Compound Detail
CHEMBL2111058
SUNEPITRON 🧪 Phase II
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🧪 Phase II
Basic Information
| ChEMBL ID | CHEMBL2111058 |
| Name | SUNEPITRON |
| Phase | Phase II |
| Structure Type | MOL |
| InChI Key | UXWBIYCPUVWKHP-KBPBESRZSA-N |
2
Targets
2
Activities
1
Assay Types
1
PK Parameters
4
Publications
4
Known Names
Molecular Properties
329.4
MW (Da)
0.53
ALogP
6
HBA
0
HBD
69.6
PSA (Ų)
0.75
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Single Enantiomer |
Activity Summary
Ki 2 meas. best 7.46
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Adrenergic receptor alpha-1 CHEMBL1907610 | Ki | 7.46 | 7.46 | 35.0 | 1 |
| 5-hydroxytryptamine receptor 1A CHEMBL214 | Ki | 7.04 | 7.04 | 92.0 | 1 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| T1/2 | 2.0 | hr | Homo sapiens |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Adrenergic receptor alpha-1 | Ki | = | 35.0 | nM | 7.46 | Displacement of [3H]prazosin from adrenergic alpha-1 receptor in rat cerebral co... | 16722631 |
| 5-hydroxytryptamine receptor 1A | Ki | = | 92.0 | nM | 7.04 | Displacement of [3H]8-OH-DPAT from human 5HT1A receptor in HEK293 cells | 16722631 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16722631 | 10.1021/jm0508641 | 5-hydroxytryptamine receptor 1A | 1 |
| 16722631 | 10.1021/jm0508641 | Adrenergic receptor alpha-1 | 1 |
| 16722631 | 10.1021/jm0508641 | Unchecked | 1 |
| 16722631 | 10.1021/jm0508641 | Homo sapiens | 1 |
Data from ChEMBL 36 via Core Engine