CHEMBL4466724


SMILES C[C@@H]1NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O
InChIKey DQAIHAMKDFPWFW-MZPDUBGKSA-N

Chemical properties

Hydrogen bond acceptors 11
Hydrogen bond donors 11
Rotatable bonds 12
Molecular weight (Da) 992.5

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
MC3 MC3R Mouse Melanocortin A pKd 5.8 5.8 5.8 ChEMBL
MC4 MC4R Mouse Melanocortin A pKd 6.1 6.1 6.1 ChEMBL
MC4 MC4R Human Melanocortin A pKd 6.5 6.5 6.5 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MC4 MC4R Mouse Melanocortin A pIC50 5.7 5.7 5.7 ChEMBL
MC4 MC4R Human Melanocortin A pIC50 4.84 4.84 4.84 ChEMBL