5-butyl-1H-pyrazole-3-carboxylic acid


SMILES CCCCc1cc(n[nH]1)C(=O)O
InChIKey ZJTXSGLJNBAMJS-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 2
Hydrogen bond donors 2
Rotatable bonds 4
Molecular weight (Da) 168.1

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Structure pdb 8IHH

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
HCA2 HCAR2 Rat Hydroxycarboxylic acid A pKi 7.1 7.1 7.1 Guide to Pharmacology
HCA2 HCAR2 Rat Hydroxycarboxylic acid A pKi 7.14 7.14 7.14 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
HCA3 HCAR3 Human Hydroxycarboxylic acid A pEC50 4.93 4.93 4.93 ChEMBL
HCA2 HCAR2 Human Hydroxycarboxylic acid A pEC50 5.85 6.46 7.07 ChEMBL