CHEMBL373118


SMILES CN([C@@H]1CCc2c(c3ccccc3n2CCC(=O)O)C1)S(=O)(=O)c1ccc(F)cc1
InChIKey XKWVLGMVINJGLP-MRXNPFEDSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 6
Molecular weight (Da) 430.1

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
DP1 PD2R Human Prostanoid A pKi 5.21 5.21 5.21 ChEMBL
TP TA2R Human Prostanoid A pKi 5.52 5.52 5.52 ChEMBL
DP2 PD2R2 Human Prostanoid A pKi 8.72 8.72 8.72 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
TP TA2R Human Prostanoid A pIC50 5.34 5.34 5.34 ChEMBL
DP2 PD2R2 Human Prostanoid A pIC50 7.58 7.7 7.82 ChEMBL