Compound Detail
CHEMBL1202823
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Basic Information
| ChEMBL ID | CHEMBL1202823 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GEPOOMWRNDKKFC-UHFFFAOYSA-N |
| Parent Compound | CHEMBL74296 |
| Active Moiety | CHEMBL74296 |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
381.5
MW (Da)
4.46
ALogP
6
HBA
0
HBD
55.5
PSA (Ų)
0.43
QED
0
Ro5 Violations
12
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.22
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Voltage-dependent L-type calcium channel subunit alpha-1C CHEMBL2830 | IC50 | 6.22 | 6.22 | 600.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Voltage-dependent L-type calcium channel subunit alpha-1C | IC50 | = | 600.0 | nM | 6.22 | Inhibition of [3H]nitrendipine binding to calcium channels in Rabbit cardiac mus... | 3184128 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 3184128 | 10.1021/jm00119a026 | Voltage-dependent L-type calcium channel subunit alpha-1C | 1 |
| 3184128 | 10.1021/jm00119a026 | Canis familiaris | 1 |
| 3184128 | 10.1021/jm00119a026 | Mus musculus | 1 |
Data from ChEMBL 36 via Core Engine