Name: PARP1-IN-19
Rating: 5 (10 reviews)

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sdf 文件

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类似物检索

HIT ID:HIT218848658
Cas No:2756337-27-4
常用名:PARP1-IN-19
IUPAC:4-{[4-fluoro-3-(4-{1H-imidazo[4,5-b]pyridin-5-yl}piperazine-1-carbonyl)phenyl]methyl}-1,2-dihydrophthalazin-1-one dihydrate hydrochloride
IUPAC:4-{[4-fluoro-3-(4-{1H-imidazo[4,5-b]pyridin-5-yl}piperazine-1-carbonyl)phenyl]methyl}-1,2-dihydrophthalazin-1-one dihydrate hydrochloride
InChI key:AFJDKALYXMEKFC-UHFFFAOYSA-N

分子式:C26H27ClFN7O4
分子量:556
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:O.O.Cl.Fc1ccc(Cc2n[nH]c(=O)c3ccccc23)cc1C(=O)N1CCN(CC1)c1ccc2[nH]cnc2n1
SMILES:O.O.Cl.Fc1ccc(Cc2n[nH]c(=O)c3ccccc23)cc1C(=O)N1CCN(CC1)c1ccc2[nH]cnc2n1

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