CHEMBL2113139


SMILES O=C(N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(c2cccc3c2CN(S(=O)(=O)c2ccccc2)CC3)CC1)[C@H]1Cc2ccccc2CN1
InChIKey CHKKKMVWAASWKU-VSJLXWSYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 8
Molecular weight (Da) 697.2

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
MC1 MSHR Human Melanocortin A pKi 5.16 5.16 5.16 ChEMBL
MC5 MC5R Human Melanocortin A pKi 6.16 6.16 6.16 ChEMBL
MC3 MC3R Human Melanocortin A pKi 5.92 5.92 5.92 ChEMBL
MC4 MC4R Human Melanocortin A pKi 5.6 5.6 5.6 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database