Compound Synopsis
Compound Overview
Bioactivity Data Summary
Protein Affinity Profile
Cellline Sensitivity Profile

92813 - Overview - Compound Synopsis

Synonyms
MBNTOLUENE
Toluene
Molecular Formula
C7H8
InChI
InChI=1S/C7H8/c1-7-5-3-2-4-6-7/h2-6H,1H3
Smiles
Cc1ccccc1
Cross References
UniChem144917
canSAR92813
PDBe (Protein Data Bank Europe)MBN
ChEMBLCHEMBL9113
BindingDB50008558
Commercially Available
Yes


MOLECULAR_WEIGHT ALOGP HBOND_DONORS HBOND_ACCEPTORS ATOMS CONTAINS_TOXICOPHORE
Properties 92.0626002561.995020015No


Compounds with the same scaffold


Image of compound ID: 92813
Murko Scaffold Family: 52097 compoundsClick here to open a new canSAR search with these compounds

Maximum number shown here is 12