Compound Detail
CHEMBL2228072
6-Cl-4-Pr-D-DIBOA Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL2228072 |
| Name | 6-Cl-4-Pr-D-DIBOA |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HMODJBIEYMVWPN-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
241.7
MW (Da)
2.41
ALogP
3
HBA
0
HBD
38.8
PSA (Ų)
0.82
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.22
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Lepidium sativum CHEMBL612381 | IC50 | 7.22 | 7.22 | 60.0 | 1 |
| Allium cepa CHEMBL613790 | IC50 | 6.7 | 6.7 | 200.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Lepidium sativum | IC50 | = | 60.0 | nM | 7.22 | Phytotoxicity against Lepidium sativum assessed as growth inhibition of root len... | 20014762 |
| Allium cepa | IC50 | = | 200.0 | nM | 6.7 | Phytotoxicity against Allium cepa (onion) assessed as growth inhibition of root ... | 20014762 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20014762 | 10.1021/jf903445m | Allium cepa | 4 |
| 20014762 | 10.1021/jf903445m | Lepidium sativum | 3 |
| 20014762 | 10.1021/jf903445m | Lactuca sativa | 3 |
| 20014762 | 10.1021/jf903445m | Solanum lycopersicum | 3 |
Data from ChEMBL 36 via Core Engine