N-{3-fluoro-5-[({1-[(1R)-1-(naphthalen-1-yl)ethyl]piperidin-4-yl}formamido)methyl]phenyl}-4-methylpiperazine-1-carboxamide, SARS-CoV-2-IN-106
HIT218667120
sdf文件结构编辑类似物检索
HIT ID: HIT218667120
Cas No: 2863607-73-0
分子式: C31H38FN5O2
分子量: 531.676
常用名: N-{3-fluoro-5-[({1-[(1R)-1-(naphthalen-1-yl)ethyl]piperidin-4-yl}formamido)methyl]phenyl}-4-methylpiperazine-1-carboxamide, SARS-CoV-2-IN-106
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: N-{3-fluoro-5-[({1-[(1R)-1-(naphthalen-1-yl)ethyl]piperidin-4-yl}formamido)methyl]phenyl}-4-methylpiperazine-1-carboxamide
SMILES: C[C@@H](N1CCC(CC1)C(=O)NCc1cc(F)cc(NC(=O)N2CCN(C)CC2)c1)c1cccc2ccccc12
InChI key: ZGUISYSWQQIAHK-JOCHJYFZSA-N
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