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

753314 - Overview - Compound Synopsis

Synonyms
COCARBOXYLASECo-Carboxylase
CocarboxylaseTPP
Molecular Formula
C12H19N4O7P2S+
InChI
InChI=1S/C12H18N4O7P2S/c1-8-11(3-4-22-25(20,21)23-24(17,18)19)26-7-16(8)6-10-5-14-9(2)15-12(10)13/h5,7H,3-4,6H2,1-2H3,(H4-,13,14,15,17,18,19,20,21)/p+1
Smiles
Cc1ncc(C[n+]2csc(CCOP(=O)(O)OP(=O)(O)O)c2C)c(N)n1
Cross References
UniChem656063
canSAR753314
PDBe (Protein Data Bank Europe)TPP
ChEMBLCHEMBL1236376
BindingDB92962
Commercially Available
Yes


MOLECULAR_WEIGHT ALOGP HBOND_DONORS HBOND_ACCEPTORS ATOMS CONTAINS_TOXICOPHORE
Properties 425.044419628090.8417451145Yes


Compounds with the same scaffold


Image of compound ID: 753314
Murko Scaffold Family: 40 compoundsClick here to open a new canSAR search with these compounds

Maximum number shown here is 12





Compound Lineages


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