Compound Detail
CHEMBL1164136
N-METHYL NORTOPSENTIN B Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL1164136 |
| Name | N-METHYL NORTOPSENTIN B |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | TWDJYVWGSNBLOX-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
419.3
MW (Da)
5.50
ALogP
4
HBA
0
HBD
27.7
PSA (Ų)
0.37
QED
1
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.1
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| P388 CHEMBL389 | IC50 | 6.1 | 5.725 | 800.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| P388 | IC50 | = | 800.0 | nM | 6.1 | Cytotoxicity against mouse P388 cells | 20472437 |
| P388 | IC50 | = | 4500.0 | nM | 5.35 | Cytotoxicity against mouse P388 cells assessed as reduction in cell viability | 28494255 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20472437 | 10.1016/j.bmc.2010.04.061 | P388 | 1 |
| 28494255 | 10.1016/j.ejmech.2017.04.078 | P388 | 1 |
Data from ChEMBL 36 via Core Engine