CHEMBL605833


SMILES O=C(O)CCc1ccc(Cn2cccn2)cc1OCCc1ccc2ccccc2c1
InChIKey SREGRCFSXVBPIJ-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 9
Molecular weight (Da) 400.2

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Sankey plot

Compound is not listed as a drug.

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
EP3 PE2R3 Mouse Prostanoid A pKi 7.68 7.8 7.92 ChEMBL
EP1 PE2R1 Mouse Prostanoid A pKi 5.15 5.15 5.15 ChEMBL
EP4 PE2R4 Mouse Prostanoid A pKi 5.96 5.96 5.96 ChEMBL
EP2 PE2R2 Mouse Prostanoid A pKi 5.55 5.55 5.55 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
EP3 PE2R3 Mouse Prostanoid A pIC50 5.44 6.65 7.66 ChEMBL