HIT ID: HIT104898626
Cas No: 223673-61-8
分子式: C21H24N4O2S
分子量: 396.51
常用名: Mirabegron
氢键受体数 (HBA): 6
氢键供体数 (HBD): 4
LogP: 1.32
IUPAC: 2-(2-amino-1,3-thiazol-4-yl)-N-[4-(2-{[(2R)-2-hydroxy-2-phenylethyl]amino}ethyl)phenyl]acetamide
IUPAC: 2-(2-amino-1,3-thiazol-4-yl)-N-[4-(2-{[(2R)-2-hydroxy-2-phenylethyl]amino}ethyl)phenyl]acetamide
SMILES: Nc1nc(CC(=O)Nc2ccc(CCNC[C@H](O)c3ccccc3)cc2)cs1
SMILES: Nc1nc(CC(=O)Nc2ccc(CCNC[C@H](O)c3ccccc3)cc2)cs1
InChI key: PBAPPPCECJKMCM-IBGZPJMESA-N
