Compound Detail
CHEMBL67370
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CCN(CC)CCN(C)Cc1c(-c2ccc(OC)cc2)nc2n(Cc3ccccc3F)c(C)c(-c3ccc4c(c3)OCO4)c(=O)n12
Basic Information
| ChEMBL ID | CHEMBL67370 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BZAQMPAUHHKIFU-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
625.8
MW (Da)
5.84
ALogP
9
HBA
0
HBD
73.5
PSA (Ų)
0.17
QED
2
Ro5 Violations
12
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 6.89
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Gonadotropin-releasing hormone receptor CHEMBL1855 | Ki | 6.89 | 6.89 | 130.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Gonadotropin-releasing hormone receptor | Ki | = | 130.0 | nM | 6.89 | Binding evaluated in cloned human Gonadotropin-releasing hormone receptor by dis... | 12127533 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12127533 | 10.1016/s0960-894x(02)00371-2 | Gonadotropin-releasing hormone receptor | 1 |
Data from ChEMBL 36 via Core Engine