VL-0395


SMILES OC(=O)CC(c1ccccc1)NC(=O)c1cccc(c1)NC(=O)c1cc2c([nH]1)ccc(c2)C(=N)N
InChIKey RVWSCZNGPOUASU-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 6
Rotatable bonds 8
Molecular weight (Da) 469.2

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
Y5 NPY5R Rat Neuropeptide Y A pKi 8.96 8.96 8.96 PDSP Ki database
Y1 NPY1R Rat Neuropeptide Y A pKi 8.89 8.89 8.89 PDSP Ki database
Y5 NPY5R Rat Neuropeptide Y A pKi 9.5 9.5 9.5 Guide to Pharmacology
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
Y5 NPY5R Human Neuropeptide Y A pIC50 8.54 8.63 8.89 ChEMBL
α2A ADA2A Human Adrenoceptors A pIC50 7.01 7.01 7.01 ChEMBL
MCH1 MCHR1 Human Melanin-concentrating hormone A pIC50 5.46 5.46 5.46 ChEMBL
Y1 NPY1R Human Neuropeptide Y A pIC50 5.08 5.08 5.08 ChEMBL
Y2 NPY2R Human Neuropeptide Y A pIC50 5.72 5.72 5.72 ChEMBL
Y4 NPY4R Human Neuropeptide Y A pIC50 5.24 5.24 5.24 ChEMBL
Y5 NPY5R Rat Neuropeptide Y A pIC50 8.85 8.85 8.85 ChEMBL