CHEMBL5077811


SMILES CC(=O)N[C@H]1CSSC[C@@H](C(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc2c[nH]c3ccccc23)N(C)C(=O)[C@H](CCCNC(=N)N)N(C)C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2c[nH]cn2)NC1=O
InChIKey UCISEPWWFQDZAP-ZTYVOHGWSA-N

Chemical properties

Hydrogen bond acceptors None
Hydrogen bond donors None
Rotatable bonds None
Molecular weight (Da)

Drug properties

Molecular type Na
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 7.25 7.25 7.25 ChEMBL
MC3 MC3R Human Melanocortin A pKi 5.5 5.5 5.5 ChEMBL
MC4 MC4R Human Melanocortin A pKi 5.69 5.69 5.69 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MC1 MSHR Human Melanocortin A pEC50 8.26 8.26 8.26 ChEMBL
MC5 MC5R Human Melanocortin A pIC50 5.0 5.0 5.0 ChEMBL
MC3 MC3R Human Melanocortin A pEC50 6.4 6.4 6.4 ChEMBL
MC4 MC4R Human Melanocortin A pEC50 5.44 6.32 7.2 ChEMBL