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

1103757 - Overview - Compound Synopsis

Synonyms
TMV
Molecular Formula
C12H21N4O8PSV+
InChI
InChI=1S/C12H17N4O4PS.4H2O.V/c1-8-11(3-4-20-21(17,18)19)22-7-16(8)6-10-5-14-9(2)15-12(10)13;;;;;/h5,7H,3-4,6H2,1-2H3,(H3-,13,14,15,17,18,19);4*1H2;/q;;;;;+5/p-4
Smiles
Cc1ncc(C[n+]2csc(CCOP(=O)(O)O[V](O)(O)(O)O)c2C)c(N)n1
Cross References
UniChem82237641
canSAR1103757
PDBe (Protein Data Bank Europe)TMV
Commercially Available
Unknown


MOLECULAR_WEIGHT ALOGP HBOND_DONORS HBOND_ACCEPTORS ATOMS CONTAINS_TOXICOPHORE
Properties 462.02838118209-1.0171671248Yes


Compounds with the same scaffold


Image of compound ID: 1103757
Murko Scaffold Family: 40 compoundsClick here to open a new canSAR search with these compounds

Maximum number shown here is 12