CHEMBL225607


SMILES COC(=O)c1c(F)cccc1-c1ccc([C@@H](C)Nc2nccc(Cl)c2NC(=O)CC#N)cc1
InChIKey MUTKNBYEVNZQBV-CQSZACIVSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 7
Molecular weight (Da) 466.1

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
B1 BKRB1 Human Bradykinin A pKi 9.4 9.4 9.4 ChEMBL
B1 BKRB1 Rat Bradykinin A pKi 7.45 7.45 7.45 ChEMBL
B1 BKRB1 Rabbit Bradykinin A pKi 9.16 9.16 9.16 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
B1 BKRB1 Human Bradykinin A pIC50 9.6 9.6 9.6 ChEMBL
B1 BKRB1 Rabbit Bradykinin A pIC50 8.62 8.62 8.62 ChEMBL