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PRESTWICK Toolbox 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 Acetazolamide 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 Amiloride 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 Hydrochlorothiazide 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 Meticrane H3C O O O 9CH3 H C N PWT000012 PRESTWICK Prestw-12 Benzonatate 3 F F F N O N PWT000013 PRESTWICK Prestw-13 Hydroflumethiazide 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 Minoxidil 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 Cimetidine N CH3 O O OH HO N H C O PWT000027 PRESTWICK Prestw-27 Doxylamine 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 Triamterene 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 Procaine 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 Lidocaine 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 Carbamazepine H2N O ClH F F S F N H C PWT000053 PRESTWICK Prestw-53 Triflupromazine hydrochloride 3 N H3C HO CH3 O H C 3 N PWT000054 PRESTWICK Prestw-54 Mefenamic acid H3C O N N S PWT000055 PRESTWICK Prestw-55 Acetohexamide 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 Pheniramine 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 Homatropine hydrobromide (R,S) O H OH H3C N CH3 O O CH H3C 3 O O + PWT000063 PRESTWICK Prestw-63 Nifedipine N O O ClH Cl S H C PWT000064 PRESTWICK Prestw-64 Chlorpromazine hydrochloride 3 N N H3C ClH H3C N O H C PWT000065 PRESTWICK Prestw-65 Diphenhydramine 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 Imipramine 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 Thioridazine 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 Baclofen (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 Diazoxide 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 Lynestrenol 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 Amoxapine Cl O ClH H C N PWT000103 PRESTWICK Prestw-103 Cyproheptadine hydrochloride 3 S N N H2N S NH NH2 N O PWT000104 PRESTWICK Prestw-104 Famotidine S O NH2 CHChiral HO H3C CH3 H PWT000105 PRESTWICK Prestw-105 Danazol N H H O O O + O N N PWT000106 PRESTWICK Prestw-106 Nicorandil 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 Naloxone hydrochloride HO O O Cl N CH3 O N S H2N PWT000112 PRESTWICK Prestw-112 Metolazone 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 Haloperidol N HO OH2 OH2 ClH N Chiral OH PWT000116 PRESTWICK Prestw-116 Naltrexone 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 Nalbuphine 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 Perphenazine N Cl S ClH HO N F PWT000126 PRESTWICK Prestw-126 Mefloquine 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 Spironolactone H H O S CH3 ClH ClH N N N N O N H3C PWT000129 PRESTWICK
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