5-butyl-methyl immidazole carboxylate 30


SMILES CCCCc1cnc(n1Cc1ccc(cc1)c1ccccc1C)C(=O)O
InChIKey ZCAMCVJTCSXPMT-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 7
Molecular weight (Da) 348.2

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
β1 ADRB1 Human Adrenoceptors A pKi 10.0 10.0 10.0 ChEMBL
β3 ADRB3 Human Adrenoceptors A pKi 6.39 6.39 6.39 ChEMBL
β2 ADRB2 Human Adrenoceptors A pKi 8.1 8.1 8.1 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database