HIT ID: HIT212037426
Cas No: 355129-15-6
分子式: C18H17Br2NO5
分子量: 487.144
常用名: Eprotirome
氢键受体数 (HBA): 4
氢键供体数 (HBD): 3
LogP: 5.082421
IUPAC: 2-({3,5-dibromo-4-[4-hydroxy-3-(propan-2-yl)phenoxy]phenyl}carbamoyl)acetic acid
IUPAC: 2-({3,5-dibromo-4-[4-hydroxy-3-(propan-2-yl)phenoxy]phenyl}carbamoyl)acetic acid
SMILES: CC(C)c1cc(Oc2c(Br)cc(NC(=O)CC(O)=O)cc2Br)ccc1O
SMILES: CC(C)c1cc(Oc2c(Br)cc(NC(=O)CC(O)=O)cc2Br)ccc1O
InChI key: VPCSYAVXDAUHLT-UHFFFAOYSA-N
