Compound Detail
CHEMBL430558
TAXEZOPIDINE H Enter ChEMBL ID:
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C=C1[C@@H](OC(=O)/C=C/c2ccccc2)C[C@H](OC(C)=O)[C@]2(C)[C@@H]1C[C@@H]1C[C@H](O)C(C)=C([C@@H](OC(C)=O)[C@@H]2OC(C)=O)C1(C)C
Basic Information
| ChEMBL ID | CHEMBL430558 |
| Name | TAXEZOPIDINE H |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SOSLCGUOOOQMEN-HNCSRTHDSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
608.7
MW (Da)
5.12
ALogP
9
HBA
1
HBD
125.4
PSA (Ų)
0.20
QED
2
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.82
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 4.82 | 4.82 | 15000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 15000.0 | nM | 4.82 | Inhibition of Saccharomyces cerevisiae alpha-glucosidase using p-nitrophenyl-alp... | 28240909 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 9873389 | 10.1016/s0960-894x(98)00262-5 | Unchecked | 2 |
| 9873389 | 10.1016/s0960-894x(98)00262-5 | L1210 | 1 |
| 9873389 | 10.1016/s0960-894x(98)00262-5 | NON-PROTEIN TARGET | 1 |
| 14987066 | 10.1021/np030346y | Unchecked | 1 |
| 28240909 | 10.1021/acs.jnatprod.7b00006 | Unchecked | 1 |
| 28240909 | 10.1021/acs.jnatprod.7b00006 | HeLa | 1 |
Data from ChEMBL 36 via Core Engine