Compound Detail
CHEMBL131244
1-AMINOCYCLOBUTANE CARBOXYLIC ACID Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL131244 |
| Name | 1-AMINOCYCLOBUTANE CARBOXYLIC ACID |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FVTVMQPGKVHSEY-UHFFFAOYSA-N |
2
Targets
3
Activities
2
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
115.1
MW (Da)
-0.05
ALogP
2
HBA
2
HBD
63.3
PSA (Ų)
0.50
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 4.73
Ki 1 meas. best 4.8
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glutamate NMDA receptor CHEMBL1907608 | Ki | 4.8 | 4.8 | 15848.9 | 1 |
| Glutamate receptor ionotropic, NMDA 2C CHEMBL401 | IC50 | 4.73 | 4.73 | 18500.0 | 1 |
| Glutamate NMDA receptor CHEMBL1907608 | IC50 | 4.72 | 4.72 | 19000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glutamate NMDA receptor | Ki | = | 15848.93 | nM | 4.8 | Displacement of [3H]glycine from strychnine-insensitive glycine recognition site... | 19642674 |
| Glutamate receptor ionotropic, NMDA 2C | IC50 | = | 18500.0 | nM | 4.73 | Compound was evaluated for in vitro inhibition of oocytes at NMDA receptor. | 7990104 |
| Glutamate NMDA receptor | IC50 | = | 19000.0 | nM | 4.72 | In vitro inhibition of [3H]glycine at NMDA receptor | 7990104 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 7990104 | 10.1021/jm00050a001 | Glutamate NMDA receptor | 1 |
| 7990104 | 10.1021/jm00050a001 | Glutamate receptor ionotropic, NMDA 2C | 1 |
| 19642674 | 10.1021/jm900363q | Unchecked | 1 |
| 19642674 | 10.1021/jm900363q | Glutamate NMDA receptor | 1 |
| 23571415 | 10.1124/mol.112.084152 | Solute carrier organic anion transporter family member 1B3 | 1 |
| 23571415 | 10.1124/mol.112.084152 | Solute carrier organic anion transporter family member 1B1 | 1 |
Data from ChEMBL 36 via Core Engine