Compound Detail
CHEMBL113028
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Basic Information
| ChEMBL ID | CHEMBL113028 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PJANXHGTPQOBST-VAWYXSNFSA-N |
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
14
Publications
0
Known Names
Molecular Properties
180.2
MW (Da)
3.86
ALogP
0
HBA
0
HBD
0.0
PSA (Ų)
0.62
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 23867387 | 10.1016/j.bmc.2013.06.048 | NON-PROTEIN TARGET | 5 |
| 10714491 | 10.1016/s0960-894x(99)00702-7 | Mus musculus | 2 |
| 8254344 | 10.1021/np50099a002 | Bacillus subtilis | 2 |
| 8254344 | 10.1021/np50099a002 | Candida albicans | 2 |
| 8254344 | 10.1021/np50099a002 | Trichophyton mentagrophytes | 2 |
| 8254344 | 10.1021/np50099a002 | Amorphotheca resinae | 2 |
| 8254344 | 10.1021/np50099a002 | Escherichia coli | 1 |
| 21215623 | 10.1016/j.bmcl.2010.12.029 | NON-PROTEIN TARGET | 1 |
| 21215623 | 10.1016/j.bmcl.2010.12.029 | NAD(P)H dehydrogenase [quinone] 1 | 1 |
| 24135726 | 10.1016/j.bmcl.2013.09.073 | Radical scavenging activity | 1 |
| 24135726 | 10.1016/j.bmcl.2013.09.073 | PC-12 | 1 |
| 24135726 | 10.1016/j.bmcl.2013.09.073 | ADMET | 1 |
| 24462176 | 10.1016/j.bmc.2014.01.008 | Unchecked | 1 |
| 25666820 | 10.1016/j.bmcl.2015.01.027 | NON-PROTEIN TARGET | 1 |
Data from ChEMBL 36 via Core Engine