Compound Detail
CHEMBL3655750
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CO[C@@H]1C[C@@H](C(=O)Nc2ccc(F)nc2)N(c2nc(Nc3cc(C4CC4)n[nH]3)c3cccn3n2)C1
Basic Information
| ChEMBL ID | CHEMBL3655750 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ACLODPCFVODCAE-QAPCUYQASA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
477.5
MW (Da)
2.84
ALogP
9
HBA
3
HBD
125.4
PSA (Ų)
0.35
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 9.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Insulin-like growth factor 1 receptor CHEMBL1957 | IC50 | 9.0 | 9.0 | 1.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Insulin-like growth factor 1 receptor | IC50 | = | 1.0 | nM | 9.0 | Tyrosine Kinase Assay: Kinase assay using IGF1-receptor. | - |
Data from ChEMBL 36 via Core Engine