Dabrafenib - Small Molecule (ID:10284-101)

HMS LINCS ID: 10284-101
Name: Dabrafenib
Alternative Names: GSK2118436
LINCS ID: LSM-6303
PubChem CID: 44462760
ChEBI ID:
ChEMBL ID:
Molecular Mass: 519.10
InChi: InChI=1S/C23H20F3N5O2S2/c1-23(2,3)21-30-18(19(34-21)16-10-11-28-22(27)29-16)12-6-4-9-15(17(12)26)31-35(32,33)20-13(24)7-5-8-14(20)25/h4-11,31H,1-3H3,(H2,27,28,29)
InChi Key: BFSMGDJOXZAERB-UHFFFAOYSA-N
SMILES: CC(C)(C)C1=NC(=C(S1)C2=NC(=NC=C2)N)C3=C(C(=CC=C3)NS(=O)(=O)C4=C(C=CC=C4F)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
1
(Kd <100 nM)
ARAF, BRAF
2
(equivalent to 100 nM ≤ Kd < 1µM)
BMPR1B, CDK16, CDK17, CDK18, COQ8A, COQ8B, CSK, LIMK2, PF3D7_0217500, PIK3C2B, PLK4, RAF1, SRMS, TESK1, TGFBR1
10
(confirmed non-binding)
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Batch Information for HMSL10284-101-1:

HMS LINCS Batch ID: 10284-101-1
Provider: Haoyuan chemexpress
Provider Batch ID: HY-14660-20120629
Salt: 101
Molecular Formula: C23H20F3N5O2S2
Molecular Weight: 519.56
Purity:
Purification Method:
Chemical Synthesis Reference:
Comments:
Date Publicly Available: 2013-02-08
Most Recent Update: 2016-04-04

HMS QC Testing Events for HMSL10284-101-1:

Date HMS QC Outcome Comment Files
04/13/2015 PASS HMSL10284-101-1_LCMS.pdf