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

1016423 - Overview - Compound Synopsis

Synonyms
E57
Molecular Formula
C22H26ClN5O3
InChI
InChI=1S/C22H26ClN5O3/c1-3-17(11-29)26-22-25-9-13(2)20(28-22)15-8-18(24-10-15)21(31)27-19(12-30)14-5-4-6-16(23)7-14/h4-10,17,19,24,29-30H,3,11-12H2,1-2H3,(H,27,31)(H,25,26,28)/t17-,19+/m0/s1
Smiles
CCC(CO)Nc1ncc(C)c(-c2c[nH]c(C(=O)NC(CO)c3cccc(Cl)c3)c2)n1
Cross References
UniChem27264708
canSAR1016423
PDBe (Protein Data Bank Europe)E57
BindingDB92080
Commercially Available
Unknown


MOLECULAR_WEIGHT ALOGP HBOND_DONORS HBOND_ACCEPTORS ATOMS CONTAINS_TOXICOPHORE
Properties 443.1724173723.079725857No


Compounds with the same scaffold


Image of compound ID: 1016423
Murko Scaffold Family: 194 compoundsClick here to open a new canSAR search with these compounds

Maximum number shown here is 12