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

1016806 - Overview - Compound Synopsis

Synonyms
EK7
Molecular Formula
C19H17N5OS
InChI
InChI=1S/C19H17N5OS/c1-24(2)18-16-14(15(9-20)26-18)7-6-11-10-21-19(23-17(11)16)22-12-4-3-5-13(25)8-12/h3-5,8,10,25H,6-7H2,1-2H3,(H,21,22,23)
Smiles
CN(C)c1sc(C#N)c2c1-c1nc(Nc3cccc(O)c3)ncc1CC2
Cross References
UniChem27265217
canSAR1016806
PDBe (Protein Data Bank Europe)EK7
BindingDB92073
Commercially Available
Unknown


MOLECULAR_WEIGHT ALOGP HBOND_DONORS HBOND_ACCEPTORS ATOMS CONTAINS_TOXICOPHORE
Properties 363.1153811643.690582643No