BMS509744 - Small Molecule (ID:10137-101)

HMS LINCS ID: 10137-101
Name: BMS509744
Alternative Names: BMS-509744
LINCS ID: LSM-1137
PubChem CID: 11467730
ChEBI ID:
ChEMBL ID:
Molecular Mass: 623.26
InChi: InChI=1S/C32H41N5O4S2/c1-20-16-26(41-7)25(30(40)37-14-12-36(13-15-37)22(3)38)17-27(20)42-28-19-34-31(43-28)35-29(39)24-10-8-23(9-11-24)18-33-21(2)32(4,5)6/h8-11,16-17,19,21,33H,12-15,18H2,1-7H3,(H,34,35,39)
InChi Key: ZHXNIYGJAOPMSO-UHFFFAOYSA-N
SMILES: CC1=C(C=C(C(=C1)OC)C(=O)N2CCN(CC2)C(=O)C)SC3=CN=C(S3)NC(=O)C4=CC=C(C=C4)CNC(C)C(C)(C)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
1
(Kd <100 nM)
ITK
3
(equivalent to 1µM ≤ Kd < 10 µM)
BTK, FYN, INSR, LCK
10
(confirmed non-binding)
(Click to show)

Batch Information for HMSL10137-101-1:

HMS LINCS Batch ID: 10137-101-1
Provider: Haoyuan chemexpress
Provider Batch ID: HM-090B_TM-20110722
Salt: 101
Molecular Formula: C32H41N5O4S2
Molecular Weight: 623.83
Purity:
Purification Method:
Chemical Synthesis Reference:
Comments:
Date Publicly Available: 2011-07-15
Most Recent Update: 2016-04-04

HMS QC Testing Events for HMSL10137-101-1:

Date HMS QC Outcome Comment Files
04/13/2015 PASS HMSL10137-101-1_LCMS.pdf
11/14/2011 PASS None