CHEMBL30917


SMILES CN1C(=O)[C@H](NC(=O)Nc2cccc(CC(=O)NCCCC(=O)NCCCOc3cccc(CN4CCCCC4)c3)c2)N=C(c2ccccc2)c2ccccc21
InChIKey NUKQDDDIEUKMIF-WBCKFURZSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 4
Rotatable bonds 16
Molecular weight (Da) 757.4

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
H2 HRH2 Rat Histamine A pKd 6.4 6.4 6.4 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
CCK1 CCKAR Mouse Cholecystokinin A pIC50 6.48 6.48 6.48 ChEMBL
CCK2 GASR Mouse Cholecystokinin A pIC50 6.69 6.69 6.69 ChEMBL
CCK2 GASR Human Cholecystokinin A pIC50 6.94 6.94 6.94 ChEMBL