VE-821 - Small Molecule (ID:10361-101)

HMS LINCS ID: 10361-101
Name: VE-821
Alternative Names:
LINCS ID: LSM-36358
PubChem CID: 51000408
ChEBI ID:
ChEMBL ID:
Molecular Mass: 368.09
InChi: InChI=1S/C18H16N4O3S/c1-26(24,25)14-9-7-12(8-10-14)15-11-20-17(19)16(22-15)18(23)21-13-5-3-2-4-6-13/h2-11H,1H3,(H2,19,20)(H,21,23)
InChi Key: DUIHHZKTCSNTGM-UHFFFAOYSA-N
SMILES: CS(=O)(=O)C1=CC=C(C=C1)C2=CN=C(C(=N2)C(=O)NC3=CC=CC=C3)N
Relevant Citations:
Comments:
Date Publicly Available:
Most Recent Update: 2016-04-04

Target Affinity:

(see Study 20000)
Target Affinity Spectrum Value HUGO Gene Name
1
(Kd <100 nM)
ATR
3
(equivalent to 1µM ≤ Kd < 10 µM)
ATM, PRKDC

Datasets:

HMS Dataset ID Dataset Title HMS Dataset Type
20000
Target Affinity Spectrum (TAS) vectors for compounds in the HMS LINCS small molecule library.
Analysis

Batch Information:

HMS LINCS Batch ID Provider Provider Batch ID
10361-101-1 MedChem Express HM-125-20110531