U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C20H11N5OS
Molecular Weight 369.399
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HI-TOPK-032

SMILES

O=C(NC1=CC2=C(C#N)C3=NC4=CC=CC=C4N=C3N2C=C1)C5=CC=CS5

InChI

InChIKey=BCSBXWKRZUPFHW-UHFFFAOYSA-N
InChI=1S/C20H11N5OS/c21-11-13-16-10-12(22-20(26)17-6-3-9-27-17)7-8-25(16)19-18(13)23-14-4-1-2-5-15(14)24-19/h1-10H,(H,22,26)

HIDE SMILES / InChI

Approval Year

Targets

Primary TargetPharmacologyConditionPotency
9.6 µM [IC50]