CHEMBL4861645


SMILES CC(=O)N[C@H](Cc1ccc(I)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](CCCNC(=N)N)C(N)=O
InChIKey JFVISPBLQYTSHU-VZNYXHRGSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 11
Rotatable bonds 20
Molecular weight (Da) 841.3

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
MC3 MC3R Mouse Melanocortin A pKd 6.9 7.6 8.3 ChEMBL
MC3 MC3R Mouse Melanocortin A pKi 6.89 7.6 8.3 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MC1 MSHR Mouse Melanocortin A pEC50 6.4 6.4 6.4 ChEMBL