Compound Detail
CHEMBL578532
6-METHOXYMANZAMINE A Enter ChEMBL ID:
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COc1ccc2[nH]c3c(C4=C[C@@]5(O)CC/C=C\CCCCN6CC[C@@H]4[C@]4(C[C@@H]7/C=C\CCCCN7[C@H]45)C6)nccc3c2c1
Basic Information
| ChEMBL ID | CHEMBL578532 |
| Name | 6-METHOXYMANZAMINE A |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FNRVMLFYIIGIFD-URZPCCFDSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
8
Publications
0
Known Names
Molecular Properties
578.8
MW (Da)
6.86
ALogP
5
HBA
2
HBD
64.6
PSA (Ų)
0.33
QED
2
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| NON-PROTEIN TARGET CHEMBL3879801 | IC50 | 7.0 | 6.98 | 100.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| NON-PROTEIN TARGET | IC50 | = | 100.0 | nM | 7.0 | Antineuroinflammatory activity in LPS-stimulated rat neonatal microglia assessed... | 20017491 |
| NON-PROTEIN TARGET | IC50 | = | 110.0 | nM | 6.96 | Antineuroinflammatory activity in LPS-stimulated rat neonatal microglia assessed... | 20017491 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20017491 | 10.1021/jm900672t | NON-PROTEIN TARGET | 3 |
| 20017491 | 10.1021/jm900672t | Plasmodium falciparum | 2 |
| 34058709 | 10.1016/j.ejmech.2021.113536 | Plasmodium falciparum | 2 |
| 20017491 | 10.1021/jm900672t | Mycobacterium intracellulare | 1 |
| 20017491 | 10.1021/jm900672t | Cryptococcus neoformans | 1 |
| 20017491 | 10.1021/jm900672t | Candida albicans | 1 |
| 20017491 | 10.1021/jm900672t | Mycobacterium tuberculosis | 1 |
| 20017491 | 10.1021/jm900672t | Vero | 1 |
Data from ChEMBL 36 via Core Engine