HJM-561
HIT217584988
sdf文件结构编辑类似物检索
HIT ID: HIT217584988
Cas No: 2570251-68-0
分子式: C45H51ClN9O5P
分子量: 864.38
常用名: HJM-561
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 3-(4-{4-[4-(1-{4-[(5-chloro-4-{[2-(dimethylphosphoryl)phenyl]amino}pyrimidin-2-yl)amino]-3-methoxyphenyl}piperidin-4-yl)piperazin-1-yl]but-1-yn-1-yl}-1-oxo-2,3-dihydro-1H-isoindol-2-yl)piperidine-2,6-dione
IUPAC: 3-(4-{4-[4-(1-{4-[(5-chloro-4-{[2-(dimethylphosphoryl)phenyl]amino}pyrimidin-2-yl)amino]-3-methoxyphenyl}piperidin-4-yl)piperazin-1-yl]but-1-yn-1-yl}-1-oxo-2,3-dihydro-1H-isoindol-2-yl)piperidine-2,6-dione
SMILES: COc1cc(ccc1Nc1ncc(Cl)c(Nc2ccccc2P(C)(C)=O)n1)N1CCC(CC1)N1CCN(CCC#Cc2cccc3C(=O)N(Cc23)C2CCC(=O)NC2=O)CC1
SMILES: COc1cc(ccc1Nc1ncc(Cl)c(Nc2ccccc2P(C)(C)=O)n1)N1CCC(CC1)N1CCN(CCC#Cc2cccc3C(=O)N(Cc23)C2CCC(=O)NC2=O)CC1
InChI key: WTUTUUAYVNLJQA-UHFFFAOYSA-N
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SC
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Mcule
SC
41254-5周 购物车
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