NG25 - Small Molecule (ID:10419-101)
| HMS LINCS ID: |
10419-101
|
| Name: | NG25 |
| Alternative Names: | |
| LINCS ID: | |
| PubChem CID: | 53340664 |
| ChEBI ID: | |
| ChEMBL ID: | |
| Molecular Mass: | 537.24 |
| InChi: | InChI=1S/C29H30F3N5O2/c1-3-36-12-14-37(15-13-36)18-21-6-7-22(17-24(21)29(30,31)32)35-28(38)20-5-4-19(2)26(16-20)39-25-9-11-34-27-23(25)8-10-33-27/h4-11,16-17H,3,12-15,18H2,1-2H3,(H,33,34)(H,35,38) |
| InChi Key: | SMPGEBOIKULBCT-UHFFFAOYSA-N |
| SMILES: | CCN1CCN(CC1)CC2=C(C=C(C=C2)NC(=O)C3=CC(=C(C=C3)C)OC4=C5C=CNC5=NC=C4)C(F)(F)F |
| Relevant Citations: | |
| Comments: | |
| Date Publicly Available: | |
| Most Recent Update: | 2016-04-04 |
Target Affinity:
(see Study 20000)| Target Affinity Spectrum Value | HUGO Gene Name |
|---|---|
MAP3K7, MAP4K2 |
Batch Information for HMSL10419-101-1:
| HMS LINCS Batch ID: | 10419-101-1 |
| Provider: | MedChem Express |
| Provider Batch ID: | 04337 |
| Salt: | 101 |
| Molecular Formula: | C29H30F3N5O2 |
| Molecular Weight: | 537.58 |
| Purity: | |
| Purification Method: | |
| Chemical Synthesis Reference: | |
| Comments: | |
| Date Publicly Available: | 2015-08-27 |
| Most Recent Update: | 2016-04-04 |
HMS QC Testing Events for HMSL10419-101-1:
| Date | HMS QC Outcome | Comment | Files |
|---|---|---|---|
| 08/31/2015 | PASS | HMSL10419-101-1_NMR.pdf, HMSL10419-101-1_LCMS.pdf |
(equivalent to 100 nM ≤ Kd < 1µM)