FR191413


SMILES COc1nc2c(n1Cc1ccccn1)cccc2OCc1c(Cl)ccc(c1Cl)N(C(=O)CNC(=O)/C=C/c1ccc(nc1)NC(=O)C)C
InChIKey KXMCFJQQOFOBKN-RVDMUPIBSA-N

Chemical properties

Hydrogen bond acceptors 9
Hydrogen bond donors 2
Rotatable bonds 12
Molecular weight (Da) 687.2

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

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
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
B2 BKRB2 Human Bradykinin A pIC50 9.2 9.2 9.2 Guide to Pharmacology
B2 BKRB2 Human Bradykinin A pIC50 9.16 9.16 9.17 ChEMBL
B2 BKRB2 Guinea pig Bradykinin A pIC50 8.2 8.2 8.2 ChEMBL