WZ4002 - Small Molecule (ID:10085-101)

HMS LINCS ID: 10085-101
Name: WZ4002
Alternative Names:
LINCS ID: LSM-1085
PubChem CID: 44607530
ChEBI ID:
ChEMBL ID:
Molecular Mass: 494.18
InChi: InChI=1S/C25H27ClN6O3/c1-4-23(33)28-17-6-5-7-19(14-17)35-24-20(26)16-27-25(30-24)29-21-9-8-18(15-22(21)34-3)32-12-10-31(2)11-13-32/h4-9,14-16H,1,10-13H2,2-3H3,(H,28,33)(H,27,29,30)
InChi Key: ITTRLTNMFYIYPA-UHFFFAOYSA-N
SMILES: CN1CCN(CC1)C2=CC(=C(C=C2)NC3=NC=C(C(=N3)OC4=CC=CC(=C4)NC(=O)C=C)Cl)OC
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)
EGFR, ERBB2, ERBB3, ERBB4
2
(equivalent to 100 nM ≤ Kd < 1µM)
BTK, JAK3, PTK2
10
(confirmed non-binding)
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Batch Information for HMSL10085-101-1:

HMS LINCS Batch ID: 10085-101-1
Provider: Nathanael Gray (DFCI)
Provider Batch ID: WZ4002-1
Salt: 101
Molecular Formula: C25H27ClN6O3
Molecular Weight: 494.97
Purity:
Purification Method:
Chemical Synthesis Reference:
Comments:
Date Publicly Available: 2011-07-15
Most Recent Update: 2016-04-04

HMS QC Testing Events for HMSL10085-101-1:

Date HMS QC Outcome Comment Files
11/24/2015 PASS HMSL10085-101-1_LCMS.pdf