CHEMBL3904989


SMILES COc1ccc(CCC(=O)NS(=O)(=O)C(F)(F)F)c(CN2CCC[C@H]2c2nc(C(=O)NCCCCC3CCCCC3)co2)c1
InChIKey ZBYCYKAOQOIIRO-SANMLTNESA-N

Chemical properties

Hydrogen bond acceptors 8
Hydrogen bond donors 2
Rotatable bonds 14
Molecular weight (Da) 642.3

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
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
IP PI2R Human Prostanoid A pEC50 5.02 5.02 5.02 ChEMBL
EP1 PE2R1 Human Prostanoid A pEC50 7.16 7.16 7.16 ChEMBL
EP2 PE2R2 Human Prostanoid A pEC50 5.26 5.26 5.26 ChEMBL
EP3 PE2R3 Human Prostanoid A pEC50 7.0 7.0 7.0 ChEMBL
EP4 PE2R4 Human Prostanoid A pEC50 7.43 7.43 7.43 ChEMBL
FP PF2R Human Prostanoid A pEC50 6.34 6.34 6.34 ChEMBL