CP724714 - Small Molecule (ID:10010-101)

HMS LINCS ID: 10010-101
Name: CP724714
Alternative Names:
LINCS ID: LSM-42777
PubChem CID: 53401057
ChEBI ID:
ChEMBL ID:
Molecular Mass: 469.21
InChi: InChI=1S/C27H27N5O3/c1-18-13-21(8-11-25(18)35-22-9-6-19(2)29-15-22)32-27-23-14-20(7-10-24(23)30-17-31-27)5-4-12-28-26(33)16-34-3/h4-11,13-15,17H,12,16H2,1-3H3,(H,28,33)(H,30,31,32)
InChi Key: LLVZBTWPGQVVLW-UHFFFAOYSA-N
SMILES: CC1=NC=C(C=C1)OC2=C(C=C(C=C2)NC3=NC=NC4=C3C=C(C=C4)C=CCNC(=O)COC)C
Relevant Citations:
Comments:
Date Publicly Available:
Most Recent Update: 2018-03-30

Target Affinity:

(see Study 20000)
Target Affinity Spectrum Value HUGO Gene Name
1
(Kd <100 nM)
ERBB2
2
(equivalent to 100 nM ≤ Kd < 1µM)
EGFR, MKNK2, Tuba1a
3
(equivalent to 1µM ≤ Kd < 10 µM)
CDK19, CDK8
10
(confirmed non-binding)
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Batch Information for HMSL10010-101-2:

HMS LINCS Batch ID: 10010-101-2
Provider: Haoyuan chemexpress
Provider Batch ID: HY-14674_1-20110708
Salt: 101
Molecular Formula: C27H27N5O3
Molecular Weight: 469.54
Purity:
Purification Method:
Chemical Synthesis Reference:
Comments:
Date Publicly Available: 2013-05-06
Most Recent Update: 2016-08-02

HMS QC Testing Events for HMSL10010-101-2:

Date HMS QC Outcome Comment Files
03/13/2015 PASS HMSL10010-101-2_LCMS.pdf