CHEMBL64246


SMILES CCC1([C@@H](O)C/C=C/[C@H]2[C@H](O)C[C@@H](Cl)[C@@H]2C/C=C\CCCC(=O)O)CCC1
InChIKey LBIPUBVVGYRBNA-VGUVCEGPSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 3
Rotatable bonds 11
Molecular weight (Da) 398.2

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
EP1 PE2R1 Mouse Prostanoid A pKi 5.47 5.47 5.47 ChEMBL
EP2 PE2R2 Mouse Prostanoid A pKi 8.66 8.66 8.66 ChEMBL
IP PI2R Human Prostanoid A pKi 5.0 5.0 5.0 ChEMBL
EP2 PE2R2 Human Prostanoid A pKi 8.48 8.8 9.13 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
EP2 PE2R2 Mouse Prostanoid A pEC50 8.55 8.55 8.55 ChEMBL
EP2 PE2R2 Human Prostanoid A pEC50 8.42 8.42 8.42 ChEMBL