CHEMBL194085


SMILES O=C(O)Cn1c2c(c3ccccc31)C[C@H](NS(=O)(=O)c1ccc(F)cc1)CC2
InChIKey NONWUVBJQKYHHO-CQSZACIVSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 5
Molecular weight (Da) 402.1

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
DP1 PD2R Human Prostanoid A pKi 5.28 5.28 5.28 ChEMBL
DP2 PD2R2 Human Prostanoid A pKi 9.29 9.29 9.29 ChEMBL
TP TA2R Human Prostanoid A pKi 6.27 6.27 6.27 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
DP2 PD2R2 Human Prostanoid A pIC50 8.42 8.42 8.42 ChEMBL
TP TA2R Human Prostanoid A pIC50 5.77 5.77 5.77 ChEMBL