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 |
|---|---|
IGF1R, INSR, PTK2, PTK2B, RIOK3, TTK | |
10 (confirmed non-binding) |
Batch Information for HMSL10105-101-2:
| HMS LINCS Batch ID: | 10105-101-2 |
| Provider: | Nathanael Gray (DFCI) |
| Provider Batch ID: | synthesized 2/22/2012 |
| Salt: | 101 |
| Molecular Formula: | C28H33N5O4S |
| Molecular Weight: | 535.66 |
| Purity: | |
| Purification Method: | |
| Chemical Synthesis Reference: | |
| Comments: | |
| Date Publicly Available: | 2012-03-26 |
| Most Recent Update: | 2016-04-04 |
(equivalent to 100 nM ≤ Kd < 1µM)