Compound Detail
CHEMBL253907
TIGLOYLGOMISIN P 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
C/C=C(\C)C(=O)O[C@@H]1c2cc(OC)c(OC)c(OC)c2-c2c(cc3c(c2OC)OCO3)C[C@H](C)[C@@]1(C)O
Basic Information
| ChEMBL ID | CHEMBL253907 |
| Name | TIGLOYLGOMISIN P |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BKGUPIVDQHHVMV-TWJXSMCESA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
514.6
MW (Da)
4.61
ALogP
9
HBA
1
HBD
101.9
PSA (Ų)
0.44
QED
1
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 4.43
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Human immunodeficiency virus 1 CHEMBL378 | EC50 | 4.43 | 4.43 | 37000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Human immunodeficiency virus 1 | EC50 | = | 37000.0 | nM | 4.43 | Antiviral activity against HIV1 3B in H9 cells after 4 days by p24-antigen ELISA | 17190445 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17190445 | 10.1021/np060239e | Human immunodeficiency virus 1 | 1 |
| 17190445 | 10.1021/np060239e | H9 | 1 |
| 17190445 | 10.1021/np060239e | ADMET | 1 |
| 25302569 | 10.1021/np500521v | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine