FRAX597 - Small Molecule (ID:10400-101)

HMS LINCS ID: 10400-101
Name: FRAX597
Alternative Names:
LINCS ID:
PubChem CID: 70934541
ChEBI ID:
ChEMBL ID:
Molecular Mass: 557.18
InChi: InChI=1S/C29H28ClN7OS/c1-3-37-27-20(14-24(28(37)38)23-9-4-19(15-25(23)30)26-17-31-18-39-26)16-32-29(34-27)33-21-5-7-22(8-6-21)36-12-10-35(2)11-13-36/h4-9,14-18H,3,10-13H2,1-2H3,(H,32,33,34)
InChi Key: DHUJCQOUWQMVCG-UHFFFAOYSA-N
SMILES: CCN1C2=NC(=NC=C2C=C(C1=O)C3=C(C=C(C=C3)C4=CN=CS4)Cl)NC5=CC=C(C=C5)N6CCN(CC6)C
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)
PAK1, PAK2, PAK3

Batch Information for HMSL10400-101-1:

HMS LINCS Batch ID: 10400-101-1
Provider: MedChem Express
Provider Batch ID: 14162
Salt: 101
Molecular Formula: C29H28ClN7OS
Molecular Weight: 558.1
Purity:
Purification Method:
Chemical Synthesis Reference:
Comments:
Date Publicly Available: 2015-08-27
Most Recent Update: 2016-04-04

HMS QC Testing Events for HMSL10400-101-1:

Date HMS QC Outcome Comment Files
08/31/2015 PASS HMSL10400-101-1_LCMS.pdf