Compound Detail
CHEMBL6002866
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CN(C)CCOc1ccc(Cn2c(=O)[nH]c3c(N)nc(-c4nc(C5CC5)c[nH]4)nc32)cn1
Basic Information
| ChEMBL ID | CHEMBL6002866 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VSFPFXHMYPOJKU-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
435.5
MW (Da)
1.35
ALogP
9
HBA
3
HBD
143.6
PSA (Ų)
0.38
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 7.3
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Hepatitis C virus NS5B RNA-dependent RNA polymerase CHEMBL5375 | EC50 | 7.3 | 7.3 | 50.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Hepatitis C virus NS5B RNA-dependent RNA polymerase | EC50 | = | 50.0 | nM | 7.3 | Measurement of Interferon Production in Human PBMC: Activation of human TLR7 res... | - |
Data from ChEMBL 36 via Core Engine