timapiprant


SMILES Fc1ccc2c(c1)c(Cc1ccc3c(n1)cccc3)c(n2CC(=O)O)C
InChIKey FATGTHLOZSXOBC-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 4
Molecular weight (Da) 348.1

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
DP2 PD2R2 Human Prostanoid A pKi 7.89 7.89 7.89 Guide to Pharmacology
DP2 PD2R2 Rat Prostanoid A pKi 8.52 8.52 8.52 Guide to Pharmacology
DP2 PD2R2 Human Prostanoid A pKi 7.89 7.89 7.89 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
DP1 PD2R Human Prostanoid A pIC50 5.14 5.14 5.14 ChEMBL
DP2 PD2R2 Human Prostanoid A pIC50 6.89 7.46 8.22 ChEMBL
DP2 PD2R2 Human Prostanoid A pEC50 7.62 7.62 7.62 ChEMBL
IP PI2R Human Prostanoid A pIC50 4.24 4.24 4.24 ChEMBL