GDC-0994 - Small Molecule (ID:10375-101)
| HMS LINCS ID: |
10375-101
|
| Name: | GDC-0994 |
| Alternative Names: | |
| LINCS ID: | |
| PubChem CID: | 71727581 |
| ChEBI ID: | |
| ChEMBL ID: | |
| Molecular Mass: | 440.12 |
| InChi: | InChI=1S/C21H18ClFN6O2/c1-28-19(5-8-25-28)27-21-24-7-4-17(26-21)13-6-9-29(20(31)11-13)18(12-30)14-2-3-15(22)16(23)10-14/h2-11,18,30H,12H2,1H3,(H,24,26,27)/t18-/m1/s1 |
| InChi Key: | RZUOCXOYPYGSKL-GOSISDBHSA-N |
| SMILES: | CN1C(NC2=NC=CC(C3=CC(N([C@@H](C4=CC(F)=C(Cl)C=C4)CO)C=C3)=O)=N2)=CC=N1 |
| Relevant Citations: | |
| Comments: | |
| Date Publicly Available: | |
| Most Recent Update: | 2016-04-04 |
Target Affinity:
(see Study 20000)| Target Affinity Spectrum Value | HUGO Gene Name |
|---|---|
MAPK1, MAPK3 |
Batch Information for HMSL10375-101-1:
| HMS LINCS Batch ID: | 10375-101-1 |
| Provider: | MedChem Express |
| Provider Batch ID: | 14696 |
| Salt: | 101 |
| Molecular Formula: | C21H18ClFN6O2 |
| Molecular Weight: | 440.86 |
| Purity: | |
| Purification Method: | |
| Chemical Synthesis Reference: | |
| Comments: | |
| Date Publicly Available: | 2015-08-27 |
| Most Recent Update: | 2016-04-04 |
HMS QC Testing Events for HMSL10375-101-1:
| Date | HMS QC Outcome | Comment | Files |
|---|---|---|---|
| 08/31/2015 | PASS | HMSL10375-101-1_NMR.pdf, HMSL10375-101-1_LCMS.pdf |
(equivalent to 100 nM ≤ Kd < 1µM)