DPP1-IN-1
HIT218847923
sdf文件结构编辑类似物检索
HIT ID: HIT218847923
Cas No: 2762114-61-2
分子式: C23H23FN4O4
分子量: 438.459
常用名: DPP1-IN-1
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (2S)-N-[(1S)-1-cyano-2-[2-fluoro-4-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazol-5-yl)phenyl]ethyl]-1,4-oxazepane-2-carboxamide
IUPAC: (2S)-N-[(1S)-1-cyano-2-[2-fluoro-4-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazol-5-yl)phenyl]ethyl]-1,4-oxazepane-2-carboxamide
SMILES: Cn1c2cc(ccc2oc1=O)-c1ccc(C[C@H](NC(=O)[C@@H]2CNCCCO2)C#N)c(F)c1
SMILES: Cn1c2cc(ccc2oc1=O)-c1ccc(C[C@H](NC(=O)[C@@H]2CNCCCO2)C#N)c(F)c1
InChI key: ONJDRXNRBKHINH-UWJYYQICSA-N
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