Spebrutinib - Small Molecule (ID:10428-101)
| HMS LINCS ID: |
10428-101
|
| Name: | Spebrutinib |
| Alternative Names: | CC-292; AVL-292 |
| LINCS ID: | |
| PubChem CID: | 59174488 |
| ChEBI ID: | |
| ChEMBL ID: | |
| Molecular Mass: | 423.17 |
| InChi: | InChI=1S/C22H22FN5O3/c1-3-20(29)25-16-5-4-6-17(13-16)26-21-19(23)14-24-22(28-21)27-15-7-9-18(10-8-15)31-12-11-30-2/h3-10,13-14H,1,11-12H2,2H3,(H,25,29)(H2,24,26,27,28) |
| InChi Key: | KXBDTLQSDKGAEB-UHFFFAOYSA-N |
| SMILES: | COCCOC1=CC=C(C=C1)NC2=NC=C(C(=N2)NC3=CC(=CC=C3)NC(=O)C=C)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 |
|---|---|
BTK |
Batch Information for HMSL10428-101-1:
| HMS LINCS Batch ID: | 10428-101-1 |
| Provider: | MedChem Express |
| Provider Batch ID: | 11983 |
| Salt: | 101 |
| Molecular Formula: | C22H22FN5O3 |
| Molecular Weight: | 423.44 |
| Purity: | |
| Purification Method: | |
| Chemical Synthesis Reference: | |
| Comments: | |
| Date Publicly Available: | 2015-08-27 |
| Most Recent Update: | 2016-04-04 |
HMS QC Testing Events for HMSL10428-101-1:
| Date | HMS QC Outcome | Comment | Files |
|---|---|---|---|
| 08/31/2015 | PASS | HMSL10428-101-1_LCMS.pdf |
(equivalent to 100 nM ≤ Kd < 1µM)