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PARP
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Taurodeoxychloic acidCas Number: 516-50-7Formula: C26H45NO6S Molecular Weight: 499.70IUPAC Name: show moreSMILES: CC(CCC(=O)NCCS(=O)(=O)O)C1CCC2C1(C(CC3C2CCC4C3(CCC(C4)O)C)O)CInChIKey: AWDRATDZQPNJFN-VAYUFCLWSA-NInChI: show moreSynonyms: 2-[4-[(3R,5R,8R,9S,10S,12S,13R,14S,17R)-3,12-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydr...
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PARPi-FLCas Number: 1380359-84-1 Compound CID: 70697686Formula: C34H32BF3N6O3 Molecular Weight: 640.46IUPAC Name: show moreSMILES: [B-]1(N2C(=CC(=C2C=C3[N+]1=C(C=C3)CCC(=O)N4CCN(CC4)C(=O)C5=C(C=CC(=C5)CC6=NNC(=O)C7=CC=CC=C76)F)C)C)(F)FInChIKey: IGUTVNUEFKPBGK-UHFFFAOYSA-NInChI: show moreSynonyms: Boron, (4-((3-((4-(3-(5-((3,5-dimethyl-2H-pyrrol-2-ylidene-kappaN)methyl)-1H-pyrrol-2-yl-kappaN)-1-oxopropyl)-1-piper...
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Nudifloramide-d3Cas Number: 1207384-48-2Formula: C7H5D3N2O2 Molecular Weight: 155.17IUPAC Name: 6-oxo-1-(trideuteriomethyl)pyridine-3-carboxamideSMILES: CN1C=C(C=CC1=O)C(=O)NInChIKey: JLQSXXWTCJPCBC-FIBGUPNXSA-NInChI: InChI=1S/C7H8N2O2/c1-9-4-5(7(8)11)2-3-6(9)10/h2-4H,1H3,(H2,8,11)/i1D3Synonyms: CHEBI:145118 | 1-(~2~H_3_)Methyl-6-oxo-1,6-dihydropyridine-3-carboxamide | 6-Oxo-1-(trideuteriomethyl)pyridine-3-carb...
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OUL35Cas Number: 6336-34-1Formula: C14H12N2O3 Molecular Weight: 256.26IUPAC Name: 4-(4-carbamoylphenoxy)benzamideSMILES: C1=CC(=CC=C1C(=O)N)OC2=CC=C(C=C2)C(=O)NInChIKey: XZRCQWLPMXFGHE-UHFFFAOYSA-NInChI: InChI=1S/C14H12N2O3/c15-13(17)9-1-5-11(6-2-9)19-12-7-3-10(4-8-12)14(16)18/h1-8H,(H2,15,17)(H2,16,18)Synonyms: NSC39047 | HMS2754A23 | OUL 35 | NSC39047 | NSC-39047 | SR-01000391101-1 | AKOS001482413 | DTXSID10284793 | SCHEMBL31...
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Olaparib (AZD2281, Ku-0059436), PARP 1, 2 and 3 inhibitorCas Number: 763113-22-0 EC Number: 642-941-5Formula: C24H23FN4O3 Molecular Weight: 434.46IUPAC Name: 4-[[3-[4-(cyclopropanecarbonyl)piperazine-1-carbonyl]-4-fluorophenyl]methyl]-2H-phthalazin-1-oneSMILES: C1CC1C(=O)N2CCN(CC2)C(=O)C3=C(C=CC(=C3)CC4=NNC(=O)C5=CC=CC=C54)FInChIKey: FDLYAMZZIXQODN-UHFFFAOYSA-NInChI: show moreSynonyms: KU-0059436 | KU0059436 | KU-0059436 | 4-({3-[(4-cyclopropanecarbonylpiperazin-1-yl)carbonyl]-4-fluorophenyl}methyl)-1...
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6-(5H)-PhenanthridinoneCas Number: 1015-89-0 EC Number: 213-804-3Formula: C13H9NO Molecular Weight: 195.22IUPAC Name: 5H-phenanthridin-6-oneSMILES: C1=CC=C2C(=C1)C3=CC=CC=C3NC2=OInChIKey: RZFVLEJOHSLEFR-UHFFFAOYSA-NInChI: InChI=1S/C13H9NO/c15-13-11-7-2-1-5-9(11)10-6-3-4-8-12(10)14-13/h1-8H,(H,14,15)Synonyms: Phenanthridin-6(5H)-one | Phenanthridone | 6-Phenanthridinol
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BGP 15Cas Number: 66611-37-8Formula: C14H22N4O2•2HCl Molecular Weight: 351.27IUPAC Name: N'-(2-hydroxy-3-piperidin-1-ylpropoxy)pyridine-3-carboximidamide;dihydrochlorideSMILES: C1CCN(CC1)CC(CON=C(C2=CN=CC=C2)N)O.Cl.ClInChIKey: ISGGVCWFTPTHIX-UHFFFAOYSA-NInChI: InChI=1S/C14H22N4O2.2ClH/c15-14(12-5-4-6-16-9-12)17-20-11-13(19)10-18-7-2-1-3-8-18;;/h4-6,9,13,19H,1-3,7-8,10-11H2,(H2,15,17);2*1HSynonyms: s8370 | 3-Pyridinecarboximidamide, N-(2-hydroxy-3-(1-piperidinyl)propoxy)-, dihydrochloride | BGP-15, >=98% (HPLC) | ...
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PJ34 HClCas Number: 344458-15-7Formula: C17H17N3O2·HCl Molecular Weight: 331.8IUPAC Name: 2-(dimethylamino)-N-(6-oxo-5H-phenanthridin-2-yl)acetamide;hydrochlorideSMILES: CN(C)CC(=O)NC1=CC2=C(C=C1)NC(=O)C3=CC=CC=C32.ClInChIKey: RURAZZMDMNRXMI-UHFFFAOYSA-NInChI: InChI=1S/C17H17N3O2.ClH/c1-20(2)10-16(21)18-11-7-8-15-14(9-11)12-5-3-4-6-13(12)17(22)19-15;/h3-9H,10H2,1-2H3,(H,18,21)(H,19,22);1HSynonyms: A874967 | AS-72775 | HY-13688 | n-(6-oxo-5,6-dihydro-phenanthridin-2-yl)-n,n-dimethylacetamide hydrochloride | AKOS00...
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Iniparib (BSI-201), Reactive nitro radicalCas Number: 160003-66-7Formula: C7H5IN2O3 Molecular Weight: 292.03IUPAC Name: 4-iodo-3-nitrobenzamideSMILES: C1=CC(=C(C=C1C(=O)N)[N+](=O)[O-])IInChIKey: MDOJTZQKHMAPBK-UHFFFAOYSA-NInChI: InChI=1S/C7H5IN2O3/c8-5-2-1-4(7(9)11)3-6(5)10(12)13/h1-3H,(H2,9,11)Synonyms: DTXSID30166784 | Iniparib (BSI-201) | s1087 | J-515558 | SMR004701226 | 4-iodo-5-nitro-benzamide | IND-71677 | Inipar...
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UPF 1069Cas Number: 1048371-03-4 Compound CID: 25015515Formula: C17H13NO3 Molecular Weight: 279.29IUPAC Name: 5-phenacyloxy-2H-isoquinolin-1-oneSMILES: C1=CC=C(C=C1)C(=O)COC2=CC=CC3=C2C=CNC3=OInChIKey: JJWMRRNGWSITSQ-UHFFFAOYSA-NInChI: InChI=1S/C17H13NO3/c19-15(12-5-2-1-3-6-12)11-21-16-8-4-7-14-13(16)9-10-18-17(14)20/h1-10H,11H2,(H,18,20)Synonyms: HMS3653L04 | HY-14478 | SW219733-1 | 5-(2-Oxo-2-phenylethoxy)isoquinolin-1(2H)-one | CS-1466 | HMS3678B17 | MFCD14051...
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XAV-939Cas Number: 284028-89-3 Compound CID: 135418940Formula: C14H11F3N2OS Molecular Weight: 312.31IUPAC Name: 2-[4-(trifluoromethyl)phenyl]-3,5,7,8-tetrahydrothiopyrano[4,3-d]pyrimidin-4-oneSMILES: C1CSCC2=C1N=C(NC2=O)C3=CC=C(C=C3)C(F)(F)FInChIKey: KLGQSVMIPOVQAX-UHFFFAOYSA-NInChI: InChI=1S/C14H11F3N2OS/c15-14(16,17)9-3-1-8(2-4-9)12-18-11-5-6-21-7-10(11)13(20)19-12/h1-4H,5-7H2,(H,18,19,20)Synonyms: 2-(4-(Trifluoromethyl)phenyl)-3,5,7,8-tetrahydro-4H-thiopyrano[4,3-d]pyrimidin-4-one | EN300-6732792 | BCPP000009 | S...
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MK-4827 (Niraparib), Poly [ADP-ribose] polymerase-1 inhibitorCas Number: 1038915-60-4Formula: C19H20N4O Molecular Weight: 320.39IUPAC Name: 2-[4-[(3S)-piperidin-3-yl]phenyl]indazole-7-carboxamideSMILES: C1CC(CNC1)C2=CC=C(C=C2)N3C=C4C=CC=C(C4=N3)C(=O)NInChIKey: PCHKPVIQAHNQLW-CQSZACIVSA-NInChI: InChI=1S/C19H20N4O/c20-19(24)17-5-1-3-15-12-23(22-18(15)17)16-8-6-13(7-9-16)14-4-2-10-21-11-14/h1,3,5-9,12,14,21H,2,4,10-11H2,(H2,20,24)/t14-/m1/s1Synonyms: 2-(4-(3S)-3-piperidinylphenyl)-2H-indazole-7-carboxamide | 1038915-60-4 | STL556264 | LABETALOL [WHO-DD] | DTXCID8068...


