ONO-AE1-329


SMILES COCc1ccccc1CC[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1SCCCSCC(=O)O)O
InChIKey BVGVPUMSPSNRRQ-CNOJNPITSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 3
Rotatable bonds 14
Molecular weight (Da) 468.2

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
EP3 PE2R3 Mouse Prostanoid A pKi 5.92 5.92 5.92 Guide to Pharmacology
EP4 PE2R4 Mouse Prostanoid A pKi 8.0 8.0 8.0 Guide to Pharmacology
EP2 PE2R2 Mouse Prostanoid A pKi 5.7 5.7 5.7 Guide to Pharmacology
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
EP4 PE2R4 Human Prostanoid A pEC50 7.66 7.73 7.8 Guide to Pharmacology