HIT ID: HIT212671401
Cas No: 1017931-53-1
分子式: C19H21F6N3O
分子量: 421.387
常用名: Cathepsin Inhibitor 2
氢键受体数 (HBA): 3
氢键供体数 (HBD): 2
LogP: 3.9799905
IUPAC: (2S)-N-(1-cyanocyclopropyl)-4,4-difluoro-2-{[(1S)-2,2,2-trifluoro-1-(4-fluorophenyl)ethyl]amino}heptanamide
IUPAC: (2S)-N-(1-cyanocyclopropyl)-4,4-difluoro-2-{[(1S)-2,2,2-trifluoro-1-(4-fluorophenyl)ethyl]amino}heptanamide
SMILES: CCCC(F)(F)C[C@H](N[C@@H](c1ccc(F)cc1)C(F)(F)F)C(=O)NC1(CC1)C#N
SMILES: CCCC(F)(F)C[C@H](N[C@@H](c1ccc(F)cc1)C(F)(F)F)C(=O)NC1(CC1)C#N
InChI key: SPJXTKFUGDUWFY-GJZGRUSLSA-N
