Compound Detail
CHEMBL155434
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N#CN/C(=N/c1ccc2c(c1)COCO2)N1CCC(=C2c3ccc(Cl)cc3CCc3cc(Br)cnc32)CC1
Basic Information
| ChEMBL ID | CHEMBL155434 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZXRLFIJLBNQELO-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
590.9
MW (Da)
6.12
ALogP
5
HBA
1
HBD
82.8
PSA (Ų)
0.16
QED
2
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.82
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Protein farnesyltransferase CHEMBL2094108 | IC50 | 7.82 | 7.82 | 15.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Protein farnesyltransferase | IC50 | = | 15.0 | nM | 7.82 | FPT inhibitory activity was determined by the ability to inhibit the transfer of... | 11844681 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11844681 | 10.1016/s0960-894x(01)00826-5 | Protein farnesyltransferase | 1 |
Data from ChEMBL 36 via Core Engine