bradyzide


SMILES CN(CCN(C)C)CCNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(c(c1)[N+](=O)[O-])NNC(=S)NC(c1ccccc1)c1ccccc1
InChIKey ZIBIVIRBYMBEHZ-NDEPHWFRSA-N

Chemical properties

Hydrogen bond acceptors 9
Hydrogen bond donors 4
Rotatable bonds 15
Molecular weight (Da) 682.3

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
apelin APJ Human Apelin A pKd 10.52 10.52 10.52 Guide to Pharmacology
apelin APJ Human Apelin A pKi 10.13 10.13 10.13 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
apelin APJ Human Apelin A pEC50 8.15 9.81 10.64 ChEMBL
apelin APJ Mouse Apelin A pEC50 10.57 10.57 10.57 ChEMBL