Compound Detail
CHEMBL195491
DEHYDROILLUDIN M 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
Basic Information
| ChEMBL ID | CHEMBL195491 |
| Name | DEHYDROILLUDIN M |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PFURRCFDDZMGLA-AWEZNQCLSA-N |
5
Targets
5
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
246.3
MW (Da)
1.95
ALogP
3
HBA
1
HBD
54.4
PSA (Ų)
0.71
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 5 meas. best 6.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| A549 CHEMBL392 | IC50 | 6.7 | 6.7 | 200.0 | 1 |
| HL-60 CHEMBL383 | IC50 | 6.53 | 6.53 | 296.0 | 1 |
| SW480 CHEMBL612544 | IC50 | 6.52 | 6.52 | 300.0 | 1 |
| MDA-MB-231 CHEMBL400 | IC50 | 6.35 | 6.35 | 450.0 | 1 |
| A-375 CHEMBL613859 | IC50 | 6.26 | 6.26 | 550.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| A549 | IC50 | = | 200.0 | nM | 6.7 | In vitro antitumor activity against A549 (lung) human tumor cell lines. | - |
| HL-60 | IC50 | = | 296.0 | nM | 6.53 | Cytotoxicity against human HL60 cells after 48 hrs by trypan blue exclusion meth... | 8864242 |
| SW480 | IC50 | = | 300.0 | nM | 6.52 | In vitro antitumor activity against SW480 (colon) human tumor cell lines. | - |
| MDA-MB-231 | IC50 | = | 450.0 | nM | 6.35 | In vitro antitumor activity against MB231 (breast) human tumor cell lines. | - |
| A-375 | IC50 | = | 550.0 | nM | 6.26 | In vitro antitumor activity against A375 (melanoma) human tumor cell lines. | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/0960-894X(96)00167-9 | A-375 | 1 |
| - | 10.1016/0960-894X(96)00167-9 | A549 | 1 |
| - | 10.1016/0960-894X(96)00167-9 | MDA-MB-231 | 1 |
| - | 10.1016/0960-894X(96)00167-9 | SW480 | 1 |
| 9051915 | 10.1021/np960596x | NON-PROTEIN TARGET | 1 |
| 8864242 | 10.1021/np960450y | HL-60 | 1 |
Data from ChEMBL 36 via Core Engine