Compound Detail
CHEMBL506416
MANZAMINE X Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Oc1ccc2[nH]c3c(C4=C[C@@]5(O)CC/C=C\CCCCN6CC[C@@H]4[C@@]4(C6)C[C@@]67CC[C@@H](CCCN6[C@H]45)O7)nccc3c2c1
Basic Information
| ChEMBL ID | CHEMBL506416 |
| Name | MANZAMINE X |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YFLBQKLEXJGASL-SLQIETCISA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
15
Publications
0
Known Names
Molecular Properties
580.8
MW (Da)
6.12
ALogP
6
HBA
3
HBD
84.8
PSA (Ų)
0.30
QED
2
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 5.64
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Human immunodeficiency virus 1 CHEMBL378 | EC50 | 5.64 | 5.64 | 2300.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Human immunodeficiency virus 1 | EC50 | = | 2300.0 | nM | 5.64 | Antiviral activity against HIV1 infected in human PBMCs | 15332848 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12828469 | 10.1021/np020592u | Plasmodium falciparum | 2 |
| 12828469 | 10.1021/np020592u | Leishmania donovani | 2 |
| 12828469 | 10.1021/np020592u | NON-PROTEIN TARGET | 2 |
| 15332848 | 10.1021/np0400095 | Plasmodium falciparum | 2 |
| 15332848 | 10.1021/np0400095 | Leishmania donovani | 2 |
| 15332848 | 10.1021/np0400095 | Staphylococcus aureus | 2 |
| 12828469 | 10.1021/np020592u | Mycobacterium tuberculosis | 1 |
| 12828469 | 10.1021/np020592u | Vero | 1 |
| 12828469 | 10.1021/np020592u | HT-29 | 1 |
| 12828469 | 10.1021/np020592u | ADMET | 1 |
| 15332848 | 10.1021/np0400095 | Vero | 1 |
| 15332848 | 10.1021/np0400095 | Cryptococcus neoformans | 1 |
| 15332848 | 10.1021/np0400095 | Mycobacterium intracellulare | 1 |
| 15332848 | 10.1021/np0400095 | Human immunodeficiency virus 1 | 1 |
| 15332848 | 10.1021/np0400095 | Mycobacterium tuberculosis | 1 |
Data from ChEMBL 36 via Core Engine