ML354


SMILES OCc1c(c2ccccc2)c2c(n1C)ccc(c2)[N+](=O)[O-]
InChIKey GNJUKVGDCUKDLF-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 3
Molecular weight (Da) 282.1

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
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
NPS NPSR1 Human Neuropeptide S A Potency 4.7 4.7 4.7 ChEMBL
PAR1 PAR1 Human Proteinase-activated A pIC50 5.0 5.0 5.0 ChEMBL
PAR4 PAR4 Human Proteinase-activated A pIC50 6.85 6.85 6.85 ChEMBL
PAR4 PAR4 Human Proteinase-activated A pIC50 6.85 6.85 6.85 Guide to Pharmacology