MPS-1-IN-1 - Small Molecule (ID:10105-101)

HMS LINCS ID: 10105-101
Name: MPS-1-IN-1
Alternative Names: HG-5-125-01
LINCS ID: LSM-1105
PubChem CID: 25195352
ChEBI ID:
ChEMBL ID:
Molecular Mass: 535.23
InChi: InChI=1S/C28H33N5O4S/c1-18(2)38(35,36)26-7-5-4-6-23(26)30-24-17-27(32-28-21(24)10-13-29-28)31-22-9-8-19(16-25(22)37-3)33-14-11-20(34)12-15-33/h4-10,13,16-18,20,34H,11-12,14-15H2,1-3H3,(H3,29,30,31,32)
InChi Key: NMJMRSQTDLRCRQ-UHFFFAOYSA-N
SMILES: CC(C)S(=O)(=O)C1=CC=CC=C1NC2=CC(=NC3=C2C=CN3)NC4=C(C=C(C=C4)N5CCC(CC5)O)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
2
(equivalent to 100 nM ≤ Kd < 1µM)
IGF1R, INSR, PTK2, PTK2B, RIOK3, TTK
10
(confirmed non-binding)
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Batch Information for HMSL10105-101-1:

HMS LINCS Batch ID: 10105-101-1
Provider: Nathanael Gray (DFCI)
Provider Batch ID: synthesized 8/10/2008
Salt: 101
Molecular Formula: C28H33N5O4S
Molecular Weight: 535.66
Purity:
Purification Method:
Chemical Synthesis Reference:
Comments:
Date Publicly Available: 2011-07-15
Most Recent Update: 2016-04-04