Compound Detail
CHEMBL399694
MANZAMINE F Enter ChEMBL ID:
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O=C1CCCN2[C@@H](CC1)C[C@]13CN4CCCC/C=C\CC[C@](O)(C=C(c5nccc6c5[nH]c5c(O)cccc56)C1CC4)[C@H]23
Basic Information
| ChEMBL ID | CHEMBL399694 |
| Name | MANZAMINE F |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KYLZDBBEWRTKTG-YKHWCGIDSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
20
Publications
0
Known Names
Molecular Properties
580.8
MW (Da)
5.96
ALogP
6
HBA
3
HBD
92.7
PSA (Ų)
0.31
QED
2
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 5.14
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Human immunodeficiency virus 1 CHEMBL378 | EC50 | 5.14 | 5.14 | 7300.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Human immunodeficiency virus 1 | EC50 | = | 7300.0 | nM | 5.14 | Effective concentration against HIV-1 | 15214779 |
| Human immunodeficiency virus 1 | EC50 | = | 7300.0 | nM | 5.14 | Antiviral activity against HIV1 infected in human PBMCs | 15332848 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12828469 | 10.1021/np020592u | Plasmodium falciparum | 2 |
| 16872140 | 10.1021/np0601399 | Plasmodium falciparum | 2 |
| 16872140 | 10.1021/np0601399 | Leishmania donovani | 2 |
| 15332848 | 10.1021/np0400095 | Staphylococcus aureus | 2 |
| 16872140 | 10.1021/np0601399 | Staphylococcus aureus | 2 |
| 15332848 | 10.1021/np0400095 | Leishmania donovani | 2 |
| 15332848 | 10.1021/np0400095 | Plasmodium falciparum | 2 |
| 12828469 | 10.1021/np020592u | Leishmania donovani | 2 |
| 15214779 | 10.1021/jm030475b | Staphylococcus aureus | 2 |
| 18198837 | 10.1021/np0703702 | NON-PROTEIN TARGET | 2 |
| 18198837 | 10.1021/np0703702 | Mycobacterium tuberculosis | 2 |
| 17708655 | 10.1021/np060092r | Glycogen synthase kinase-3 beta | 2 |
| 12828469 | 10.1021/np020592u | Mycobacterium tuberculosis | 1 |
| 8946747 | 10.1021/np9604083 | L5178Y | 1 |
| 8946747 | 10.1021/np9604083 | Spodoptera littoralis | 1 |
| 12828469 | 10.1021/np020592u | Vero | 1 |
| 20017491 | 10.1021/jm900672t | Mycobacterium tuberculosis | 1 |
| 15332848 | 10.1021/np0400095 | Cryptococcus neoformans | 1 |
| 15332848 | 10.1021/np0400095 | Mycobacterium intracellulare | 1 |
| 15214779 | 10.1021/jm030475b | Mycobacterium intracellulare | 1 |
Data from ChEMBL 36 via Core Engine