CHEMBL379879


SMILES NC(N)=NCCC[C@H]1C[C@@H](OCc2ccc3ccccc3c2)CN1C(=O)[C@H](N)Cc1ccccc1
InChIKey ZPOQUKYSTRZAFA-JIMJEQGWSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 3
Rotatable bonds 10
Molecular weight (Da) 473.3

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
MC1 MSHR Human Melanocortin A pKi 6.42 6.42 6.42 ChEMBL
MC3 MC3R Human Melanocortin A pKi 5.91 5.91 5.91 ChEMBL
MC4 MC4R Human Melanocortin A pKi 6.52 6.52 6.52 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MC1 MSHR Human Melanocortin A pEC50 6.82 6.82 6.82 ChEMBL
MC3 MC3R Human Melanocortin A pEC50 6.06 6.06 6.06 ChEMBL
MC4 MC4R Human Melanocortin A pEC50 6.54 6.54 6.54 ChEMBL