CHEMBL340355


SMILES O=C(N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(c2ccccc2Cn2cncn2)CC1)[C@H]1Cc2ccccc2CN1
InChIKey PKHOEKKVDQTOOR-FQLXRVMXSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 2
Rotatable bonds 8
Molecular weight (Da) 583.2

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
MC5 MC5R Human Melanocortin A pKi 5.92 5.92 5.92 ChEMBL
MC3 MC3R Human Melanocortin A pKi 7.62 7.62 7.62 ChEMBL
MC4 MC4R Human Melanocortin A pKi 6.57 6.57 6.57 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MC4 MC4R Mouse Melanocortin A pEC50 7.23 7.23 7.23 ChEMBL
MC4 MC4R Human Melanocortin A pEC50 6.96 7.03 7.1 ChEMBL