Compound Detail
CHEMBL1169490
4'-THIO-2'-DEOXYCYTIDINE Phase I
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Phase I
Basic Information
| ChEMBL ID | CHEMBL1169490 |
| Name | 4'-THIO-2'-DEOXYCYTIDINE |
| Phase | Phase I |
| Structure Type | MOL |
| InChI Key | MOMUJZRKXYLWMH-SHYZEUOFSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
5
Known Names
1
Indications
Molecular Properties
243.3
MW (Da)
-0.82
ALogP
7
HBA
3
HBD
101.4
PSA (Ų)
0.63
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Single Enantiomer |
Indications
Neoplasms
Activity Summary
IC50 1 meas. best 5.92
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| L1210 CHEMBL386 | IC50 | 5.92 | 5.92 | 1200.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| L1210 | IC50 | = | 1200.0 | nM | 5.92 | The concentration required to produce a 50% reduction in the rate of cell prolif... | 1652015 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19029322 | 10.1128/aac.01257-08 | Vaccinia virus | 3 |
| 1652015 | 10.1021/jm00112a007 | L1210 | 1 |
| 1652015 | 10.1021/jm00112a007 | HEp-2 | 1 |
| 19029322 | 10.1128/aac.01257-08 | Cowpox virus | 1 |
Data from ChEMBL 36 via Core Engine