Compound Detail
CHEMBL109317
GITOXIN Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL109317 |
| Name | GITOXIN |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LKRDZKPBAOKJBT-CNPIRKNPSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
9
Publications
0
Known Names
Molecular Properties
781.0
MW (Da)
2.22
ALogP
14
HBA
6
HBD
203.1
PSA (Ų)
0.16
QED
3
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 6.88
Target Activity Profile
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| TK-10 | IC50 | = | 131.2 | nM | 6.88 | Cytotoxicity against human TK10 cells after 48 hrs by SRB assay | 16309315 |
| MCF7 | IC50 | = | 251.9 | nM | 6.6 | Cytotoxicity against human MCF7 cells after 48 hrs by SRB assay | 16309315 |
| UACC-62 | IC50 | = | 369.4 | nM | 6.43 | Cytotoxicity against human UACC62 cells after 48 hrs by SRB assay | 16309315 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12109909 | 10.1021/jm0102811 | Monoclonal antibody (mAb) | 5 |
| - | 10.6019/CHEMBL4651402 | SARS-CoV-2 | 2 |
| 2089119 | 10.1021/np50072a015 | Unchecked | 1 |
| 16309315 | 10.1021/np050226l | TK-10 | 1 |
| 16309315 | 10.1021/np050226l | MCF7 | 1 |
| 16309315 | 10.1021/np050226l | UACC-62 | 1 |
| 8254345 | 10.1021/np50099a003 | Saccharomyces cerevisiae | 1 |
| 23571415 | 10.1124/mol.112.084152 | Solute carrier organic anion transporter family member 1B1 | 1 |
| 23571415 | 10.1124/mol.112.084152 | Solute carrier organic anion transporter family member 1B3 | 1 |
Data from ChEMBL 36 via Core Engine