CHEMBL1957435


SMILES O=C(O)c1csc(SCCN2C(=O)CC[C@@H]2/C=C/[C@@H](O)Cc2cccc(-c3ccccc3)c2)n1
InChIKey TZZLWYONQVXDRN-JEUBMUGFSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 10
Molecular weight (Da) 494.1

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 5.38 5.38 5.38 ChEMBL
EP2 PE2R2 Mouse Prostanoid A pKi 8.52 8.52 8.52 ChEMBL
EP4 PE2R4 Mouse Prostanoid A pKi 9.03 9.03 9.03 ChEMBL
EP3 PE2R3 Mouse Prostanoid A pKi 5.37 5.37 5.37 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
EP2 PE2R2 Rat Prostanoid A pEC50 5.75 5.75 5.75 ChEMBL
EP4 PE2R4 Rat Prostanoid A pEC50 8.1 8.1 8.1 ChEMBL