HG-6-64-01 - Small Molecule (ID:10017-101)

HMS LINCS ID: 10017-101
Name: HG-6-64-01
Alternative Names: KIN001-206
LINCS ID: LSM-43248
PubChem CID:
ChEBI ID:
ChEMBL ID:
Molecular Mass: 577.27
InChi: InChI=1S/C32H34F3N5O2/c1-4-39-13-15-40(16-14-39)20-25-9-10-26(18-28(25)32(33,34)35)38-31(41)23-6-5-21(2)22(17-23)7-8-24-19-37-30-27(11-12-36-30)29(24)42-3/h5-12,17-19H,4,13-16,20H2,1-3H3,(H,36,37)(H,38,41)/b8-7+
InChi Key: UMBFDGUGXMOMHX-BQYQJAHWSA-N
SMILES: CC1=CC=C(C(NC2=CC=C(CN3CCN(CC)CC3)C(C(F)(F)F)=C2)=O)C=C1/C=C/C4=C(OC)C5=C(NC=C5)N=C4
Relevant Citations:
Comments:
Date Publicly Available:
Most Recent Update: 2018-03-30

Target Affinity:

(see Study 20000)
Target Affinity Spectrum Value HUGO Gene Name
2
(equivalent to 100 nM ≤ Kd < 1µM)
ABL1, ABL2, CHUK, CIT, CSF1R, EPHA4, EPHA6, EPHB2, ERBB2, ERBB4, FGFR1, LYN, MAP4K1, MAP4K2, MAPK11, MAPK14, MAPK9, MUSK, PDGFRB, RET, STK10, TAOK3, TEK
10
(confirmed non-binding)
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Batch Information for HMSL10017-101-2:

HMS LINCS Batch ID: 10017-101-2
Provider: Nathanael Gray (DFCI)
Provider Batch ID: 20120203
Salt: 101
Molecular Formula: C32H34F3N5O2
Molecular Weight: 577.64
Purity:
Purification Method:
Chemical Synthesis Reference:
Comments:
Date Publicly Available: 2012-03-26
Most Recent Update: 2016-04-04

HMS QC Testing Events for HMSL10017-101-2:

Date HMS QC Outcome Comment Files
03/13/2015 PASS HMSL10017-101-2_LCMS.pdf