Compound Detail
CHEMBL175296
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Basic Information
| ChEMBL ID | CHEMBL175296 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PYSJLPAOBIGQPK-UHFFFAOYSA-N |
0
Targets
2
Activities
1
Assay Types
0
PK Parameters
16
Publications
0
Known Names
Molecular Properties
176.2
MW (Da)
2.39
ALogP
3
HBA
1
HBD
38.9
PSA (Ų)
0.72
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas.
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 25559643 | 10.1021/jm501402x | Unchecked | 5 |
| 28437106 | 10.1021/acs.jmedchem.7b00147 | Ubiquitin-conjugating enzyme E2 T | 4 |
| 23526571 | 10.1021/ml300322n | MDA-MB-231 | 2 |
| - | 10.6019/CHEMBL3301361 | No relevant target | 2 |
| 25559643 | 10.1021/jm501402x | SPRY domain-containing SOCS box protein 2 | 2 |
| 10230619 | 10.1016/s0960-894x(99)00122-5 | Unchecked | 1 |
| 19419876 | 10.1016/j.bmc.2009.04.030 | Fructose-1,6-bisphosphatase 1 | 1 |
| 20055453 | 10.1021/jm9014718 | Indoleamine 2,3-dioxygenase 1 | 1 |
| 23000296 | 10.1016/j.bmc.2012.08.040 | Unchecked | 1 |
| 23992862 | 10.1016/j.bmcl.2013.07.067 | L6 | 1 |
| 24835815 | 10.1016/j.ejmech.2014.04.042 | Histone acetyltransferase KAT2B | 1 |
| 24835815 | 10.1016/j.ejmech.2014.04.042 | Histone acetyltransferase p300 | 1 |
| 25559643 | 10.1021/jm501402x | Apical membrane antigen 1 | 1 |
| 25559643 | 10.1021/jm501402x | Carbonic anhydrase 2 | 1 |
| 28437106 | 10.1021/acs.jmedchem.7b00147 | Ubiquitin-conjugating enzyme E2 D3 | 1 |
| 28651980 | 10.1016/j.bmcl.2016.06.052 | Indoleamine 2,3-dioxygenase 1 | 1 |
Data from ChEMBL 36 via Core Engine