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

753148 - Overview - Compound Synopsis

Synonyms
237
Molecular Formula
C26H25ClFN3O5S
InChI
InChI=1S/C26H25ClFN3O5S/c1-36-19-14-23(31(15-19)26(33)29-18-10-8-17(27)9-11-18)25(32)30-22-12-7-16(13-21(22)28)20-5-3-4-6-24(20)37(2,34)35/h3-13,19,23H,14-15H2,1-2H3,(H,29,33)(H,30,32)/t19-,23-/m1/s1
Smiles
CO[C@@H]1C[C@H](C(=O)Nc2ccc(-c3ccccc3S(C)(=O)=O)cc2F)N(C(=O)Nc2ccc(Cl)cc2)C1
Cross References
UniChem651832
canSAR753148
PDBe (Protein Data Bank Europe)237
ChEMBLCHEMBL1229814
BindingDB50328726
Commercially Available
Unknown


MOLECULAR_WEIGHT ALOGP HBOND_DONORS HBOND_ACCEPTORS ATOMS CONTAINS_TOXICOPHORE
Properties 545.11874784.80952862No


Compounds with the same scaffold


Image of compound ID: 753148
Murko Scaffold Family: 327 compoundsClick here to open a new canSAR search with these compounds

Maximum number shown here is 12