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 |
|---|---|
ATR | |
3 (equivalent to 1µM ≤ Kd < 10 µM) | ATM, PRKDC |
Batch Information for HMSL10361-101-1:
| HMS LINCS Batch ID: | 10361-101-1 |
| Provider: | MedChem Express |
| Provider Batch ID: | HM-125-20110531 |
| Salt: | 101 |
| Molecular Formula: | C18H16N4O3S |
| Molecular Weight: | 368.41 |
| Purity: | |
| Purification Method: | |
| Chemical Synthesis Reference: | |
| Comments: | |
| Date Publicly Available: | 2015-02-06 |
| Most Recent Update: | 2016-04-04 |
HMS QC Testing Events for HMSL10361-101-1:
| Date | HMS QC Outcome | Comment | Files |
|---|---|---|---|
| 04/13/2015 | PASS | HMSL10361-101-1_NMR.pdf, HMSL10361-101-1_LCMS.pdf |
(Kd <100 nM)