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

859933 - Overview - Compound Synopsis

Synonyms
T04
Molecular Formula
C23H20FN3O6S2
InChI
InChI=1S/C23H20FN3O6S2/c24-16-6-3-13(9-15(16)20(30)26-17(22(32)33)7-8-19(28)29)11-25-14-4-1-12(2-5-14)10-18-21(31)27-23(34)35-18/h1-6,9-10,17,25H,7-8,11H2,(H,26,30)(H,28,29)(H,32,33)(H,27,31,34)/b18-10-/t17-/m1/s1
Smiles
O=C(O)CC[C@@H](NC(=O)c1cc(CNc2ccc(/C=C3\SC(=S)NC3=O)cc2)ccc1F)C(=O)O
Cross References
UniChem1028944
canSAR859933
ChEMBLCHEMBL1738901
PDBe (Protein Data Bank Europe)T04
Commercially Available
Unknown


MOLECULAR_WEIGHT ALOGP HBOND_DONORS HBOND_ACCEPTORS ATOMS CONTAINS_TOXICOPHORE
Properties 517.077755582.97445955Yes


Compounds with the same scaffold


Image of compound ID: 859933
Murko Scaffold Family: 194 compoundsClick here to open a new canSAR search with these compounds

Maximum number shown here is 12