HIT ID: HIT212711942
Cas No: 847727-81-5
分子式: C21H16ClFN2O4
分子量: 414.82
常用名: AAT-008
氢键受体数 (HBA): 4
氢键供体数 (HBD): 2
LogP: 4.470012
IUPAC: 4-[(1S)-1-{[5-chloro-2-(3-fluorophenoxy)pyridin-3-yl]formamido}ethyl]benzoic acid
IUPAC: 4-[(1S)-1-{[5-chloro-2-(3-fluorophenoxy)pyridin-3-yl]formamido}ethyl]benzoic acid
SMILES: C[C@H](NC(=O)c1cc(Cl)cnc1Oc1cccc(F)c1)c1ccc(cc1)C(O)=O
SMILES: C[C@H](NC(=O)c1cc(Cl)cnc1Oc1cccc(F)c1)c1ccc(cc1)C(O)=O
InChI key: FKXDPPYCCKCVCW-LBPRGKRZSA-N
