CHEMBL222038


SMILES Cc1noc(-c2c(F)cccc2-c2ccc([C@@H](C)Nc3nccc(Cl)c3NC(=O)CC#N)cc2)n1
InChIKey SCJWBYXWZGMQHS-CQSZACIVSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 2
Rotatable bonds 7
Molecular weight (Da) 490.1

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
B1 BKRB1 Rabbit Bradykinin A pKi 8.57 8.57 8.57 ChEMBL
B1 BKRB1 Rat Bradykinin A pKi 7.09 7.09 7.09 ChEMBL
B1 BKRB1 Human Bradykinin A pKi 9.3 9.3 9.3 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
B1 BKRB1 Rabbit Bradykinin A pIC50 7.91 7.91 7.91 ChEMBL
B1 BKRB1 Human Bradykinin A pIC50 9.03 9.03 9.03 ChEMBL