Compound Detail
CHEMBL539507
CLORGYLINE HYDROCHLORIDE Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL539507 |
| Name | CLORGYLINE HYDROCHLORIDE |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BBAZDLONIUABKI-UHFFFAOYSA-N |
| Parent Compound | CHEMBL8706 |
| Active Moiety | CHEMBL8706 |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
272.2
MW (Da)
3.33
ALogP
2
HBA
0
HBD
12.5
PSA (Ų)
0.58
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 4.9
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | IC50 | 4.9 | 4.9 | 12589.2 | 1 |
| Monoamine oxidase CHEMBL2095196 | IC50 | 4.3 | 4.3 | 50000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium falciparum | IC50 | = | 12589.25 | nM | 4.9 | Antiplasmodial activity against Plasmodium falciparum 7G8 after 72 hrs by SYBR g... | 19734910 |
| Monoamine oxidase | IC50 | = | 50000.0 | nM | 4.3 | Inhibitory activity against rat brain mitochondrial Monoamine oxidase | 3968682 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 3968682 | 10.1021/jm00380a007 | Monoamine oxidase | 2 |
| 17417631 | 10.1038/nchembio873 | Unchecked | 1 |
| 19734910 | 10.1038/nchembio.215 | Plasmodium falciparum | 1 |
| 28051303 | 10.1021/acs.jmedchem.6b01203 | Candida albicans | 1 |
| - | 10.1101/2020.04.03.023846 | SARS-CoV-2 | 1 |
Data from ChEMBL 36 via Core Engine