Compound Detail
CHEMBL2425363
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Cc1cc[n+](CCC(=O)Nc2ccc3nc4ccc(NC(=O)CC[n+]5ccc(C)cc5)cc4cc3c2)cc1
Basic Information
| ChEMBL ID | CHEMBL2425363 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GXABKJAVKCXMHV-UHFFFAOYSA-P |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
505.6
MW (Da)
4.64
ALogP
3
HBA
2
HBD
78.8
PSA (Ų)
0.24
QED
1
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.89
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Telomerase reverse transcriptase CHEMBL2916 | IC50 | 5.89 | 5.89 | 1300.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Telomerase reverse transcriptase | IC50 | = | 1300.0 | nM | 5.89 | Inhibition of telomerase (unknown origin) by TRAP assay | 23974014 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 23974014 | 10.1016/j.ejmech.2013.07.022 | Telomerase reverse transcriptase | 1 |
Data from ChEMBL 36 via Core Engine