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

954433 - Overview - Compound Synopsis

Synonyms
3O2
Molecular Formula
C26H31F3N6O7S
InChI
InChI=1S/C26H31F3N6O7S/c1-40-18-16-34-14-11-25(12-15-34,24(36)32-37)43(38,39)22-9-7-20(8-10-22)41-17-2-13-35-31-23(30-33-35)19-3-5-21(6-4-19)42-26(27,28)29/h3-10,37H,2,11-18H2,1H3,(H,32,36)
Smiles
COCCN1CCC(C(=O)NO)(S(=O)(=O)c2ccc(OCCCn3nnc(-c4ccc(OC(F)(F)F)cc4)n3)cc2)CC1
Cross References
UniChem1077956
canSAR954433
ChEMBLCHEMBL1771216
PDBe (Protein Data Bank Europe)3O2
BindingDB50343081
Commercially Available
Unknown


MOLECULAR_WEIGHT ALOGP HBOND_DONORS HBOND_ACCEPTORS ATOMS CONTAINS_TOXICOPHORE
Properties 628.1927029922.467921374Yes


Compounds with the same scaffold


Image of compound ID: 954433
Murko Scaffold Family: 1 compoundsClick here to open a new canSAR search with these compounds

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