Compound Detail
CHEMBL23731
AMIDATE Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL23731 |
| Name | AMIDATE |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NPUKDXXFDDZOKR-UHFFFAOYSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
244.3
MW (Da)
2.67
ALogP
4
HBA
0
HBD
44.1
PSA (Ų)
0.78
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 10.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cytochrome P450 11B2, mitochondrial CHEMBL2722 | IC50 | 10.0 | 10.0 | 0.1 | 2 |
| Cytochrome P450 11B1, mitochondrial CHEMBL1908 | IC50 | 9.3 | 9.3 | 0.5 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cytochrome P450 11B2, mitochondrial | IC50 | = | 0.1 | nM | 10.0 | Cellular Inhibition Assay: V79MZ cells expressing human CYP11B1 and human CYP11B... | - |
| Cytochrome P450 11B2, mitochondrial | IC50 | = | 0.1 | nM | 10.0 | Cellular Inhibition Assay: V79MZ cells expressing human CYP11B1 and human CYP11B... | - |
| Cytochrome P450 11B1, mitochondrial | IC50 | = | 0.5 | nM | 9.3 | Cellular Inhibition Assay: V79MZ cells expressing human CYP11B1 and human CYP11B... | - |
Data from ChEMBL 36 via Core Engine