CHEMBL237502


SMILES COc1ccccc1/C=C/CN(C(=O)CCCc1c[nH]c2ccccc12)C1CCC(CC2CCC(N)CC2)CC1
InChIKey PKEDTJCBPAOIAW-JXMROGBWSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 11
Molecular weight (Da) 541.4

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Sankey plot

Compound is not listed as a drug.

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MC1 MSHR Mouse Melanocortin A pKi 5.8 5.81 5.82 ChEMBL
MC5 MC5R Human Melanocortin A pKi 5.12 5.21 5.3 ChEMBL
MC3 MC3R Human Melanocortin A pKi 4.51 4.64 4.77 ChEMBL
MC4 MC4R Human Melanocortin A pKi 5.31 5.35 5.39 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database