HIT ID: HIT105565771
Cas No: 101714-41-4
分子式: C9H7NO3S
分子量: 209.22
常用名: BiP inducer X
氢键受体数 (HBA): 3
氢键供体数 (HBD): 2
LogP: 1.533
IUPAC: 2-(cyanosulfanyl)-1-(3,4-dihydroxyphenyl)ethan-1-one
IUPAC: 2-(cyanosulfanyl)-1-(3,4-dihydroxyphenyl)ethan-1-one
SMILES: Oc1ccc(cc1O)C(=O)CSC#N
SMILES: Oc1ccc(cc1O)C(=O)CSC#N
InChI key: SVFLBLCWKKQKDW-UHFFFAOYSA-N