CP724714 - Small Molecule (ID:10010-101)
HMS LINCS ID: |
10010-101
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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 |
---|---|
ERBB2 | |
2 (equivalent to 100 nM ≤ Kd < 1µM) | EGFR, MKNK2, Tuba1a |
3 (equivalent to 1µM ≤ Kd < 10 µM) | CDK19, CDK8 |
10 (confirmed non-binding) |
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 |
(Kd <100 nM)