setipiprant


SMILES Fc1ccc2c(c1)c1CN(CCc1n2CC(=O)O)C(=O)c1cccc2c1cccc2
InChIKey IHAXLPDVOWLUOS-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 3
Molecular weight (Da) 402.1

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug Yes

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
DP2 PD2R2 Human Prostanoid A pIC50 8.22 8.22 8.22 Guide to Pharmacology
EP2 PE2R2 Human Prostanoid A pIC50 5.58 5.58 5.58 ChEMBL
DP1 PD2R Human Prostanoid A pIC50 5.89 5.89 5.89 ChEMBL
DP2 PD2R2 Human Prostanoid A pIC50 6.47 7.19 8.22 ChEMBL