HIT ID: HIT212666122
Cas No: 2377379-39-8
分子式: C23H21N3O4S
分子量: 435.5
常用名: MRGPRX1 agonist 1
氢键受体数 (HBA): 5
氢键供体数 (HBD): 2
LogP: 2.802893
IUPAC: N-{2-[(1-aminoisoquinolin-6-yl)oxy]-4-methylphenyl}-2-methoxybenzene-1-sulfonamide
IUPAC: N-{2-[(1-aminoisoquinolin-6-yl)oxy]-4-methylphenyl}-2-methoxybenzene-1-sulfonamide
SMILES: COc1ccccc1S(=O)(=O)Nc1ccc(C)cc1Oc1ccc2c(N)nccc2c1
SMILES: COc1ccccc1S(=O)(=O)Nc1ccc(C)cc1Oc1ccc2c(N)nccc2c1
InChI key: BWEJNHRMGZUMNU-UHFFFAOYSA-N