CHEMBL1205677


SMILES O=C(O)COc1cccc(C[C@@H]2CCCC=C2c2nc(-c3ccccc3)c(-c3ccccc3)o2)c1
InChIKey QVZSFHJAGXKMMQ-DEOSSOPVSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 8
Molecular weight (Da) 465.2

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
IP PI2R Human Prostanoid A pKi 7.22 7.26 7.27 ChEMBL
EP3 PE2R3 Human Prostanoid A pKi 5.17 5.17 5.17 ChEMBL
EP4 PE2R4 Human Prostanoid A pKi 5.99 5.99 5.99 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
IP PI2R Rat Prostanoid A pIC50 5.92 5.92 5.92 ChEMBL
IP PI2R Human Prostanoid A pIC50 7.22 7.22 7.22 ChEMBL