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

1096341 - Overview - Compound Synopsis

Synonyms
1B3
Molecular Formula
C18H18ClN5O4S
InChI
InChI=1S/C18H18ClN5O4S/c1-9(25)15(20)17(26)24-29(27,28)12-4-2-3-10(7-12)11-5-6-13-14(8-11)22-18(19)23-16(13)21/h2-9,15,25H,20H2,1H3,(H,24,26)(H2,21,22,23)/t9-,15+/m1/s1
Smiles
C[C@@H](O)[C@H](N)C(=O)NS(=O)(=O)c1cccc(-c2ccc3c(N)nc(Cl)nc3c2)c1
Cross References
UniChem32392114
canSAR1096341
ChEMBLCHEMBL2311920
PDBe (Protein Data Bank Europe)1B3
BindingDB50426188
Commercially Available
Unknown


MOLECULAR_WEIGHT ALOGP HBOND_DONORS HBOND_ACCEPTORS ATOMS CONTAINS_TOXICOPHORE
Properties 435.0768027361.04546947No


Compounds with the same scaffold


Image of compound ID: 1096341
Murko Scaffold Family: 4231 compoundsClick here to open a new canSAR search with these compounds

Maximum number shown here is 12