Compound Detail
CHEMBL5963783
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Cn1ccc(-c2cc(C(=O)Nc3cc4c(nc3-c3ccccc3)CCNC4=O)c(F)cc2C(F)(F)F)n1
Basic Information
| ChEMBL ID | CHEMBL5963783 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LDRWEKPIACIMDT-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
509.5
MW (Da)
4.85
ALogP
5
HBA
2
HBD
88.9
PSA (Ų)
0.39
QED
1
Ro5 Violations
4
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 10.16
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| High affinity nerve growth factor receptor CHEMBL2815 | IC50 | 10.16 | 10.16 | 0.1 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| High affinity nerve growth factor receptor | IC50 | = | 0.069 | nM | 10.16 | Functional Activity Assay: TrkA functional activity was measured using a Discove... | - |
Data from ChEMBL 36 via Core Engine