

N PWT000647 PRESTWICK Prestw-1166 Rebamipide O O OH

CH3

H3C O CH3

O N

N PWT000648 PRESTWICK Prestw-1154 O O + N CH O O 3

O OH N

N NO PWT000649 PRESTWICK Prestw-649 Etanidazole 2 N

Br

CH3 H3C H

Br

H3C O O + H PWT000650 PRESTWICK Prestw-1601 N O

CH3 O

O O H3C O O S CH3 N N N O N

H3C O O H3C O O S CH3 N N N O N

H3C PWT000651 PRESTWICK Prestw-651

O O O H CH3 CH2

O CH3 PWT000652 PRESTWICK Prestw-652 Picrotoxinin OH O

Br

H C + CH 3 N 3 O

O PWT000653 PRESTWICK Prestw-653 bromide OH

NH2 H3C N O S O O N N P PWT000654 PRESTWICK Prestw-654 Benfotiamine O OH OH CH3

O CH3 Chiral Cl CH O 3 CH HO O 3

CH3 H

PWT000655 PRESTWICK Prestw-655 Halcinonide F H O

OChiral O

OH CH3

CH3 H

H OH H C O O 3 H

H3C O O OH

H3C O O OH PWT000656 PRESTWICK Prestw-656 Lanatoside C O O HO O CH3 HO OH O OH

ClH

O NH2 Cl N PWT000657 PRESTWICK Prestw-657 Benzamil hydrochloride N N

H2N N NH2 O

N CH3 N O COOH PWT000658 PRESTWICK Prestw-658 Suxibuzone O O

N O N N PWT000659 PRESTWICK Prestw-659 6-Furfurylaminopurine N N

CH3 O HO CH3 O O H C O 3 H H C CH 3 3 CH O O 3 H H O H C CH3 3 O H H O O H3C PWT000660 PRESTWICK Prestw-660 Avermectin B1 H OH O CH H 3 OH

O

N N N O N O PWT000661 PRESTWICK Prestw-1317 Pranlukast N

O

NH2 H C 3 O PWT000662 PRESTWICK Prestw-1477 D,L-Penicillamine H C 3 SH OH

HO NH2 N O PWT000663 PRESTWICK Prestw-1365 Zileuton S CH3

H3C

O O

N

PWT000664 PRESTWICK Prestw-1432 N Cl ClH

ClH ClH ClH ClH

PWT000665 PRESTWICK Prestw-1387 Tetraethylenepentamine pentahydrochloride N N H2N N NH2

O + N O O O O CH3 H C 3 O PWT000666 PRESTWICK Prestw-666 CH N 3 CH3 H3C

O CH3 O N N O PWT000667 PRESTWICK Prestw-1507 Acefylline HO N N CH3

CH3 O CH3 H3C OH

PWT000668 PRESTWICK Prestw-1165 Acitretin CH CH CH3 3 3 O

O NH S 2 O PWT000669 PRESTWICK Prestw-1162 N O

O

OH

OH

O NH2

N N PWT000670 PRESTWICK Prestw-1173 Irsogladine maleate Cl N NH2

Cl

O CH3Chiral

CH3

CH3 H

PWT000671 PRESTWICK Prestw-671 H H O O HO OH O

N

H C 3 N O PWT000672 PRESTWICK Prestw-1346 Sumatriptan succinate S O CH3 N CH3

ClH ClH

N

PWT000673 PRESTWICK Prestw-1456 dihydrochloride N N OH

+ Na

O O

CH3 O N PWT000674 PRESTWICK Prestw-1447 Nalidixic acid sodium salt N

H3C

+ Na

Chiral O CH3 N

O

N S CH3

N CH PWT000675 PRESTWICK Prestw-1475 Oxacillin sodium 3 O O O

H

H3C CH3 H3C CH3 O O

O CH3 CH3 CH3 OH O CH3 OH COOH O

O H3C OH OH O O OH O HO OH OH Prestw-676 Beta-Escin OH PWT000676 PRESTWICK O

HO HO OH

ClH Cl

NH2

+ N N S Prestw-631 Thiamine hydrochloride H C N PWT000677 PRESTWICK 3 H C 3

OH

O Chiral O S CH3 N N O N PWT000678 PRESTWICK Prestw-1349 Tazobactam N O OH + Na

O OH HO P OH H3C PWT000679 PRESTWICK Prestw-1285 Ibandronate sodium N P OH O O CH3

O O O

H3C

PWT000680 PRESTWICK Prestw-1363 Warfarin HO

O OH

CH3 PWT000681 PRESTWICK Prestw-1318 Pranoprofen N O

CH3HO CH N 3 N

+ PWT000682 PRESTWICK Prestw-1340 Secnidazole N O O

H3C CH3 H C N CH PWT000683 PRESTWICK Prestw-683 Pempidine 3 3 CH3

Chiral NH2

S N O N OH PWT000684 PRESTWICK Prestw-1798 Mirabegron N

O

OH HO

O CH3 CH3 H3C N H3C N HO HO

PWT000685 PRESTWICK Prestw-1508 fumarate O O

H3C S N H3C S N O O H3C CH3 H3C CH3 Chiral N N H H OH O

H3C N NH2 N H C OH PWT000686 PRESTWICK Prestw-1799 Tigecycline 3 OH O OH O O CH3

ClH

Chiral CH3 N CH3

O PWT000687 PRESTWICK Prestw-1465 hydrochloride HO CH3

N

N O CH3

H

H H PWT000688 PRESTWICK Prestw-688 Estropipate O O S O OH

CH3

CH3 + N H H Br O O H H PWT000689 PRESTWICK Prestw-1253 Butylscopolammonium (n-) bromide O

OH

OH2

OH2

ClH Chiral

OH2 N O CH3 N N O PWT000690 PRESTWICK Prestw-1494 Irinotecan hydrochloride trihydrate O O O N HO

CH3

O H C CH O 3 O 3

HO O H3C CH3 OH H3C CH3 H C O O O O 3 N

CH3 O OH O

CH3 O

CH3 O PWT000691 PRESTWICK Prestw-1353 Tylosin H C 3

HO CH3 OH

BrH

N

O

H C PWT000692 PRESTWICK Prestw-692 Citalopram Hydrobromide 3 N F H3C ClH

CH3 N CH3 N PWT000693 PRESTWICK Prestw-693 hydrochloride S

O N S N N CH O 3 PWT000694 PRESTWICK Prestw-694 Sulfamerazine H2N

CH3 N H3C

PWT000695 PRESTWICK Prestw-1170 Venlafaxine H3C O HO

N O

PWT000696 PRESTWICK Prestw-696 N O CH3

O Chiral CH3

CH3 H

H PWT000697 PRESTWICK Prestw-697 3-alpha-Hydroxy-5-beta-androstan-17-one H HO H

ClH

N PWT000698 PRESTWICK Prestw-698 Tetrahydrozoline hydrochloride N

H3C OH

PWT000699 PRESTWICK Prestw-699 Hexestrol HO CH3 + Na

O N OMe H S S CH N 3 N N S N PWT000700 PRESTWICK Prestw-700 Cefmetazole sodium salt O N N O O

ClH

N PWT000701 PRESTWICK Prestw-701 -D,L Hydrochloride OH

N COOH S N O S PWT000702 PRESTWICK Prestw-702 Succinylsulfathiazole N O O

CH H C 3 3 N N N H3C CH PWT000703 PRESTWICK Prestw-703 Famprofazone O 3

H3C

CH O 3 Br N CH N 3

H N O PWT000704 PRESTWICK Prestw-704 2

CH3

Cl

CH3 + O N O H3C H C CH3 H C3 PWT000705 PRESTWICK Prestw-705 Methyl benzethonium chloride 3 CH 3

CH3 CH3

ClH

Cl

N

PWT000706 PRESTWICK Prestw-706 hydrochloride N

CH3 ClH

O

N H C PWT000707 PRESTWICK Prestw-707 hydrochloride 3

Cl

CH3 + O N O H C H C CH3 H C3 3 PWT000708 PRESTWICK Prestw-708 Benzethonium chloride 3

CH3 CH3

CH3 O O O

CH3 PWT000709 PRESTWICK Prestw-709 Trioxsalen CH3

O O O H3C N N

PWT000710 PRESTWICK Prestw-1136 Doxofylline O N N

CH3

O O O S N PWT000711 PRESTWICK Prestw-711 Sulfabenzamide H2N

O

O CH3 PWT000712 PRESTWICK Prestw-712 H2N

+ Na

CH3 N H C 3 N O PWT000713 PRESTWICK Prestw-713 Dipyrone S N O O O CH3 NO2 O H O

NO2 PWT000714 PRESTWICK Prestw-714 Isosorbide dinitrate O O H

N Cl N O O S N PWT000715 PRESTWICK Prestw-715 Sulfachloropyridazine H2N

ClH

O O N PWT000716 PRESTWICK Prestw-716 Pramoxine hydrochloride H3C O

H3C Chiral O N CH3

CH3 CH3

CH3 H PWT000717 PRESTWICK Prestw-717 Finasteride H H O N H

O CH3 CH OH HO 3

CH3 H

F H PWT000718 PRESTWICK Prestw-718 O

CH3

+ Na

S O H H S N N O CH3 PWT000719 PRESTWICK Prestw-719 Cephalothin sodium salt O O O O

+ Na

O O H H S N

N N O NH2 PWT000720 PRESTWICK Prestw-720 Cefuroxime sodium salt O O CH O 3 O O O O S S H N N 2 O O PWT000721 PRESTWICK Prestw-721 Althiazide S Cl N CH2

ClH

O N CH N 3 H C PWT000722 PRESTWICK Prestw-722 Isopyrin hydrochloride 3 N CH3 H3C

+ K

O H H O S CH N 3 CH CH3 N 3 PWT000723 PRESTWICK Prestw-723 Phenethicillin potassium salt O O O

NH2 N H C S PWT000724 PRESTWICK Prestw-724 Sulfamethoxypyridazine 3 N O O N O

OH O S O

CH3

OH O O OH

H2N N N N CH N N 3 PWT000725 PRESTWICK Prestw-725 Deferoxamine mesylate O OH O O

O HO S OH O

N CH H C 3 3 CH 3 N PWT000726 PRESTWICK Prestw-726 Mephentermine hemisulfate CH 3 H3C CH3

H3C S N

H3C N O PWT000727 PRESTWICK Prestw-1140 Liranaftate O CH O 3 O N S N O N PWT000728 PRESTWICK Prestw-728 Sulfadimethoxine O H2N H3C

O S NH O 2 PWT000729 PRESTWICK Prestw-729 Sulfanilamide H2N

+ + Na Na

OH

N O N O O PWT000730 PRESTWICK Prestw-730 Balsalazide Sodium N O

O

+ Na

NH2

N N PWT000731 PRESTWICK Prestw-731 Sulfaquinoxaline sodium salt S O O N

H C N 3 N O

O N HO OH

O PWT000732 PRESTWICK Prestw-732 Streptozotocin HO

HO

H C 3 OH OH CH3 OH H3C N O O OH O O OH

H3C

CH3

H3C N PWT000733 PRESTWICK Prestw-733 Metoprolol-(+,-) (+)-tartrate salt O O OH

O OH CH3 OH HO CH3

CH3 H

F H PWT000734 PRESTWICK Prestw-734 Flumethasone O F O

H3C OH

F O F O N F N PWT000735 PRESTWICK Prestw-735 acetate O F F F

+ Na

N N O N H H N S N S N S CH3 PWT000736 PRESTWICK Prestw-736 Cefazolin sodium salt O N N O O

CH3 O O O H3C N PWT000737 PRESTWICK Prestw-1702 Trimetozine O O CH3

2+ Ca

H2N N N

N N N O O N O PWT000738 PRESTWICK Prestw-738 Folinic acid calcium salt O O O O

HO OH HO NH PWT000739 PRESTWICK Prestw-739 Levonordefrin 2 H3C

CH3 Chiral

H C 3 NH OH 2 O N N O S O O PWT000740 PRESTWICK Prestw-1820 Amprenavir O

O Chiral CH N 3 HO

PWT000741 PRESTWICK Prestw-1821 Bimatoprost HO OH H3C N S N

O N S O PWT000742 PRESTWICK Prestw-742 Sulfamethizole

H2N

H3C O CH HO 3 H CH3

H H PWT000743 PRESTWICK Prestw-743 Medrysone O

CH3

OH OH N HO CH3 OH OH

CH3 F F N N PWT000744 PRESTWICK Prestw-744 Flunixin meglumine F

COOH

CH3 N CH3 O

O CH3

CH3

O H3C O OH O O CH3 O N CH H C O 3 PWT000745 PRESTWICK Prestw-745 Spiramycin 3 O OH R O H3C CH3 O OH

CH3

Br

O CH3 + N CH3 PWT000746 PRESTWICK Prestw-746 Glycopyrrolate O OH

F Chiral

H3C O

N F O F N Prestw-1600 Aprepitant F PWT000747 PRESTWICK F N O F N F

+ Na

OH Chiral HO CH O 3 H3C HO H H O H C O H 3 O CH H 3 CH H C O 3 H3C 3 H PWT000748 PRESTWICK Prestw-748 Monensin sodium salt O O O CH3 CH3 O OH S H C 3 O

OH

CH3 CH PWT000749 PRESTWICK Prestw-749 Isoetharine mesylate salt N 3 HO

OH CH3

ClH

H3C O O O H3C S N CH PWT000750 PRESTWICK Prestw-1822 hydrochloride N 3 O O

H3C

ClH

O O N

H3C O N N PWT000751 PRESTWICK Prestw-751 Terazosin hydrochloride N H3C O

NH2

ClH

NH2 N

H2N N PWT000752 PRESTWICK Prestw-752 Phenazopyridine hydrochloride N

ClH

H C CH Cl OH 3 N 3 H H OH

NH PWT000753 PRESTWICK Prestw-753 hydrochloride 2 OH OH O OH O O

CH3 O O O

CH OH 2+ 3 OH 2 Ca 2 O PWT000754 PRESTWICK Prestw-754 Fenoprofen calcium salt dihydrate O O

+ Na

CH3 O O N O H H S N N CH3 N N CH3 PWT000755 PRESTWICK Prestw-755 Piperacillin sodium salt O O O O CH3 OH

PWT000756 PRESTWICK Prestw-756 Diethylstilbestrol HO CH3

O H3C Cl

H C PWT000757 PRESTWICK Prestw-757 Chlorotrianisene 3 O O

CH3

O HO S OH O

NH2 Chiral

OH O H O OH

NH2

HO O O H NH PWT000758 PRESTWICK Prestw-758 Ribostamycin sulfate salt 2 OH HO HO

NH2

Cl

O CH3 CH3 + PWT000759 PRESTWICK Prestw-759 chloride N H3C O CH3 CH3

Br

H C 3 CH3 + N O

O PWT000760 PRESTWICK Prestw-760 OH

O

O CH3 PWT000761 PRESTWICK Prestw-761 H2N

O O S N

N PWT000762 PRESTWICK Prestw-762 Sulfapyridine H2N ClH

O CH3 O N O CH PWT000763 PRESTWICK Prestw-763 hydrochloride 3 Cl

ClH

O O O N + N N O O PWT000764 PRESTWICK Prestw-764 Furaltadone hydrochloride N

O

N CH3

CH3 H C O PWT000765 PRESTWICK Prestw-765 Ethoxyquin 3 CH3

O O NO2 S CH3 N

PWT000766 PRESTWICK Prestw-766 Tinidazole N CH3

NH

O N NH2 O OH S O HO O NH O PWT000767 PRESTWICK Prestw-767 Guanadrel sulfate N NH2

O

NH2 Chiral N N

N N

O PWT000768 PRESTWICK Prestw-768 Vidarabine HO HO OH

O O N CH3 S N N O PWT000769 PRESTWICK Prestw-769 Sulfameter H2N I

H3C CH3

H3C + N CH3 NH 2 CH PWT000770 PRESTWICK Prestw-770 iodide 3 O

H3C CH3 O OO O CH3 HO O

CH3 H CH3

PWT000771 PRESTWICK Prestw-771 Alclometasone dipropionate H H O Cl

F

O F F N PWT000772 PRESTWICK Prestw-772 Leflunomide N CH O 3

H C 3 OH CH

H H PWT000773 PRESTWICK Prestw-773 -(-)-D H H O

O Chiral

O CH3 H3C O CH O 3 CH HO O 3

CH3 H

F H PWT000774 PRESTWICK Prestw-774 Fluocinonide O F

+ Na

H3C

O N O S CH3 PWT000775 PRESTWICK Prestw-775 Sulfamethazine sodium salt N N

H2N

OH O OH

PWT000776 PRESTWICK Prestw-776 Guaifenesin CH O 3

ClH ClH

CH NH NH 3

N N N CH3 H3C N N N NH NH H3C ClH ClH

CH NH NH 3

N N N CH3 H3C N N N NH NH H C PWT000777 PRESTWICK Prestw-777 Alexidine dihydrochloride 3

ClH

CH CH3 3

N

O O

CH PWT000778 PRESTWICK Prestw-778 hydrochloride 3

+ Na

O CH3 O O PWT000779 PRESTWICK Prestw-779 Zomepirac sodium salt N Cl H3C

CH3

N O N

PWT000780 PRESTWICK Prestw-780 Cinoxacin O COOH O

Cl O Chiral O CH O 3 CH3 HO CH3

CH3 H

PWT000781 PRESTWICK Prestw-781 Clobetasol propionate F H O

OH Chiral H O O O H O

H C PWT000782 PRESTWICK Prestw-782 Podophyllotoxin 3 O O

O CH3 CH3

H C O3 COOH

PWT000783 PRESTWICK Prestw-783 Clofibric acid CH3 Cl O O O O S S H2N N F N PWT000784 PRESTWICK Prestw-784 F F

O O O O

PWT000785 PRESTWICK Prestw-785 Dicumarol OH OH

CH3 N SH PWT000786 PRESTWICK Prestw-786 Methimazole N

+ + Na Na

OH Hg O O O

Br Br PWT000787 PRESTWICK Prestw-787 Merbromin O O

ClH

O PWT000788 PRESTWICK Prestw-788 hydrochloride N

O CH3

ClH

O O N CH3

CH PWT000789 PRESTWICK Prestw-789 hydrochloride 3

O

OH N

H3C O H PWT000790 PRESTWICK Prestw-790 Cycloheximide O

CH3 + Na

CH3 O PWT000791 PRESTWICK Prestw-791 (R) -Naproxen sodium salt H C O 3 O

I I

NH2

CH3

+ + N N H2N CH3 CH PWT000792 PRESTWICK Prestw-792 Propidium iodide 3

ClH

Cl

O N PWT000793 PRESTWICK Prestw-793 hydrochloride

O

OH

O N

H C OH 3 N PWT000794 PRESTWICK Prestw-1823 Eprosartan mesylate S O O S

H3C OH

O N N O N PWT000795 PRESTWICK Prestw-795 Isocarboxazid H3C

COOH H3C Chiral CH 3 H

CH3 H PWT000796 PRESTWICK Prestw-796 Lithocholic acid H H HO H

O

OH O

OH

CH3 CH3 N CH3 PWT000797 PRESTWICK Prestw-797 Methotrimeprazine maleat salt N O CH3

S H3C OH

PWT000798 PRESTWICK Prestw-798 Dienestrol HO CH3

O S H C OH 3 O

OH N PWT000799 PRESTWICK Prestw-799 methanesulfonate salt

N O N

PWT000800 PRESTWICK Prestw-800 Amrinone H2N

O

OH O

CH OH 3 N O CH3 PWT000801 PRESTWICK Prestw-801 maleate salt N

Cl

O O S N S O H3C NH2 PWT000802 PRESTWICK Prestw-802 Methazolamide N N H3C

N O

CH3

PWT000803 PRESTWICK Prestw-803 Pyrithyldione O CH3

ClH ClH

OH H H N O O CH3

H3C

HO O PWT000804 PRESTWICK Prestw-804 Spectinomycin dihydrochloride H OH N O

H3C CH3

N N N

N PWT000805 PRESTWICK Prestw-805 Piromidic acid COOH O

O

OH O

OH N CH PWT000806 PRESTWICK Prestw-806 maleate salt N 3

CH3 CH3

ClH

Cl

N N CH PWT000807 PRESTWICK Prestw-807 hydrochloride N 3

CH3

O O O + O N N N PWT000808 PRESTWICK Prestw-808 Furazolidone O

O O O O S S H2N NH2

PWT000809 PRESTWICK Prestw-809 Dichlorphenamide Cl Cl

HO + N O O

N Cl N PWT000810 PRESTWICK Prestw-810 Sulconazole nitrate Cl S Cl

H3C

H3C P CH O Au 3 O S H3C O O

O O CH3 PWT000811 PRESTWICK Prestw-1233 Auranofin O O H3C O

CH3 + Na + Na

O O O O O O

PWT000812 PRESTWICK Prestw-812 Cromolyn disodium salt OH O O O O

O

N CH3

+ N Na N

N N O H O PWT000813 PRESTWICK Prestw-813 Bucladesine sodium salt O H O CH O P 3 O O

+ Na

O O H H S N NH2 + O S O N N PWT000814 PRESTWICK Prestw-814 Cefsulodin sodium salt O O O O

HO O

O

PWT000815 PRESTWICK Prestw-815 Fosfosal O P OH OH

O S

COOH PWT000816 PRESTWICK Prestw-816 Suprofen CH3

CH Chiral O 3

O O

H3C N CH HO 3 H O CH3 H PWT000817 PRESTWICK Prestw-1509 Deflazacort H H

O

OH

OH OH H C H C3 N O PWT000818 PRESTWICK Prestw-818 Nadolol 3

CH3 + + Na Na

HO H C Chiral O 3 O H O N CH3 N S N O O PWT000819 PRESTWICK Prestw-819 Moxalactam disodium salt O N N O O N

H2N NH2

CH3 CH3 N N O N N O

N N PWT000820 PRESTWICK Prestw-820 Aminophylline N N CH3 CH3 O O

+ Na

O Chiral H H N N N S CH N 3 O N O CH PWT000821 PRESTWICK Prestw-821 Azlocillin sodium salt O 3 O O

Br

CH3 + N O

O PWT000822 PRESTWICK Prestw-822 OH

O N N S O N H N PWT000823 PRESTWICK Prestw-823 Sulfamonomethoxine 2 O H3C

O O S S H N N 2 O O PWT000824 PRESTWICK Prestw-824 Benzthiazide S Cl N

O O O O S S H2N N Cl PWT000825 PRESTWICK Prestw-825 Cl N Cl O OH O OH

HO O HO H3C

O H3C N N PWT000826 PRESTWICK Prestw-826 Oxalamine citrate salt N

Br

CH3

O O + N CH CH3 H3C 3

PWT000827 PRESTWICK Prestw-827 H3C

O

ClH

O H3C O PWT000828 PRESTWICK Prestw-1361 Viloxazine hydrochloride O

N

H C 3 O O

H3C N PWT000829 PRESTWICK Prestw-829 Dimethadione O

ClH

O CH3

O CH3

H C O PWT000830 PRESTWICK Prestw-830 Ethaverine hydrochloride 3 N

H3C O

O

O N CH3

H N PWT000831 PRESTWICK Prestw-831 2

CH3

+ Na

S O H C 3 O H S N

N O NH2 PWT000832 PRESTWICK Prestw-832 Cefoxitin sodium salt O O O O Cl Chiral

N O N

O N PWT000833 PRESTWICK Prestw-1824 Eszopiclone N N O N H3C

+ Na

H2N O Chiral OH CH3 O O O O O H C O 3 O N H C CH 3 3 OH

PWT000834 PRESTWICK Prestw-834 Novobiocin sodium salt O CH 3

CH3

Chiral H3C CH N 3

N PWT000835 PRESTWICK Prestw-1800 Zolmitriptan O O N

O

CH3 N PWT000836 PRESTWICK Prestw-836 Indoprofen O HO

+ + Na Na

O

H3C O

CH3 O

CH3 CH3 H O CH PWT000837 PRESTWICK Prestw-837 Carbenoxolone disodium salt H 3 O O H O H3C CH3

O CH3 I CH3 N O

OH PWT000838 PRESTWICK Prestw-838 Iocetamic acid I I

NH2

O

N N

N H2N N O PWT000839 PRESTWICK Prestw-839 Ganciclovir OH HO ClH

H3C N CH3

CH3 PWT000840 PRESTWICK Prestw-840 Ethopropazine hydrochloride N

S

S CH N 3

N N

PWT000841 PRESTWICK Prestw-1455 N

CH3

CH3 CH3 N H3C N

OH OH S HO O

O OH CH3 CH3 N H3C PWT000842 PRESTWICK Prestw-842 Trimeprazine tartrate N

S

+ Na

OH2

O H H S CH3 N N CH3 O PWT000843 PRESTWICK Prestw-843 Nafcillin sodium salt monohydrate O O O CH3

ClH

N

PWT000844 PRESTWICK Prestw-844 hydrochloride OH

ClH

H Chiral H C 3 O O OH

H3C O H OH H O PWT000845 PRESTWICK Prestw-845 Amiprilose hydrochloride N CH3 H3C

OH Chiral CH3 CH H

H H PWT000846 PRESTWICK Prestw-846 Ethynylestradiol 3-methyl ether H C 3 O ClH

CH3 Chiral CH O N 3 CH3 OH PWT000847 PRESTWICK Prestw-847 (-) -Levobunolol hydrochloride

O

OH OH HO N O O N OH

I I I I OH OH HO N N OH Prestw-848 Iodixanol N N PWT000848 PRESTWICK O I OH I O H3C O O CH3

Cl H N 2 N N

O PWT000849 PRESTWICK Prestw-1379 Clinafloxacin F O OH

O CH3

PWT000850 PRESTWICK Prestw-850 Equilin H H HO

ClH

F Chiral

O

PWT000851 PRESTWICK Prestw-851 Hydrochloride O O

N

OH N

PWT000852 PRESTWICK Prestw-1454 Nylidrin CH CH 3 3 OH

O HO I OH NH PWT000853 PRESTWICK Prestw-853 Liothyronine I O 2 I CH3

O H CH O N 3 CH CH3 3 O H C 3 OH CH3 H3C O OH O H3C CH HO 3

CH3 H3C O O CH PWT000854 PRESTWICK Prestw-854 O O N O 3 H C 3 OH OH H3C

CH3 Chiral

O O O

CH3 O HO CH3 CH3 CH H PWT000855 PRESTWICK Prestw-855 Beclomethasone dipropionate 3 O Cl H O

OH + 2 Na OH2

O CH3 N O PWT000856 PRESTWICK Prestw-856 Tolmetin sodium salt dihydrate O H3C

ClH

CH3 Chiral CH O N 3 CH3 OH PWT000857 PRESTWICK Prestw-857 (+) -Levobunolol hydrochloride O

O

H3C S OH O

O O CH3 N O N N O PWT000858 PRESTWICK Prestw-858 Doxazosin mesylate H C N 3 O

NH2

+ Na

F

OH OH O

O PWT000859 PRESTWICK Prestw-859 Fluvastatin sodium salt N

CH3 H3C

O

N CH3 PWT000860 PRESTWICK Prestw-860 Methylhydantoin-5-(L) N O H2N COOH

PWT000861 PRESTWICK Prestw-861

ClH

HO S OH

PWT000862 PRESTWICK Prestw-862 Raloxifene hydrochloride O N O

CH3 Chiral O

CH3 O O H3C HO O

H O CH3 PWT000863 PRESTWICK Prestw-1801 Ciclesonide H H

O

O

N CH3 PWT000864 PRESTWICK Prestw-864 Methylhydantoin-5-(D) N O

HO O

O O H

H C O 3 H H H3C CH3 CH PWT000865 PRESTWICK Prestw-865 Simvastatin 3

H3C

OH Chiral HO O

N N O OH PWT000866 PRESTWICK Prestw-866 Azacytidine-5 H2N N

O HO OH S O

NH2 Chiral HO NH HO 2 H N 2 OH HO O OH O O PWT000867 PRESTWICK Prestw-867 Paromomycin sulfate O H O HO H O OH H NH2 HO NH2 HO O

PWT000868 PRESTWICK Prestw-868 Acetaminophen N CH3

O S S COOH O N N O PWT000869 PRESTWICK Prestw-869 Phthalylsulfathiazole N

OH

HO O OH PWT000870 PRESTWICK Prestw-870 Luteolin OH O

HO OH Chiral O I O HO OH N N

I I HO H PWT000871 PRESTWICK Prestw-871 Iopamidol N H3C O

CH3 OH O N OH

I I O OH O N OH PWT000872 PRESTWICK Prestw-872 Iopromide H3C N I O

OH2

O

H3C N N

PWT000873 PRESTWICK Prestw-873 Theophylline monohydrate O N N

CH3

O CH3 N N

N PWT000874 PRESTWICK Prestw-874 O N CH3 H3C N O N H H O H O O H3C O CH3

O O CH3 PWT000875 PRESTWICK Prestw-875 Reserpine CH O 3 O CH3

O F F F O S F O CH PWT000876 PRESTWICK Prestw-1239 N N OH 3

ClH

O HO PWT000877 PRESTWICK Prestw-877 hydrochloride N CH3 O O

OH O N OH

I I O OH HO N OH PWT000878 PRESTWICK Prestw-878 Ioversol N HO I O

+ Na

O CH3

N O H3C O PWT000879 PRESTWICK Prestw-1495 Rabeprazole Sodium salt S N N

Cl

H C 3 + O O PWT000880 PRESTWICK Prestw-880 N H3C CH3 NH2

N

OH PWT000881 PRESTWICK Prestw-881 Niacin O O N O

H C PWT000882 PRESTWICK Prestw-882 Bemegride 3 CH3

O O OH CH3

CH3 H PWT000883 PRESTWICK Prestw-883 Digoxigenin H OH HO H

OH OH N HO CH3 PWT000884 PRESTWICK Prestw-884 Meglumine OH OH

O

HO S CH3 O OH2

O O H Prestw-1510 Dolasetron mesilate H PWT000885 PRESTWICK N N H O

OH I N

PWT000886 PRESTWICK Prestw-886 Clioquinol Cl

O

PWT000887 PRESTWICK Prestw-887 Oxybenzone H C 3 O OH

ClH H3C CH3 N

CH3 N PWT000888 PRESTWICK Prestw-888 hydrochloride S O O

H C 3 O O O CH3

PWT000889 PRESTWICK Prestw-1167 Diacerein OH O O

ClH

CH3

O N CH3 OH

PWT000890 PRESTWICK Prestw-1137 Esmolol hydrochloride O

CH3 O

O Chiral

O O CH3

CH3 HO OH H CH3 PWT000891 PRESTWICK Prestw-1486 acetate H H O

O O CH3 N O N PWT000892 PRESTWICK Prestw-1416 Flubendazol F N

O OH

PWT000893 PRESTWICK Prestw-893 Felbinac

O

O CH3 PWT000894 PRESTWICK Prestw-894 Butylparaben HO

O O N PWT000895 PRESTWICK Prestw-895 OH H2N H O H3C N

PWT000896 PRESTWICK Prestw-896 N-Acetyl-L-leucine CH CH3 H3O O

CH N 3 N N N

N O PWT000897 PRESTWICK Prestw-897 Pipemidic acid O OH

O OH

PWT000898 PRESTWICK Prestw-898 Dioxybenzone H C 3 O OH

O Chiral CH O 3

CH3 H

PWT000899 PRESTWICK Prestw-899 Adrenosterone H H O

O + N O O

O H C + OH 3 N O Prestw-900 nitrate CH PWT000900 PRESTWICK 3

HO O O

PWT000901 PRESTWICK Prestw-901 Hymecromone CH3

NH2

N N

N N N OH

Chiral NH2

HO OH N N PWT000902 PRESTWICK Prestw-1512 Abacavir Sulfate S O O N N N OH CH3 Cl N Cl O O O PWT000903 PRESTWICK Prestw-903 Diloxanide furoate O

H3C CH3 N

PWT000904 PRESTWICK Prestw-904 O N

ClH

N CH3 O N N N O H3C PWT000905 PRESTWICK Prestw-905 Urapidil hydrochloride N CH3 O

F

O N

N N PWT000906 PRESTWICK Prestw-906 Fluspirilen F

CH3 Chiral OH CH3 PWT000907 PRESTWICK Prestw-907 S-(+)- O H3C

O Chiral

H C O 3 CH CH3

H H O PWT000908 PRESTWICK Prestw-908 Ethynodiol diacetate H H

H3C O

O

CH3 PWT000909 PRESTWICK Prestw-909 Nabumetone H C 3 O ClH

CH3 O CH N 3

PWT000910 PRESTWICK Prestw-910 Nisoxetine hydrochloride O

O OH Chiral O HO OH OH

OH HO N CH PWT000911 PRESTWICK Prestw-911 (+)-Isoproterenol (+)-bitartrate salt 3

CH3 HO

O

PWT000912 PRESTWICK Prestw-912 Monobenzone OH

O S NH O 2 PWT000913 PRESTWICK Prestw-913 2-Aminobenzenesulfonamide NH2

O Chiral CH3

H

PWT000914 PRESTWICK Prestw-914 Estrone H H HO

O O

CH3

+ Cl Na N Cl N PWT000915 PRESTWICK Prestw-915 sodium salt O O

CH3

H3C N CH3

O O CH3 H3C O O

+ O PWT000916 PRESTWICK Prestw-916 N O O OH

CH PWT000917 PRESTWICK Prestw-917 Flurbiprofen 3 F

H3C N CH3

H C O O CH3 3 O

CH3 O O

+ O PWT000918 PRESTWICK Prestw-918 N O

N N Chiral O

HO O N N N O N O O H2N O CH3 O O O N N CH3 N

NH2 N O O OH N

H3C O Prestw-919 Bacitracin O PWT000919 PRESTWICK N NH2 H3C H3C N N CH H C 3 3 O S CH3

O O

CH3 F O OH N N N N

H2N PWT000920 PRESTWICK Prestw-1825 Gemifloxacin mesylate O H3C S OH O

S S N N

N CH3 H3C O + PWT000921 PRESTWICK Prestw-921 N N H C 3 O

COOH COOH

N N PWT000922 PRESTWICK Prestw-922 maleate N N S

OH O O N N N O HO O OH O OH O N PWT000923 PRESTWICK Prestw-923 Xamoterol hemifumarate HO N N O O HO

CH Chiral N 3 O N OH N N O O N N N N CH3

F F OH2 CH Chiral N 3 O N OH N N O O N N N N CH3

OH PWT000924 PRESTWICK Prestw-1826 Posaconazole F F 2

Br

H C CH3 3 + N CH3 N 15 H C PWT000925 PRESTWICK Prestw-925 Thonzonium bromide 3 O N N

ClH

O

N PWT000926 PRESTWICK Prestw-926 Idazoxan hydrochloride O N

ClH

O H3C O Chiral CH3 O N O N PWT000927 PRESTWICK Prestw-927 Quinapril hydrochloride OH

H3C N O F H C 3 N F O F

+ O PWT000928 PRESTWICK Prestw-928 Nilutamide N O

OH

NH2 HO OH

O O PWT000929 PRESTWICK Prestw-929 Ketorolac tromethamine N OH

ClH

PWT000930 PRESTWICK Prestw-930 hydrochloride CH3 N CH3 OH CH3

H3C CH3 PWT000931 PRESTWICK Prestw-931 Propofol

ClH

CH3 Chiral O OH N N CH3

PWT000932 PRESTWICK Prestw-932 S(-)Eticlopride hydrochloride O

CH3 Cl

O N

N

PWT000933 PRESTWICK Prestw-933 O H3C

N O

N F PWT000934 PRESTWICK Prestw-934 Flucytosine NH2

O N

O F N N Prestw-1827 PWT000935 PRESTWICK H3C N OH

O

O

OH

CH3 O + PWT000936 PRESTWICK Prestw-936 Bephenium hydroxynaphthoate N

H3C

O Chiral CH3

CH3 H O PWT000937 PRESTWICK Prestw-937 Dehydroisoandosterone 3-acetate H H

H3C O ClH

NH2 OH HO N OH PWT000938 PRESTWICK Prestw-938 Benserazide hydrochloride N O OH

O OH

I I O I N N I O PWT000939 PRESTWICK Prestw-939 Iodipamide I I

HO O

N N N PWT000940 PRESTWICK Prestw-1213 Allopurinol N O

O

OH N COOH N N COOH PWT000941 PRESTWICK Prestw-941 Pentetic acid COOH COOH

O

H3C S O O

Br

+ N CH PWT000942 PRESTWICK Prestw-942 tosylate CH 3 H3C 3

Cl

CH3 + N PWT000943 PRESTWICK Prestw-943 Pralidoxime chloride N OH

ClH

Cl N O H C PWT000944 PRESTWICK Prestw-944 Phenoxybenzamine hydrochloride 3 O

OH PWT000945 PRESTWICK Prestw-945 Salmeterol HO N

HO

CH3 CH3 N N N H3C CH3 N N

PWT000946 PRESTWICK Prestw-946 Altretamine N H3C CH3

ClH

O O

CH3 N O N N

H C N PWT000947 PRESTWICK Prestw-947 Prazosin hydrochloride 3 O

NH2

O

OH O OH

Chiral O N N S N CH PWT000948 PRESTWICK Prestw-948 Timolol maleate salt O 3 N HO CH3 CH3

ClH

OH

NH2 PWT000949 PRESTWICK Prestw-949 (+,-)-Octopamine hydrochloride HO

O CH N 3

O N PWT000950 PRESTWICK Prestw-1279 Stavudine O HO

O

H3C N CH3

CH3 PWT000951 PRESTWICK Prestw-951 Crotamiton H C 3 CH N 3

O

Cl PWT000952 PRESTWICK Prestw-1197 Toremifene

NH2Chiral CH3 O H3C N O PWT000953 PRESTWICK Prestw-536 (R)-(+)-Atenolol OH

OH OH OH

O O O

O O O

m m m O O O

PWT000954 PRESTWICK Prestw-954 Tyloxapol n CH CH CH3 3 3 CH CH3 CH3 3

H3C H3C H3C CH H3C CH3 H3C CH3 H3C 3

OH Chiral

F O N O S H C PWT000955 PRESTWICK Prestw-955 Florfenicol 3 O Cl Cl

O CH3 Chiral CH O 3 CH3

CH3 H O

H H PWT000956 PRESTWICK Prestw-956 acetate O

CH3

O Chiral OH CH3

CH3 H

PWT000957 PRESTWICK Prestw-957 Deoxycorticosterone H H O

O

H3C OH CH3 H

CH3 H PWT000958 PRESTWICK Prestw-958 Urosiol H H HO OH H ClH

CH O 3 N CH O 3 H C PWT000959 PRESTWICK Prestw-959 Proparacaine hydrochloride 3 O

NH2

O

H2N PWT000960 PRESTWICK Prestw-960 Aminocaproic acid OH

O

O

CH3 H3C N + PWT000961 PRESTWICK Prestw-961 Denatonium benzoate N O CH3 CH3

O Chiral

O H3C

CH3 H

PWT000962 PRESTWICK Prestw-1259 H H O

Cl

O H2C Cl N PWT000963 PRESTWICK Prestw-963 Enilconazole N

ClH

H C CH CH OH3 N 3 2H H OH

NH PWT000964 PRESTWICK Prestw-964 Methacycline hydrochloride 2 OH OH O OH O O

OH Chiral F O N HO O PWT000965 PRESTWICK Prestw-1415 Floxuridine N O ClH

OH

N CH3 PWT000966 PRESTWICK Prestw-966 hydrochloride O O S CH3 H3C N

OH CH H3C

H

PWT000967 PRESTWICK Prestw-1267 H O

Br Br

CH3 + CH3 N + PWT000968 PRESTWICK Prestw-968 Decamethonium bromide H3C N CH3 H3C CH3

BrH

Chiral O

H N 2 O PWT000969 PRESTWICK Prestw-1514 hydrobromide N

ClH

H3C N

PWT000970 PRESTWICK Prestw-1602 Indatraline hydrochloride Cl

Cl

ClH

CH3 Chiral O O CH3 H Br N N

PWT000971 PRESTWICK Prestw-971 Remoxipride Hydrochloride O

CH3

ClH

OH

PWT000972 PRESTWICK Prestw-972 THIP Hydrochloride N N O O

H3C S OH O

N PWT000973 PRESTWICK Prestw-973 Pirlindole mesylate N

H3C

ClH

OH

N CH3 PWT000974 PRESTWICK Prestw-974 Pronethalol hydrochloride CH3

ClH ClH

O N OH N

PWT000975 PRESTWICK Prestw-975 dihydrochloride O

CH3

ClH

CH3

H3C H3C N N N O PWT000976 PRESTWICK Prestw-976 Tracazolate hydrochloride O N CH3

O

N F N

F O PWT000977 PRESTWICK Prestw-977 Zardaverine O CH3

ClH

NH2

PWT000978 PRESTWICK Prestw-978 Memantine Hydrochloride CH H3C 3

ClH

O

N PWT000979 PRESTWICK Prestw-979 Ozagrel hydrochloride OH N ClH

O N N N PWT000980 PRESTWICK Prestw-980 Piribedil hydrochloride O N

ClH

O + N O CH O 3 N CH PWT000981 PRESTWICK Prestw-981 Nitrocaramiphen hydrochloride O 3

OHChiral CH3

H H

PWT000982 PRESTWICK Prestw-982 H H O

ClH ClH

NH CH H N S N 3 PWT000983 PRESTWICK Prestw-983 dihydrochloride 2

CH3

O S N O

CH3 PWT000984 PRESTWICK Prestw-1459 Oxfendazol N N O

HO

O PWT000985 PRESTWICK Prestw-1268 Guaiacol H3C

Chiral H3C O O HO N N O HO CH PWT000986 PRESTWICK Prestw-1828 Capecitabine N O 3 F ClH ClH

S N CH Prestw-1316 Pramipexole dihydrochloride 3 PWT000987 PRESTWICK H2N N

O Chiral

H C 3 O CH CH3

H H

PWT000988 PRESTWICK Prestw-1452 H H HO N

O Chiral H C 3 O CH3 O

CH3 CH3 H

H H PWT000989 PRESTWICK Prestw-1374 acetate O Cl

O

N

N CH3 PWT000990 PRESTWICK Prestw-1310 Phenylbutazone O

O O S CH O N N 3 O O N

PWT000991 PRESTWICK Prestw-991 O CH H3C 3

O O HO OH OH

S

PWT000992 PRESTWICK Prestw-992 malate N

CH3

O Chiral

N NH2 N N

OH PWT000993 PRESTWICK Prestw-993 Ribavirin O

HO OH O O O O S S H2N N PWT000994 PRESTWICK Prestw-994 Cl N

O

OH HO O

CH3 O

O NH2 PWT000995 PRESTWICK Prestw-995 Fluvoxamine maleate N F F F

S NH2

PWT000996 PRESTWICK Prestw-1321 Prothionamide N

CH3

F S O O Chiral

CH3 CH3 HO O CH3 CH3 H

F H PWT000997 PRESTWICK Prestw-997 Fluticasone propionate O F

ClH ClH

OH N N PWT000998 PRESTWICK Prestw-998 dihydrochloride Cl

S

ClH

N N N CH3 PWT000999 PRESTWICK Prestw-999 Proguanil hydrochloride NH NH CH Cl 3

HO O OH O OH O O OH

N N NH2

OH PWT001000 PRESTWICK Prestw-1000 Lymecycline HO H H CH3 N H3C CH3 O Chiral O O CH3 CH3 O

CH3 H PWT001001 PRESTWICK Prestw-1001 Alfadolone acetate H H HO H

O CH3Chiral

CH3 O

CH3 H PWT001002 PRESTWICK Prestw-1002 Alfaxalone H H HO H

CH3 O

H C N O 3 N CH PWT001003 PRESTWICK Prestw-1003 Azapropazone N N 3

CH3

ClH

CH3 N Prestw-1004 hydrochloride PWT001004 PRESTWICK OH CH3

OH NH2 Chiral OH

O OH H N NH2 H H 2 O O H2N

HO PWT001005 PRESTWICK Prestw-1005 Apramycin O N H O OH OH CH3

Chiral

H2N O O S N N H O O H H C OH PWT001006 PRESTWICK Prestw-1802 Darunavir 3 CH3 O O H

ClH

H3C N O OH N N S PWT001007 PRESTWICK Prestw-1007 Fursultiamine Hydrochloride S O

NH2 CH3 O OH S H C 3 O

NH O N NH2

PWT001008 PRESTWICK Prestw-1008 Gabexate mesilate H3C O O

O

Chiral O H H S N CH3 O NH2 N CH3 O CH PWT001009 PRESTWICK Prestw-1009 Pivampicillin O O 3 O CH3 CH3

Cl O N N O

O O OH HO PWT001010 PRESTWICK Prestw-1746 Lodoxamide N

+ Na

F Chiral O H H S N CH3 Cl N N CH CH3 PWT001011 PRESTWICK Prestw-1011 Flucloxacillin sodium O O3 O O

H3C N CH3 N N

PWT001012 PRESTWICK Prestw-1012 Trapidil N H3C N

COOH COOH

HO COOH

PWT001013 PRESTWICK Prestw-1013 citrate O N CH3

Chiral CH3 Cl N Cl H H PWT001014 PRESTWICK Prestw-1014 Sertraline H3C N CH3

OH PWT001015 PRESTWICK Prestw-1015 Ethamsylate O HO S OH O

CH O 3 N N N PWT001016 PRESTWICK Prestw-1016 Moxonidine N H3C N Cl

ClH

OH HO N CH PWT001017 PRESTWICK Prestw-1017 Etilefrine hydrochloride 3

O O Chiral

OH

CH3 PWT001018 PRESTWICK Prestw-1018 Alprostadil HO OH

H C 3 O O O O H PWT001019 PRESTWICK Prestw-1019 Tribenoside HO O

O Chiral CH CH 3 3 CH3 HO CH3

CH3 H

PWT001020 PRESTWICK Prestw-1020 Rimexolone H H O

H3C N CH3

O O CH3 H3C O O CH N 3 PWT001021 PRESTWICK Prestw-1021 O N CH3 N N O N

O + OH N N CH PWT001022 PRESTWICK Prestw-1774 3 O O

CH3 CH3 N

O OH OH H3C CH3 O HO CH CH N 3 PWT001023 PRESTWICK Prestw-1023 mucate OH OH OH 3

H3C CH3

O O + O N N N S O O PWT001024 PRESTWICK Prestw-1024 Nifurtimox H3C

N N N

PWT001025 PRESTWICK Prestw-1025 Letrozole N N

H C CH Chiral 3 N O 3 N N

O PWT001026 PRESTWICK Prestw-1829 Levofloxacin F O OH

ClH

CH3 NH2 N CH3 PWT001027 PRESTWICK Prestw-1027 hydrochloride O CH3

N

N

O H H O S CH N 3 N O Chiral CH H H O 3 O S CH N 3 O PWT001028 PRESTWICK Prestw-1028 Benzathine benzylpenicillin HO N CH O 3 O HO N CH3

N N F O PWT001029 PRESTWICK Prestw-1029 N O

O H C N N 3 S O

CH3 O N CH3 Prestw-1030 Torsemide PWT001030 PRESTWICK N

ClH

F F F OH

N CH PWT001031 PRESTWICK Prestw-1031 Halofantrine hydrochloride 3 CH3

Cl Cl

ClH

O

S CH3 O O N PWT001032 PRESTWICK Prestw-1032 hydrochloride N H3C CH3

CH3

O CH3 Chiral

CH3 O CH3

H H O

H H PWT001033 PRESTWICK Prestw-1033 acetate O

CH3

Br Br

O Chiral

H3C O CH + 3 N

+ CH CH H H C N 3 3 3 H H PWT001034 PRESTWICK Prestw-1034 Pancuronium bromide O H

O CH3

ClH

N O CH3 PWT001035 PRESTWICK Prestw-1035 Molindone hydrochloride N O CH3 CH2 Chiral

+ N H Cl OH Cl H N

N H HO H PWT001036 PRESTWICK Prestw-1036 Alcuronium chloride + N

H2C

O Chiral

O N N OH PWT001037 PRESTWICK Prestw-1037 Zalcitabine H2N

ClH O Chiral H C 3 O OH H C PWT001038 PRESTWICK Prestw-1038 Methyldopate hydrochloride 3 NH2 OH

ClH

F Chiral

OH N PWT001039 PRESTWICK Prestw-1039 hydrochloride N H O CH3

CH3 CH3 + N N H C O 3 H C N 3

O CH3

OH CH3 CH3 + OH N PWT001040 PRESTWICK Prestw-1040 Pyrvinium pamoate N H C O 3 H C N 3

O CH3

N Chiral H C 3 N O PWT001041 PRESTWICK Prestw-1041 Etomidate O H3C

Cl

CH3

+ N CH3 HO CH PWT001042 PRESTWICK Prestw-1042 chloride 3 O OH S HO O H OH O N CH3

CH3 CH3

H OH Prestw-1043 Penbutolol sulfate O N CH PWT001043 PRESTWICK 3

CH3 CH3

O Chiral H C O 3 O CH3 O O CH3 HO

CH3 H O

PWT001044 PRESTWICK Prestw-1044 Prednicarbate H H O

Cl

S

O O Cl + N HO PWT001045 PRESTWICK Prestw-1045 Sertaconazole nitrate O N N Cl

CH3 OH Chiral

H3C O O

N O CH3 PWT001046 PRESTWICK Prestw-1046 N

HO O

NH N S 2 O O PWT001047 PRESTWICK Prestw-1047 O

HO

N O N CH PWT001048 PRESTWICK Prestw-1048 Piperacetazine 3 S

OH N O N PWT001049 PRESTWICK Prestw-1049 Oxyphenbutazone H3C O Cl N CH3 H N N 2 S PWT001050 PRESTWICK Prestw-1050 O O O

ClH

O O N

N N O CH PWT001051 PRESTWICK Prestw-1051 Moricizine hydrochloride 3 O S

O I NH HO 2 PWT001052 PRESTWICK Prestw-1052 Iopanoic acid H3C I I

ClH

Chiral H H N S CH N 3 O CH3 N CH 3 CH PWT001053 PRESTWICK Prestw-1053 Pivmecillinam hydrochloride O O 3 O H3C O

O OH S O

O H C 3 O CH PWT001054 PRESTWICK Prestw-1054 Levopropoxyphene napsylate N 3 CH 3 CH3

ClH

CH3

N O

O PWT001055 PRESTWICK Prestw-1055 hydrochloride

O N O Chiral F F N O

PWT001056 PRESTWICK Prestw-1056 Trifluridine F OH OH ClH

OH

O N CH3 PWT001057 PRESTWICK Prestw-1057 Oxprenolol hydrochloride CH CH O 2 3

ClH

O N N

H3C PWT001058 PRESTWICK Prestw-1058 Ondansetron Hydrochloride N

CH3

CH3 O O N CH3 O CH3 ClH PWT001059 PRESTWICK Prestw-1059 hydrochloride

NH2

O O OH N PWT001060 PRESTWICK Prestw-1060 Oxaprozin

CH3

O N O

PWT001061 PRESTWICK Prestw-1061

O OH O N CH3 I I I I O O N N HO N N CH PWT001062 PRESTWICK Prestw-1062 Ioxaglic acid 3 O I O I CH3

ClH

CH3 N PWT001063 PRESTWICK Prestw-1063 Naftifine hydrochloride ClH

N CH3 H3C O CH3 PWT001064 PRESTWICK Prestw-1064 hydrochloride O

CH3 N O N

PWT001065 PRESTWICK Prestw-1065 Milrinone N

Br

O O + N CH3 H C CH PWT001066 PRESTWICK Prestw-1066 bromide 3 3

O

+ Na

S O H H S CH N 3

N CH3 PWT001067 PRESTWICK Prestw-1067 Ticarcillin sodium HO O O O O

O O O O HO HO OH OH OH OH CH N 3 N

N S CH PWT001068 PRESTWICK Prestw-1068 Thiethylperazine dimalate 3

S

HO O

OH PWT001069 PRESTWICK Prestw-1069 Mesalamine H2N

O N OH N PWT001070 PRESTWICK Prestw-1362 Vorinostat O HO OH

N N O N N N N O

PWT001071 PRESTWICK Prestw-1071 Imidurea N O O N O O

N O N S F N O F PWT001072 PRESTWICK Prestw-1072 Lansoprazole F CH3

Cl

H3C H N O + CH PWT001073 PRESTWICK Prestw-1073 chloride 2 N 3

O CH3 CH3

O CH3 Chiral

CH3 O CH3 CH H 3 O

H H PWT001074 PRESTWICK Prestw-1074 O Cl

ClH

CH3 H

O N CH3 OH PWT001075 PRESTWICK Prestw-1075 (R)- hydrochloride

O O OH H3C CH3 PWT001076 PRESTWICK Prestw-1076 Ciprofibrate Cl Cl

O Chiral CH3

CH3 H

H H PWT001077 PRESTWICK Prestw-1420 Formestane O OH + Na

Chiral O H H S CH N 3 N CH PWT001078 PRESTWICK Prestw-1078 Benzylpenicillin sodium O 3 O O

Chiral CH3 O

O O + H3C N Na S CH3 N CH3 PWT001079 PRESTWICK Prestw-1803 Methicillin sodium O O O

H3C CH3

S N N PWT001080 PRESTWICK Prestw-1080 Methiazole N O O CH3

ClH

CH3 H

O N CH3 OH PWT001081 PRESTWICK Prestw-1081 (S)-propranolol hydrochloride

O OH HO

O

H3C Chiral HO N CH PWT001082 PRESTWICK Prestw-1082 (-)- fumarate salt 3 N H

CH3

HO H O

O O H + PWT001083 PRESTWICK Prestw-1294 Isosorbide mononitrate O N O

ClH OH Chiral CH3

N CH3 HO CH PWT001084 PRESTWICK Prestw-1516 Levalbuterol hydrochloride 3 HO O Chiral H C O NH2 3 O S H C O O 3 O O O CH PWT001085 PRESTWICK Prestw-1493 3 CH3

Chiral NH2 O PWT001086 PRESTWICK Prestw-1086 D-cycloserine N O

Chiral H3C O

N N

H N N N 2 OH O

PWT001087 PRESTWICK Prestw-1804 Nelarabine OH

OH

OH N CH3 PWT001088 PRESTWICK Prestw-1088 (+,-)-Synephrine HO

Chiral NH2 O PWT001089 PRESTWICK Prestw-1089 (S)-(-)-Cycloserine N O

CH3

O CH3 O CH PWT001090 PRESTWICK Prestw-1090 Homosalate 3 OH

O Chiral

O OH O N H3C N OH O PWT001091 PRESTWICK Prestw-1091 Spaglumic acid O OH CH3 O

OH O

CH3 O N N PWT001092 PRESTWICK Prestw-1092 N

CH3

H C 3 O

O O

H3C OH PWT001093 PRESTWICK Prestw-1443 Misoprostol HO CH3

N N O O S N O

PWT001094 PRESTWICK Prestw-1094 Sulfadoxine O CH3 H2N CH3

ClH

O CH3 N O CH3 PWT001095 PRESTWICK Prestw-1095 hydrochloride OH

OH Chiral CH 3 OH H

PWT001096 PRESTWICK Prestw-1096 Estriol H H HO

ClH

OH Chiral HO N CH3 PWT001097 PRESTWICK Prestw-1097 (-)-Isoproterenol hydrochloride CH3 HO

F

N N N

Prestw-1339 Sarafloxacin O PWT001098 PRESTWICK F O OH N O N N N PWT001099 PRESTWICK Prestw-1099 Nialamide O

O N O

F S H3C N N CH3 F PWT001100 PRESTWICK Prestw-1195 Toltrazuril F O O

H Chiral OH

N O CH H 3 CH3 H O N H O PWT001101 PRESTWICK Prestw-1101 Perindopril O

CH3

ClH

HO N CH PWT001102 PRESTWICK Prestw-1102 hydrochloride 3 O HO OH CH3

O

OH PWT001103 PRESTWICK Prestw-1202 4-aminosalicylic acid H2N OH

O

OH O N N H2N OH CH3 PWT001104 PRESTWICK Prestw-1104 Clonixin Lysinate Cl NH2

O

H3C O H3C

O H C 3 N CH2 H C N O 3

N N H3C CH3 PWT001105 PRESTWICK Prestw-1105 Verteporfin O O O OH

CH3 OH Chiral CH H H 3 H3C S N O O O N PWT001106 PRESTWICK Prestw-1106 Meropenem HO N CH 3

H3C

O

H3C O O HO H CH3 N N PWT001107 PRESTWICK Prestw-1107 Ramipril H O

N O H C PWT001108 PRESTWICK Prestw-1108 3 N

O CH3

CH H3C 3 Chiral HO

O CH3 H3C OH O O CH3 OH O N H3C H C CH3 3 O O N N PWT001109 PRESTWICK Prestw-1109 Rifabutin O O CH3 N

H3C CH3

N N H C 3 N O PWT001110 PRESTWICK Prestw-1110 Parbendazole O CH3

ClH

N CH3 CH CH3 PWT001111 PRESTWICK Prestw-1111 Mecamylamine hydrochloride 3

CH3

ClH

O CH3

N CH PWT001112 PRESTWICK Prestw-1112 Procarbazine hydrochloride 3 H C N 3 N O O S HO OH

O H2N

N NH2 OH O N N O H N N OH N H O O NH2 PWT001113 PRESTWICK Prestw-1113 Viomycin sulfate N N HO O N NH2 O

O OH S H C 3 O

N CH3 O O CH3 N CH3 N N N H Prestw-1114 Saquinavir mesylate O NH OH PWT001114 PRESTWICK 2 H O

CH O 3 O + N N O NH PWT001115 PRESTWICK Prestw-1115 Ronidazole O 2 N

ClH

O O Chiral H3C S S O S NH PWT001116 PRESTWICK Prestw-1116 Dorzolamide hydrochloride O 2

N CH3

N

N O N PWT001117 PRESTWICK Prestw-1117 F

Cl

S O Chiral H H S N H2N N + N N N O PWT001118 PRESTWICK Prestw-1118 Cefepime hydrochloride O CH3 CH3 O OH

CH3 CH O 3 CH3 O O CH3 HO CH3 H CH3 PWT001119 PRESTWICK Prestw-1119 Clocortolone pivalate Cl H O F O O F OH

N N PWT001120 PRESTWICK Prestw-1120 Nadifloxacin HO CH3

ClH

N O N N N PWT001121 PRESTWICK Prestw-1283 Buspirone hydrochloride N

O

N

N N N H3C

CH3

Prestw-1222 Anastrozole H C N PWT001122 PRESTWICK 3

CH3

ClH

NH Chiral OH O OH O 2 OH O

OH PWT001123 PRESTWICK Prestw-1399 Doxycycline hydrochloride H H CH OH N 3 CH H3C 3

O H O S CH3 N CH O 3 PWT001124 PRESTWICK Prestw-1345 Sulbactam OH O

F H C 3 N F N N

O PWT001125 PRESTWICK Prestw-1414 Fleroxacin F O OH

+ K H O OH

N O PWT001126 PRESTWICK Prestw-1315 Clavulanate potassium salt O O CH3 O

PWT001127 PRESTWICK Prestw-1482 Valproic acid HO CH3

ClH

H3C CH3 O N PWT001128 PRESTWICK Prestw-1280 hydrochloride N

CH3

CH3 CH3 Chiral HO O CH3 H C 3 O OH CH O 3 OH OH N CHH3C 3 H3C O PWT001129 PRESTWICK Prestw-1478 Rifaximin O N O N O CH3 CH3

O Chiral

O CH3

H

PWT001130 PRESTWICK Prestw-1473 Estradiol Valerate H H H3C HO

O

HS OH

N CH3 PWT001131 PRESTWICK Prestw-1206 Acetylcysteine O

O O Chiral H3C CH3 CH3 O CH CH3 H 2

H H PWT001132 PRESTWICK Prestw-1435 acetate O

CH3

ClH

Br

CH3 N PWT001133 PRESTWICK Prestw-1246 Bromhexine hydrochloride Br

NH2 S O CH PWT001134 PRESTWICK Prestw-1223 Anethole-trithione 3 S S

O Chiral

O CH3 O CH O HO 3 CH H O PWT001135 PRESTWICK Prestw-1476 Amcinonide 3 F H O

O CH3 H3C N N O N PWT001136 PRESTWICK Prestw-1256 N CH3

N

CH3 O O PWT001137 PRESTWICK Prestw-1262 Carvedilol N O OH

N

N N PWT001138 PRESTWICK Prestw-1282 Methenamine N

ClH

H N PWT001139 PRESTWICK Prestw-1308 Phentermine hydrochloride 2 CH H3C 3

N Cl O N N O N Cl PWT001140 PRESTWICK Prestw-1394 Diclazuril Cl N N

N H2N N

O O PWT001141 PRESTWICK Prestw-1249 Famciclovir H3C O

O CH3

ClH

OH

PWT001142 PRESTWICK Prestw-1398 Dopamine hydrochloride H2N OH

O OH Chiral

S O O N CH2 H2N N N S PWT001143 PRESTWICK Prestw-1263 Cefdinir H N OH

Cl O

N OH PWT001144 PRESTWICK Prestw-1261 Carprofen CH3

O O S H2N F F N N F PWT001145 PRESTWICK Prestw-1371 Celecoxib

H3C

O

OH N N N N N

N PWT001146 PRESTWICK Prestw-1258 Candesartan O

CH3

F Chiral N NH N 2

O N N PWT001147 PRESTWICK Prestw-1483 Fludarabine HO HO OH HO N Chiral O N NH2

N N PWT001148 PRESTWICK Prestw-1484 Cladribine HO Cl

O H3C

N O N O N S N N

O N H C PWT001149 PRESTWICK Prestw-1356 Vardenafil 3

H3C H3C

F

N OH N F N PWT001150 PRESTWICK Prestw-1417 Fluconazole N N N

O N O

PWT001151 PRESTWICK Prestw-1203 5-fluorouracil N F

+ Na

O PWT001152 PRESTWICK Prestw-1487 Mesna S SH O O

Cl Cl

PWT001153 PRESTWICK Prestw-1444 Mitotane Cl Cl

H3C OH O N

CH3 O O N H C PWT001154 PRESTWICK Prestw-1497 Ambrisentan 3 Cl OH O

PWT001155 PRESTWICK Prestw-1479 Triclosan Cl Cl

O O F OH

N N N PWT001156 PRESTWICK Prestw-1401 Enoxacin N H3C

O

OH

O

CH3 PWT001157 PRESTWICK Prestw-1307 hydrochloride ClH N

CH3

CH3 N CH3 H N H N N PWT001158 PRESTWICK Prestw-1187 Granisetron H O

OH O OH

PWT001159 PRESTWICK Prestw-1224 Anthralin

Cl Cl N N

NH2 PWT001160 PRESTWICK Prestw-1492 N H2N

CH3 H3C Cl O CH3 O PWT001161 PRESTWICK Prestw-1383 Clofibrate O OChiral O N N N N

PWT001162 PRESTWICK Prestw-1830 Dexrazoxane hydrochloride CH3 O O

Cl N Cl N PWT001163 PRESTWICK Prestw-1229 O N O

HO CHChiral CH3

H

PWT001164 PRESTWICK Prestw-1405 Ethinylestradiol H H HO

HO O Chiral CH3 O CH3 CH HO 3 O CH3 H

F H PWT001165 PRESTWICK Prestw-1419 Fluocinolone acetonide O F

NH2 O O F OH H C 3 N N PWT001166 PRESTWICK Prestw-1343 Sparfloxacin N F

CH3

N

N

PWT001167 PRESTWICK Prestw-1390 Cl

CH CH O 3 OH CH 3 CH3H3C 3 HO N O CH3 HO O O CH3 O CH CH H C 3 3 3 O O H C 3 O PWT001168 PRESTWICK Prestw-1378 H C 3 CH3

HO O CH3 ClH

N PWT001169 PRESTWICK Prestw-1199 hydrochloride N H3C N

CH3

Cl OH CH N 3

CH3 PWT001170 PRESTWICK Prestw-1352 Tulobuterol H3C

Chiral CH3 N CH3 HO O N N

PWT001171 PRESTWICK Prestw-1196 Topotecan H C O 3 HO O

HO CH 3 N H3C O O HO N HO PWT001172 PRESTWICK Prestw-1232 Atorvastatin

F

H C CH 3 N 3 CH 3 HO H3C N H3C CH3 O CH3 HO HO O HO CH H3C 3 O O CH O 3 H3C CH Prestw-1234 Azithromycin 3 PWT001173 PRESTWICK O OH H C O 3 CH3

CH O 3

CH3 CH3

PWT001174 PRESTWICK Prestw-1286 Ibudilast N N CH3

OH Cl

N N N N N N PWT001175 PRESTWICK Prestw-1433 Losartan

CH3 H3C N H

O O

HO S CH3 H PWT001176 PRESTWICK Prestw-1236 Benztropine mesylate O

Br

O Chiral

CH3 O CH3 + N CH H 3 CH N 3 PWT001177 PRESTWICK Prestw-1359 Vecuronium bromide H H H3C O H O

CH3

H3C N CH3 N N

N

PWT001178 PRESTWICK Prestw-1350 Telmisartan O

HO

Chiral

ClH N H OH PWT001179 PRESTWICK Prestw-1490 hydrochloride O HO H CH2

PWT001180 PRESTWICK Prestw-1241 Bifonazole N N

O O F OH H C 3 N N PWT001181 PRESTWICK Prestw-1265 Gatifloxacin N O H3C

N N N N O O CH3 S N O OH H3C CH O PWT001182 PRESTWICK Prestw-1244 Bosentan 3 O

CH3 HO Chiral

O O HO N N F PWT001183 PRESTWICK Prestw-1266 Gemcitabine F NH2

CH3 CH3 H3C N HO N O

O

N PWT001184 PRESTWICK Prestw-1190 Olmesartan O N N H3C N O O

ClH

HO OH PWT001185 PRESTWICK Prestw-1480 Racepinephrine hydrochloride N

HO CH3

N Cl

S H C H 3C PWT001186 PRESTWICK Prestw-1189 Montelukast 3 OH O OH

Chiral O O OH O OH O CH3 H O H3C O N O CH3 H C CH H 3 3 O O CH H C 3 PWT001187 PRESTWICK Prestw-1180 Docetaxel 3 CH3 HO O OH

H3C N CH3

O O

H C O O 3 O

+ O PWT001188 PRESTWICK Prestw-1376 N O

H3C

CH3

N N PWT001189 PRESTWICK Prestw-1291 Imiquimod

N NH2 CH3 O H C CH 3 O 3 O O P

N O

PWT001190 PRESTWICK Prestw-1423 Fosinopril O HO

O H C 3 N N N

N

CH3 PWT001191 PRESTWICK Prestw-1290 Imatinib N N

N

O O Chiral F OH H N N PWT001192 PRESTWICK Prestw-1446 Moxifloxacin O H C N H 3

OH Chiral N N

O H C CH O 3 O 3 OH HO OH PWT001193 PRESTWICK Prestw-1421 Formoterol fumarate OH N N O H3C CH3 O O OH

H3C N S N N

O PWT001194 PRESTWICK Prestw-1338 Rufloxacin F O OH

HO O CH3 O OH OH O H

CH3 CH3 PWT001195 PRESTWICK Prestw-1319 Pravastatin HO

ClH

O N N

CH3

O PWT001196 PRESTWICK Prestw-1337 Rosiglitazone Hydrochloride S N O CH3

O N CH3

O

CH3 H C PWT001197 PRESTWICK Prestw-1334 Rivastigmine 3 N

CH3

N H3C N CH3

O N N PWT001198 PRESTWICK Prestw-1342 Sildenafil O O S N N CH3 H3C O

O OH

O CH3

PWT001199 PRESTWICK Prestw-1207 Acetylsalicylic acid O

OH Cl Cl Cl

HO PWT001200 PRESTWICK Prestw-1472 Hexachlorophene Cl Cl Cl

O H C CH Chiral H 3 3 N CH3 N H N O HO O O S CH CH S 3 Prestw-1764 Nelfinavir mesylate HO 3 PWT001201 PRESTWICK OH

Chiral

N F O F O CH F 3 N PWT001202 PRESTWICK Prestw-1749 Silodosin OH H2N O

CH3 CH3 O O

H C O 3 O O

CH PWT001203 PRESTWICK Prestw-1777 3 N H3C CH3 N N N

PWT001204 PRESTWICK Prestw-1739 Nevirapine N CH O 3

ClH

N CH3 O N PWT001205 PRESTWICK Prestw-1707 Doxapram hydrochloride O

O N NH2

H3C O PWT001206 PRESTWICK Prestw-1718 Amlexanox CH3 O OH

ClH

H C 3 N CH PWT001207 PRESTWICK Prestw-1719 Amorolfine hydrochloride O 3 CH3 H3C CH3 CH3

O O F OH

N N PWT001208 PRESTWICK Prestw-1786 Enrofloxacin N

CH3

Chiral

HO

O NH2 HO N CH PWT001209 PRESTWICK Prestw-1784 3 O

CH3

N O N

H3C O O PWT001210 PRESTWICK Prestw-1778 Troxipide O CH3 CH3 O

CH3 PWT001211 PRESTWICK Prestw-1773 Ipriflavone O O CH3

OHChiral OH

N PWT001212 PRESTWICK Prestw-1762 Ezetimibe F O F

O OH

N N PWT001213 PRESTWICK Prestw-1761 Rizatriptan benzoate N N

N CH3

H3C

O

HO OH

O NH N N N O PWT001214 PRESTWICK Prestw-1760 Tegaserod maleate H C 3

N H3C

+ Na

CH3 N O O O CH3 F Prestw-1758 Pantoprazole sodium S PWT001215 PRESTWICK F O N N

F O N O PWT001216 PRESTWICK Prestw-1753 Tegafur N O

O + O N O HO PWT001217 PRESTWICK Prestw-1732 Tolcapone HO

CH3 OH Chiral CH2 H3C

H

PWT001218 PRESTWICK Prestw-1716 H O

H N O O NH PWT001219 PRESTWICK Prestw-1711 Felbamate 2 2 O O

OHChiral CH3

H

H H O

PWT001220 PRESTWICK Prestw-1709 Estramustine N O Cl Cl

ClH

H3C Chiral N

O PWT001221 PRESTWICK Prestw-1708 (R)-Duloxetine hydrochloride S

ClH

O N O H C PWT001222 PRESTWICK Prestw-1706 Donepezil hydrochloride 3 H C 3 O

O

PWT001223 PRESTWICK Prestw-1703 1,8-Dihydroxyanthraquinone OH O OH

O + N O

N S

N

PWT001224 PRESTWICK Prestw-1733 Nitazoxanide O O O

CH3 Chiral CH3

H3C O N OH PWT001225 PRESTWICK Prestw-1748 O

O O

H3C PWT001226 PRESTWICK Prestw-1721 Avobenzone O CH H3C CH3 3

Chiral

O H C 3 O CH3 CH3 O CH3 H

PWT001227 PRESTWICK Prestw-1715 acetophenide H H O

N CH O 3 O PWT001228 PRESTWICK Prestw-1763 Actarit HO

N O H C O S S PWT001229 PRESTWICK Prestw-1710 Ethoxzolamide 3 NH O 2

CH3 O O N

OH OH OH OH N O PWT001230 PRESTWICK Prestw-1722 maleate O

NH2

PWT001231 PRESTWICK Prestw-1717 Aminacrine N O Chiral

O H O N OH Prestw-1792 Pidotimod N PWT001232 PRESTWICK H S

ClH

O + N O

O O H C N PWT001233 PRESTWICK Prestw-1766 hydrochloride 3 O O

H3C N CH3

H O Chiral

N

PWT001234 PRESTWICK Prestw-1770 H O N N S N

OH Chiral

N N O OH H N N S N H3C N S N O PWT001235 PRESTWICK Prestw-1726 Cefpiramide O N CH3

O OH

HO

HO N PWT001236 PRESTWICK Prestw-1713 Fenoldopam HO Cl

O

OH

H3C O

PWT001237 PRESTWICK Prestw-1714 Adapalene H H

H

OH2

OH2

O OH

I I PWT001238 PRESTWICK Prestw-1705 Diatrizoic acid dihydrate O O H3C N N CH3 I CH3 O S O N

H3C N

O

PWT001239 PRESTWICK Prestw-1743 N O S O

CH3

O NH PWT001240 PRESTWICK Prestw-1776 Phenprobamate 2 O

O Chiral H3C O S O NH N N 2 N O O O O PWT001241 PRESTWICK Prestw-1730 Cefuroxime axetil O O H3C CH O 3

N N O N Cl PWT001242 PRESTWICK Prestw-1720 Anagrelide Cl

CH3 O O

N PWT001243 PRESTWICK Prestw-1701 Clopidogrel S Cl

O

O PWT001244 PRESTWICK Prestw-1723 Benzoxiquine N

S

PWT001245 PRESTWICK Prestw-1785 N OH2

OH2

O OH Chiral CH3 O N O PWT001246 PRESTWICK Prestw-1769 Enalaprilat dihydrate N OH

NH2 CH3 O

PWT001247 PRESTWICK Prestw-1791 H3C OH

ClH

H3C O

H N Prestw-1787 Homoveratrylamine 2 PWT001248 PRESTWICK O

CH3

OH2

O OH HO P OH PWT001249 PRESTWICK Prestw-1731 Zoledronic acid hydrate N N OH P O OH

Chiral H3C

O CH3 H2N H3C O O O S N O O O N N N PWT001250 PRESTWICK Prestw-1727 Cefpodoxime proxetil H O S O CH3

H3C

N N N N O N H C 3 N PWT001251 PRESTWICK Prestw-1736 Irbesartan

O HO S OH O Chiral

HO O N N HO

N N

PWT001252 PRESTWICK Prestw-1737 Indinavir sulfate O N CH3

CH3 H3C H3C CH3

CH3 CH3 N

PWT001253 PRESTWICK Prestw-1750 Terbinafine

H2N

N PWT001254 PRESTWICK Prestw-1700 dihydrochloride ClH ClH N

CHChiral

N PWT001255 PRESTWICK Prestw-1734 Rasagiline

CH3 Chiral CH3 O CH3 O

OH CH HO 3 O

CH3 H CH3 PWT001256 PRESTWICK Prestw-1712 Flumethasone pivalate F H O F

H3C N O N PWT001257 PRESTWICK Prestw-1756 Cl

O O S H2N CH3

O PWT001258 PRESTWICK Prestw-1759 Valdecoxib N

ClH

O O Chiral F OH

N N PWT001259 PRESTWICK Prestw-1740 Besifloxacin hydrochloride Cl

NH2 Chiral

S CH3 O OH N

H3C N N N O N N S

CH3 O O H C CH PWT001260 PRESTWICK Prestw-1782 Ritonavir 3 3

ClH

O OH Chiral OH OH

O H O O OH O NH2 CH3 PWT001261 PRESTWICK Prestw-1752 Epirubicin hydrochloride O OH

CH3

Cl Chiral

O O O CH3 CH O HO 3 O CH3 H PWT001262 PRESTWICK Prestw-1741 Loteprednol etabonate H H

O

OH O Chiral HO OH O OH

OH CH3

N CH PWT001263 PRESTWICK Prestw-1744 tartrate 3 H3C CH3

CH3

ClH

F

N N

O Prestw-1775 hydrochloride H C PWT001264 PRESTWICK 3

F O O CH3

CH3

O O S CH3 N N

H3C O O N

O O

PWT001265 PRESTWICK Prestw-1772 Ampiroxicam O

CH3

H3C ClH N O N N

PWT001266 PRESTWICK Prestw-1781 hydrochloride N

CH3 OH2

OH O P OH O PWT001267 PRESTWICK Prestw-1738 Risedronic acid monohydrate P HO HO OH N

ClH

Chiral

O H PWT001268 PRESTWICK Prestw-1783 Palonosetron hydrochloride N N H

OH Chiral CH3 CH OH 3 CH3 H

PWT001269 PRESTWICK Prestw-1780 Oxymetholone H H O H

Chiral O CH3

O CH3 HO

PWT001270 PRESTWICK Prestw-1765 Latanoprost HO OH

O O S O O O CH 3 CH3 + O N + O Chiral O O N S O H3C O CH3 O O Prestw-1745 Cisatracurium besylate O PWT001271 PRESTWICK H C CH 3 O O 3 O H C O CH 3 CH 3 3 CH3

+ + Na Na

Chiral O O N N O O H N N PWT001272 PRESTWICK Prestw-1794 Pemetrexed disodium 2 N

O O

Chiral CH3 O N N S N HO CH O 3 N PWT001273 PRESTWICK Prestw-1793 Raltitrexed O O OH O Chiral O OH OH N O N S O PWT001274 PRESTWICK Prestw-1729 Ceftibuten N S

H2N

Chiral H3C

N N N H3C CH N 3 O N PWT001275 PRESTWICK Prestw-1735 Valsartan O HO

ClH

O NH2 H C 3 N

H C PWT001276 PRESTWICK Prestw-1788 Milnacipran hydrochloride 3

Cl

Cl O N

N PWT001277 PRESTWICK Prestw-1768 Triclabendazole Cl S

CH3

OH O Chiral HO OH O OH

N PWT001278 PRESTWICK Prestw-1751 Brimonidine L-Tartrate N N N N Br

O OH Chiral CH O 3 H3C HO CH3 O H CH3 H PWT001279 PRESTWICK Prestw-1704 Desonide H H O

NH2 Chiral N S

O N HO CH PWT001280 PRESTWICK Prestw-1728 Cefprozil O 3 O OH COMMENT

Enzyme

Not identified

Enzyme

Receptor Ionotropic receptor

Carrier

Carrier

Enzyme

Enzyme

Protein Enzyme

Enzyme

Enzyme

Enzyme

Enzyme

Ion channel Enzyme

Enzyme

Ribosome

GPCR

GPCR Enzyme

Ribosome

Enzyme

Ionotropic receptor Enzyme

Ribosome

Enzyme

Ionotropic receptor

Enzyme

DNA

Ion channel GPCR

GPCR

Enzyme

Enzyme

GPCR

GPCR

Receptor Ion channel

Ion channel

Ion channel

GPCR

Enzyme

Transmembrane receptor GPCR

Ion channel

Ion channel

GPCR

GPCR

Enzyme

GPCR Ion channel

GPCR

GPCR

Enzyme

Enzyme

GPCR

GPCR Carrier

Enzyme

Carrier

Ionotropic receptor

Ion channel Nuclear receptor

GPCR

GPCR

GPCR

DNA

Nuclear receptor

Enzyme GPCR

Enzyme

Ion channel

Not identified

DNA

GPCR Carrier

GPCR

Enzyme

Nuclear receptor

GPCR

Enzyme Enzyme

GPCR

Protein

GPCR

Carrier

GPCR

GPCR Nuclear receptors

Nuclear receptor

Carrier

Nuclear receptors

GPCR Enzyme

GPCR

GPCR

GPCR

Nuclear receptor Receptor

Nuclear receptor

GPCR

Not identified

Enzyme

GPCR Enzyme

Enzyme

Nuclear receptor

GPCR

Nuclear receptor

Transmembrane receptor

GPCR GPCR

Ion channel

GPCR

Ribosome

GPCR

Enzyme Ribosome

Ion channel

Enzyme

Membrane

Ion channel

Ribosome

Nuclear receptor GPCR

Membrane

GPCR

GPCR

Ribosome

Enzyme Ribosome

Protein

Ionotropic receptor

GPCR

Ribosome

Ribosome

Ribosome Ionotropic receptor

DNA

Ion channel

Enzyme

Ion channel DNA

GPCR

Enzyme

Enzyme

Enzyme

Enzyme

Not identified Enzyme

Enzyme

Enzyme

Enzyme

Nuclear receptor Enzyme

Enzyme

Enzyme

Enzyme

Ionotropic receptor Enzyme

Transmembrane receptor

GPCR

Enzyme

Enzyme

GPCR Enzyme

GPCR

GPCR

Ion channel

Enzyme

GPCR

Nuclear receptor Enzyme

Enzyme

Enzyme

Enzyme

Nuclear receptors

Enzyme

GPCR Protein

Enzyme

Enzyme

GPCR

Nuclear receptor

GPCR Protein

Enzyme

Enzyme

Carrier

Enzyme

Enzyme

GPCR GPCR

Enzyme

Protein

GPCR

GPCR

GPCR Enzyme

GPCR

GPCR

Carrier

Enzyme Enzyme

GPCR

Receptor

Ionotropic receptor

Enzyme

Enzyme

Coenzyme Ion channel

GPCR

GPCR

Carrier Nuclear receptor

Carrier

Enzyme

GPCR Carrier

Not identified

GPCR

Carrier

Ion channel

GPCR Ionotropic receptor

Ion channel

Enzyme

Carrier

Ion channel

Enzyme Nuclear receptor

Nuclear receptor

Nuclear receptor

Carrier

GPCR

GPCR

Nuclear receptor Enzyme

Nuclear receptor

GPCR

GPCR

Enzyme

Membrane

Ion channel GPCR

GPCR

GPCR

Transmembrane protein

Ionotropic receptor

Carrier GPCR

GPCR

Enzyme

Enzyme

Ionotropic receptor

Nuclear receptor Enzyme

Ribosome

GPCR

Enzyme

Ion channel

GPCR

Ribosome GPCR

Enzyme

GPCR

GPCR

Ion channel

GPCR

Enzyme Ribosome

Transmembrane receptor

Carrier

Enzyme

Ion channel

GPCR

Ribosome GPCR

Transmembrane receptor

GPCR

Enzyme

Enzyme

Carrier Enzyme

GPCR

GPCR

Enzyme

Enzyme

Enzyme Ion channel

Not identified

GPCR

GPCR

Carrier

GPCR Carrier

Enzyme

GPCR

Carrier

Enzyme

GPCR

GPCR GPCR

Ion channel

GPCR

Enzyme

Carrier

DNA

Ion channel Enzyme

GPCR

GPCR

GPCR

Nuclear receptor

Protein GPCR

Enzyme

Carrier

Ion channel

Enzyme

Carrier GPCR

Carrier

Enzyme

GPCR

GPCR

GPCR Nuclear receptor

GPCR

Ion channel

GPCR

Ion channel Enzyme

Carrier

GPCR

Membrane

Enzyme

Ribosome

GPCR GPCR

Carrier

Ribosome

Ribosome

Enzyme

Nuclear receptors

Enzyme GPCR

Nuclear receptor

Not identified

Enzyme Not identified

Enzyme

Ion channel

Membrane Ion channel

Carrier

Enzyme

Enzyme

Ion channel Enzyme

GPCR

Enzyme

Carrier Carrier

Enzyme

GPCR

Enzyme Enzyme

Enzyme

Enzyme

Enzyme

DNA

Enzyme Nuclear receptor

Ion channel

GPCR

Nuclear receptor Receptor

Enzyme

GPCR

Receptor

Enzyme GPCR

Ribosome

GPCR

GPCR

GPCR

Ionotropic receptor GPCR

Enzyme

Enzyme

Enzyme DNA

Enzyme

GPCR

Enzyme

GPCR Enzyme

Nuclear receptor

Ion channel

GPCR

GPCR Enzyme

GPCR

Enzyme

Membrane

DNA Receptor

DNA

Enzyme

Enzyme

Enzyme

Enzyme Enzyme

Not identified

GPCR

Enzyme

GPCR

GPCR Not identified

GPCR

Ribosome

Carrier

Enzyme

GPCR

GPCR Carrier

Ion channel

Enzyme

Membrane Enzyme

Enzyme

GPCR

Enzyme

Protein Enzyme

Enzyme

Enzyme

GPCR

GPCR Enzyme

GPCR

GPCR

Enzyme Ionotropic receptor

Not identified

Carrier

GPCR

Ribosome

Enzyme Not identified

Enzyme

Membrane

Enzyme Transmembrane receptor

DNA

GPCR

Ribosome

Ion channel Ion channel

GPCR

Enzyme

Enzyme

GPCR

Enzyme Not identified

Enzyme

Enzyme

Enzyme

Ion channel

Nuclear receptor DNA

Pump

GPCR

Carrier

GPCR

Ion channel

Enzyme Carrier

GPCR

Enzyme

GPCR

Enzyme

Enzyme

Enzyme Enzyme

Not identified

GPCR

Enzyme

Ionotropic receptor

Enzyme Coenzyme

Enzyme

DNA

GPCR

GPCR

Ionotropic receptor GPCR

Enzyme

Not identified GPCR

Receptor

Not identified

Not identified

Enzyme Ionotropic receptor

GPCR

GPCR Enzyme

Ribosome

Enzyme

Enzyme Enzyme

Enzyme

Carrier

GPCR

Enzyme GPCR

Enzyme

GPCR

Enzyme

Enzyme Not identified

Enzyme

Not identified

Ion channel

DNA Transmembrane receptor

Ionotropic receptor

GPCR

Enzyme

Ion channel Ionotropic receptor

GPCR

Enzyme

GPCR Not identified

Ion channel

GPCR

Nuclear receptors

Enzyme

Enzyme

Nuclear receptor GPCR

GPCR

DNA

Enzyme

Enzyme Enzyme

Enzyme

Receptor

Ion channel Nuclear receptor

DNA

Ribosome

Carrier GPCR

Enzyme

Carrier

GPCR

Nuclear receptors Enzyme

GPCR

Enzyme

GPCR

Membrane

GPCR GPCR

Membrane

Enzyme

Enzyme

Ion channel

Enzyme Enzyme

Enzyme

Enzyme

Enzyme

Enzyme Protein

Enzyme

Enzyme

Enzyme

Not identified

GPCR Enzyme

Enzyme

Enzyme

GPCR Ionotropic receptor

Enzyme

GPCR Enzyme

Ribosome

GPCR

Membrane GPCR

GPCR

Ribosome

Enzyme

Enzyme Nuclear receptor

Nuclear receptor

Ribosome

GPCR

Ionotropic receptor

Ion channel Not identified

DNA

DNA

Enzyme

Enzyme Receptor

Nuclear receptors

Enzyme

Nuclear receptor

Enzyme Membrane

Ion channel

Enzyme

Enzyme

Not identified Carrier

Enzyme

Enzyme

Ion channel Enzyme

Membrane

GPCR

Enzyme

Not identified

GPCR Nuclear receptor

GPCR

Enzyme

GPCR

Enzyme

Ribosome Enzyme

Carrier

GPCR

DNA

Enzyme

Enzyme Enzyme

Enzyme

Enzyme

Enzyme

Nuclear receptor

GPCR Enzyme

Enzyme

Enzyme

GPCR

Enzyme

Protein

Carrier GPCR

Carrier

Ion channel

Enzyme Enzyme

Enzyme

Enzyme

Enzyme Receptor

GPCR

GPCR

Enzyme

GPCR GPCR

Enzyme

Carrier

GPCR

Nuclear receptor Ribosome

Enzyme

GPCR

GPCR

Enzyme Not identified

Nuclear receptor

Enzyme

Enzyme

Ribosome Enzyme

Enzyme

Not identified

Enzyme

GPCR Nuclear receptor

GPCR

Enzyme

GPCR Ionotropic receptor

Not identified

Ionotropic receptor

Enzyme

Not identified

GPCR Protein

GPCR

Nuclear receptor

Enzyme Enzyme

Not identified

Nuclear receptors

GPCR

Not identified

Enzyme Enzyme

GPCR

Enzyme

Nuclear receptors

Enzyme Carrier

GPCR

Cell

Enzyme

Nuclear receptor

Transmembrane receptor

Ion channel Enzyme

Ion channel

Enzyme

GPCR

GPCR

GPCR Membrane

Transmembrane receptor

Enzyme

Nuclear receptor

Enzyme

Carrier Ionotropic receptor

GPCR

Ion channel

Enzyme Enzyme

Enzyme

Not identified

Carrier

Enzyme

GPCR GPCR

DNA

GPCR

GPCR

GPCR

Enzyme Nuclear receptor

GPCR

Not identified

Ribosome

Nuclear receptor

Nuclear receptor Ion channel

Enzyme

Nuclear receptors

Enzyme

Ribosome

RNA GPCR

Ionotropic receptor

GPCR

GPCR

Ionotropic receptor Enzyme

GPCR

GPCR

Ionotropic receptor

Enzyme

Ionotropic receptor

Enzyme GPCR

GPCR GPCR

Nuclear receptor

Nuclear receptor

Enzyme

Enzyme Carrier

Carrier

Nuclear receptors

GPCR

Enzyme

Ribosome Ionotropic receptor

Ionotropic receptor

Enzyme

GPCR

Enzyme Enzyme

Enzyme

Enzyme

Carrier Enzyme

Receptor

GPCR

GPCR

Enzyme

Nuclear receptor

Ion channel GPCR

Coenzyme

Ionotropic receptor

Enzyme GPCR

Carrier

Ion channel

Nuclear receptor

Ionotropic receptor

GPCR Ionotropic receptor

Enzyme

GPCR

GPCR

Not identified

Ionotropic receptor GPCR

Nuclear receptors

Enzyme

Transmembrane receptor

Protein

Enzyme Protein

Ion channel

Enzyme

GPCR

DNA GPCR

Ionotropic receptor

Ion channel

Enzyme

Not identified Ion channel

Enzyme

GPCR

Enzyme

GPCR

Enzyme

Enzyme Enzyme

GPCR

Nuclear receptors

GPCR

Nuclear receptor

Coenzyme Enzyme

GPCR

Enzyme

Enzyme

GPCR Enzyme

Enzyme

GPCR

Not identified

Ionotropic receptor Not identified

GPCR

Enzyme

GPCR

Nuclear receptor

GPCR Enzyme

Enzyme

GPCR

Enzyme Enzyme

Enzyme

Enzyme

Ionotropic receptor

DNA RNA

Enzyme

Enzyme

GPCR

Enzyme

Nuclear receptors Enzyme

GPCR

Coenzyme

Enzyme

Enzyme Enzyme

Ion channel

Nuclear receptors Nuclear receptors

GPCR

GPCR

GPCR Enzyme

GPCR

Enzyme

Enzyme

GPCR

Enzyme Enzyme

Enzyme

Enzyme

DNA

Enzyme

Not identified

GPCR Enzyme

GPCR

Ionotropic receptor

Ion channel

Nuclear receptor Nuclear receptor

Enzyme

GPCR

Ribosome GPCR

GPCR

DNA

Enzyme

Ribosome

Enzyme

GPCR GPCR

Receptor

GPCR

GPCR

GPCR GPCR

GPCR

GPCR

Protein

Ion channel

Receptor Enzyme

Enzyme

Enzyme

GPCR

Enzyme

Nuclear receptor Enzyme

Enzyme

Enzyme

Enzyme

GPCR

GPCR Enzyme

Receptor

Not identified

Enzyme

Enzyme

Enzyme

Not identified Not identified

Protein

GPCR

GPCR

Enzyme

Enzyme

Enzyme Nuclear receptors

Ionotropic receptor

Protein

Enzyme

Ionotropic receptor

Not identified Transmembrane receptor

Not identified

Nuclear receptors

Enzyme

GPCR

DNA Not identified

Ion channel

GPCR

Enzyme

GPCR

Nuclear receptors

Not identified Ion channel

Carrier

Enzyme

Enzyme

GPCR

Not identified Enzyme

Ion channel

Enzyme

Enzyme

Enzyme

GPCR

Enzyme Enzyme

GPCR

Enzyme

Nuclear receptors

Carrier

Enzyme

Enzyme Enzyme

DNA

Nuclear receptors

GPCR

Ion channel

Enzyme

Ionotropic receptor Enzyme

Ionotropic receptor

Nuclear receptors

GPCR

Ion channel

Enzyme

Enzyme Enzyme

GPCR

Protein

GPCR

Nuclear receptors