Compound Detail
CHEMBL15585
BRL-20627 Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL15585 |
| Name | BRL-20627 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IDNZRSXQOGDYGG-UHFFFAOYSA-N |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
10
Publications
0
Known Names
Molecular Properties
351.9
MW (Da)
3.07
ALogP
4
HBA
2
HBD
67.6
PSA (Ų)
0.82
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 3 meas. best 7.14
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 4 CHEMBL1875 | EC50 | 7.14 | 6.6633 | 72.4 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 4 | EC50 | = | 72.44 | nM | 7.14 | Tested for 5-hydroxytryptamine 4 binding affinity against cisapride | 12540230 |
| 5-hydroxytryptamine receptor 4 | EC50 | = | 125.89 | nM | 6.9 | Tested for 5-hydroxytryptamine 4 binding affinity against renzapride | 12540230 |
| 5-hydroxytryptamine receptor 4 | EC50 | = | 1122.02 | nM | 5.95 | Tested for 5-hydroxytryptamine 4 binding affinity against zacopride | 12540230 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 4068007 | 10.1021/jm00150a015 | Rattus norvegicus | 8 |
| - | 10.1016/S0960-894X(00)80636-8 | Rattus norvegicus | 3 |
| 12540230 | 10.1021/jm020099f | 5-hydroxytryptamine receptor 4 | 3 |
| - | 10.1016/S0960-894X(00)80636-8 | Mus musculus | 2 |
| - | 10.1016/S0960-894X(00)80636-8 | Unchecked | 2 |
| - | 10.1016/S0960-894X(00)80233-4 | Rattus norvegicus | 1 |
| - | 10.1016/S0960-894X(00)80233-4 | Dopamine receptor | 1 |
| - | 10.1016/S0960-894X(00)80233-4 | Unchecked | 1 |
| - | 10.1016/S0960-894X(01)81190-2 | Rattus norvegicus | 1 |
| - | 10.1016/S0960-894X(01)81190-2 | No relevant target | 1 |
Data from ChEMBL 36 via Core Engine