Compound Detail
CHEMBL513723
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
O=c1cc(-c2ccccc2)oc2c([N+](=O)[O-])c(O)c([N+](=O)[O-])c(O)c12
Basic Information
| ChEMBL ID | CHEMBL513723 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XIKHZTGDTFLXMY-UHFFFAOYSA-N |
0
Targets
2
Activities
2
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
344.2
MW (Da)
2.69
ALogP
8
HBA
2
HBD
156.9
PSA (Ų)
0.54
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas.
IC50 1 meas.
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 8158164 | 10.1021/np50103a006 | H9 | 1 |
| 8158164 | 10.1021/np50103a006 | Human immunodeficiency virus 1 | 1 |
| 8158164 | 10.1021/np50103a006 | ADMET | 1 |
Data from ChEMBL 36 via Core Engine