amarogentin


SMILES C=C[C@@H]1[C@@H]2CCOC(=O)C2=CO[C@H]1O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)OC(=O)C4=C(C=C(C=C4O)O)C5=CC(=CC=C5)O
InChIKey DBOVHQOUSDWAPQ-WTONXPSSSA-N

Chemical properties

Hydrogen bond acceptors 13
Hydrogen bond donors 6
Rotatable bonds 7
Molecular weight (Da) 586.2

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
TAS2R30 T2R30 Human Taste 2 T2 pEC50 6.39 6.39 6.39 Guide to Pharmacology
TAS2R43 T2R43 Human Taste 2 T2 pEC50 4.12 4.12 4.12 Guide to Pharmacology
TAS2R46 T2R46 Human Taste 2 T2 pEC50 4.17 4.17 4.17 Guide to Pharmacology