I-BET - Small Molecule (ID:10330-101)
| HMS LINCS ID: |
10330-101
|
| Name: | I-BET |
| Alternative Names: | GSK 525762A |
| LINCS ID: | LSM-6334 |
| PubChem CID: | 46943432 |
| ChEBI ID: | |
| ChEMBL ID: | |
| Molecular Mass: | 423.15 |
| InChi: | InChI=1S/C22H22ClN5O2/c1-4-24-20(29)12-18-22-27-26-13(2)28(22)19-10-9-16(30-3)11-17(19)21(25-18)14-5-7-15(23)8-6-14/h5-11,18H,4,12H2,1-3H3,(H,24,29)/t18-/m0/s1 |
| InChi Key: | AAAQFGUYHFJNHI-SFHVURJKSA-N |
| SMILES: | CCNC(=O)C[C@H]1C2=NN=C(N2C3=C(C=C(C=C3)OC)C(=N1)C4=CC=C(C=C4)Cl)C |
| Relevant Citations: | |
| Comments: | |
| Date Publicly Available: | |
| Most Recent Update: | 2016-04-04 |
Target Affinity:
(see Study 20000)| Target Affinity Spectrum Value | HUGO Gene Name |
|---|---|
BRD2, BRD3, BRD4 | |
10 (confirmed non-binding) |
Batch Information for HMSL10330-101-1:
| HMS LINCS Batch ID: | 10330-101-1 |
| Provider: | Haoyuan chemexpress |
| Provider Batch ID: | HM-279_12A-20130322 |
| Salt: | 101 |
| Molecular Formula: | C22H22ClN5O2 |
| Molecular Weight: | 423.9 |
| Purity: | |
| Purification Method: | |
| Chemical Synthesis Reference: | |
| Comments: | |
| Date Publicly Available: | 2013-05-08 |
| Most Recent Update: | 2016-04-04 |
HMS QC Testing Events for HMSL10330-101-1:
| Date | HMS QC Outcome | Comment | Files |
|---|---|---|---|
| 04/13/2015 | PASS | HMSL10330-101-1_LCMS.pdf | |
| 05/13/2013 | PASS | None |
(Kd <100 nM)