CHEMBL378293


SMILES CC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H](OCc2ccc3ccccc3c2)C[C@@H]1C(=O)NCCN=C(N)N
InChIKey FRLGHEFWPNKBDQ-VWPRMMSESA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 6
Rotatable bonds 15
Molecular weight (Da) 681.3

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
MC1 MSHR Human Melanocortin A pKi 7.89 7.89 7.89 ChEMBL
MC3 MC3R Human Melanocortin A pKi 6.08 6.08 6.08 ChEMBL
MC4 MC4R Human Melanocortin A pKi 5.8 5.8 5.8 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MC1 MSHR Human Melanocortin A pEC50 8.52 8.52 8.52 ChEMBL
MC3 MC3R Human Melanocortin A pEC50 6.47 6.47 6.47 ChEMBL
MC4 MC4R Human Melanocortin A pEC50 6.82 6.82 6.82 ChEMBL