HIT ID: HIT219234660
Cas No:
分子式: C28H41N5O7
分子量: 559.664
常用名: TAPI1 acetate
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (2R)-N-[(1S)-1-{[(1S)-1-[(2-aminoethyl)carbamoyl]ethyl]carbamoyl}-2-(naphthalen-2-yl)ethyl]-N'-hydroxy-2-(2-methylpropyl)butanediamide; acetic acid
IUPAC: (2R)-N-[(1S)-1-{[(1S)-1-[(2-aminoethyl)carbamoyl]ethyl]carbamoyl}-2-(naphthalen-2-yl)ethyl]-N'-hydroxy-2-(2-methylpropyl)butanediamide; acetic acid
SMILES: CC(O)=O.CC(C)C[C@H](CC(=O)NO)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](C)C(=O)NCCN
SMILES: CC(O)=O.CC(C)C[C@H](CC(=O)NO)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](C)C(=O)NCCN
InChI key: WHIHMTHIYLJVSG-RDZNBAMBSA-N