CHEMBL84864


SMILES C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@@H](CC(=O)O)Cc1ccc(N)c(I)c1
InChIKey YMNQSYWYYQDKJU-FKRPALPOSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 5
Rotatable bonds 10
Molecular weight (Da) 698.2

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
CCK2 GASR Mouse Cholecystokinin A pKi 9.28 9.28 9.28 ChEMBL
CCK1 CCKAR Rat Cholecystokinin A pKi 6.8 6.8 6.8 ChEMBL
CCK2 GASR Human Cholecystokinin A pKd 9.6 9.6 9.6 ChEMBL
CCK2 GASR Human Cholecystokinin A pKi 9.4 9.4 9.4 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database