CHEMBL2036321


SMILES Cc1ccc(-c2cccc(C[C@H](O)/C=C/[C@H]3CCC(=O)N3CCSc3nc(C(=O)O)cs3)c2)cc1C
InChIKey QBUJKNBDVBZVJH-IEZNSWIASA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 10
Molecular weight (Da) 522.2

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
EP1 PE2R1 Mouse Prostanoid A pKi 5.6 5.6 5.6 ChEMBL
EP2 PE2R2 Mouse Prostanoid A pKi 8.82 8.82 8.82 ChEMBL
EP4 PE2R4 Mouse Prostanoid A pKi 9.46 9.46 9.46 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
EP2 PE2R2 Rat Prostanoid A pEC50 5.85 5.85 5.85 ChEMBL
EP4 PE2R4 Rat Prostanoid A pEC50 7.68 7.68 7.68 ChEMBL