Compound Detail
CHEMBL15487
PIPERIDINE Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL15487 |
| Name | PIPERIDINE |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NQRYJNQNLNOLGT-UHFFFAOYSA-N |
1
Targets
3
Activities
2
Assay Types
1
PK Parameters
12
Publications
0
Known Names
Molecular Properties
85.2
MW (Da)
0.76
ALogP
1
HBA
1
HBD
12.0
PSA (Ų)
0.46
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Achiral |
Activity Summary
Kd 2 meas. best 6.92
Ki 1 meas.
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Neuronal acetylcholine receptor CHEMBL2094110 | Kd | 6.92 | 5.54 | 120.0 | 2 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| T1/2 | 11.1 | hr | - |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Neuronal acetylcholine receptor | Kd | = | 120.0 | nM | 6.92 | Ability to enhance the binding of (+/-)-[3H]nicotine to the rat brain P2 fractio... | 4032427 |
| Neuronal acetylcholine receptor | Kd | = | 69000.0 | nM | 4.16 | Ability to enhance the binding of (+/-)-[3H]nicotine to the rat brain P2 fractio... | 4032427 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 4032427 | 10.1021/jm00147a021 | Neuronal acetylcholine receptor | 6 |
| 21955456 | 10.1016/j.bmc.2011.08.058 | Proton-coupled amino acid transporter 1 | 2 |
| 24249037 | 10.1007/s11095-013-1232-z | No relevant target | 2 |
| 15026074 | 10.1016/j.bmcl.2003.12.101 | ADMET | 1 |
| 7199089 | 10.1021/jm00142a006 | Thromboxane-A synthase | 1 |
| 18570365 | 10.1021/jm800219f | No relevant target | 1 |
| 22533875 | 10.1021/jm300343m | No relevant target | 1 |
| 20839888 | 10.1021/jf102087c | Echinochloa crus-galli | 1 |
| 25305333 | 10.1016/j.ejmech.2014.10.005 | Bacillus cereus | 1 |
| 25305333 | 10.1016/j.ejmech.2014.10.005 | Escherichia coli | 1 |
| 30423248 | 10.1021/acs.jmedchem.8b01308 | No relevant target | 1 |
| 30891128 | 10.1021/acsmedchemlett.8b00656 | No relevant target | 1 |
Data from ChEMBL 36 via Core Engine