CHEMBL3942394


SMILES O=C(CCc1ccc(Cl)cc1CN1CCC[C@H]1c1nc(C(=O)NCCCCC2CCCCC2)co1)NS(=O)(=O)C(F)(F)F
InChIKey XTSILTSKUZERSP-VWLOTQADSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 2
Rotatable bonds 13
Molecular weight (Da) 646.2

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
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
FP PF2R Human Prostanoid A pEC50 6.57 6.57 6.57 ChEMBL
IP PI2R Human Prostanoid A pEC50 6.07 6.07 6.07 ChEMBL
EP2 PE2R2 Human Prostanoid A pEC50 6.08 6.08 6.08 ChEMBL
EP3 PE2R3 Human Prostanoid A pEC50 7.33 7.33 7.33 ChEMBL
DP1 PD2R Human Prostanoid A pEC50 7.77 7.77 7.77 ChEMBL
EP1 PE2R1 Human Prostanoid A pEC50 7.7 7.7 7.7 ChEMBL
EP4 PE2R4 Human Prostanoid A pEC50 8.0 8.0 8.0 ChEMBL