CHEMBL1744083


SMILES CCCN1C(=O)[C@H](NC(=O)Nc2ccc(N3CCC(N4CCCCC4)CC3)cc2)N=C(CCc2ccccc2)c2ccccc21
InChIKey WIYQBPUJBIMONN-DHUJRADRSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 9
Molecular weight (Da) 606.4

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 Rat Bradykinin A pKi 8.71 8.71 8.71 ChEMBL
B1 BKRB1 Human Bradykinin A pKi 8.86 8.86 8.86 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
B1 BKRB1 Rat Bradykinin A pIC50 8.14 8.14 8.14 ChEMBL
B1 BKRB1 Human Bradykinin A pIC50 8.32 8.32 8.32 ChEMBL