ALW-II-49-7 - Small Molecule (ID:10003-101)

HMS LINCS ID: 10003-101
Name: ALW-II-49-7
Alternative Names:
LINCS ID: LSM-1003
PubChem CID: 24875320
ChEBI ID:
ChEMBL ID:
Molecular Mass: 414.13
InChi: InChI=1S/C21H17F3N4O2/c1-12-5-6-13(8-18(12)27-17-7-14(19(25)29)10-26-11-17)20(30)28-16-4-2-3-15(9-16)21(22,23)24/h2-11,27H,1H3,(H2,25,29)(H,28,30)
InChi Key: SAAYRHKJHDIDPH-UHFFFAOYSA-N
SMILES: CC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)C(F)(F)F)NC3=CN=CC(=C3)C(=O)N
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)
EPHB2
2
(equivalent to 100 nM ≤ Kd < 1µM)
DDR1, DDR2, EPHA2, EPHA3, EPHA4, EPHA5, EPHA8, EPHB3, EPHB4, KIT, PDGFRA, PDGFRB
10
(confirmed non-binding)
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Batch Information for HMSL10003-101-1:

HMS LINCS Batch ID: 10003-101-1
Provider: Nathanael Gray (DFCI)
Provider Batch ID: ALW-II-49-7-1
Salt: 101
Molecular Formula: C21H17F3N4O2
Molecular Weight: 414.38
Purity:
Purification Method:
Chemical Synthesis Reference:
Comments:
Date Publicly Available: 2011-07-15
Most Recent Update: 2016-04-04

HMS QC Testing Events for HMSL10003-101-1:

Date HMS QC Outcome Comment Files
03/13/2015 PASS HMSL10003-101-1_LCMS.pdf