PARP1/c-Met-IN-1
HIT218848656
sdf文件结构编辑类似物检索
HIT ID: HIT218848656
Cas No: 2944101-99-7
分子式: C40H33FN8O4
分子量: 708.754
常用名: PARP1/c-Met-IN-1
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 4-({4-fluoro-3-[4-(4-{2-[6-oxo-3-(pyridin-3-yl)-1,6-dihydropyridazin-1-yl]ethoxy}quinolin-7-yl)piperazine-1-carbonyl]phenyl}methyl)-1,2-dihydrophthalazin-1-one
IUPAC: 4-({4-fluoro-3-[4-(4-{2-[6-oxo-3-(pyridin-3-yl)-1,6-dihydropyridazin-1-yl]ethoxy}quinolin-7-yl)piperazine-1-carbonyl]phenyl}methyl)-1,2-dihydrophthalazin-1-one
SMILES: Fc1ccc(Cc2n[nH]c(=O)c3ccccc23)cc1C(=O)N1CCN(CC1)c1ccc2c(OCCn3nc(ccc3=O)-c3cccnc3)ccnc2c1
SMILES: Fc1ccc(Cc2n[nH]c(=O)c3ccccc23)cc1C(=O)N1CCN(CC1)c1ccc2c(OCCn3nc(ccc3=O)-c3cccnc3)ccnc2c1
InChI key: QJKRRPUDVWORKT-UHFFFAOYSA-N
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