Compound Detail
CHEMBL5570258
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Basic Information
| ChEMBL ID | CHEMBL5570258 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZCBFONOVFGSZJN-UHFFFAOYSA-N |
| Parent Compound | CHEMBL6070187 |
| Active Moiety | CHEMBL6070187 |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
275.3
MW (Da)
2.24
ALogP
4
HBA
1
HBD
53.7
PSA (Ų)
0.79
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 6.41
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 2A CHEMBL224 | Ki | 6.41 | 6.41 | 387.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 2A | Ki | = | 387.0 | nM | 6.41 | Displacement of [3H]LSD from human 5-HT2A receptor expressed in HEK293 cell memb... | 38593423 |
| 5-hydroxytryptamine receptor 2A | Ki | = | 389.05 | nM | 6.41 | Displacement of [3H]LSD from human 5-HT2A receptor expressed in HEK293 cell memb... | 38593423 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 38593423 | 10.1021/acs.jmedchem.3c01961 | 5-hydroxytryptamine receptor 2A | 2 |
| 38593423 | 10.1021/acs.jmedchem.3c01961 | Mus musculus | 2 |
| 38593423 | 10.1021/acs.jmedchem.3c01961 | 5-hydroxytryptamine receptor 2B | 1 |
| 38593423 | 10.1021/acs.jmedchem.3c01961 | 5-hydroxytryptamine receptor 2C | 1 |
| 38593423 | 10.1021/acs.jmedchem.3c01961 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine