indomethacin


SMILES COc1ccc2c(c1)c(CC(=O)O)c(n2C(=O)c1ccc(cc1)Cl)C
InChIKey CGIGDMFJXJATDK-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 4
Molecular weight (Da) 357.1

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug Yes

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
DP2 PD2R2 Human Prostanoid A pKi 6.1 6.9 7.7 Guide to Pharmacology
DP2 PD2R2 Mouse Prostanoid A pKi 5.7 5.85 6.0 Guide to Pharmacology
DP2 PD2R2 Human Prostanoid A pKi 5.1 6.2 7.3 ChEMBL
EP4 PE2R4 Human Prostanoid A pKi 7.0 7.61 8.15 PDSP Ki database
EP2 PE2R2 Dog Prostanoid A pKi 6.52 6.52 6.52 PDSP Ki database
EP2 PE2R2 Rat Prostanoid A pKi 6.52 7.13 7.74 PDSP Ki database
DP2 PD2R2 Human Prostanoid A pKi 8.19 8.19 8.19 Drug Central
EP2 PE2R2 Human Prostanoid A pKi 8.11 8.11 8.11 Drug Central
DP2 PD2R2 Mouse Prostanoid A pKi 8.22 8.22 8.22 Drug Central
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
DP2 PD2R2 Human Prostanoid A pEC50 6.41 6.41 6.41 ChEMBL
NPS NPSR1 Human Neuropeptide S A Potency 5.8 5.8 5.8 ChEMBL
GPR17 GPR17 Human A orphans A pIC50 4.54 4.54 4.54 ChEMBL