Compound Detail
CHEMBL22207
RACEMETHORPHAN 🧪 Phase II
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🧪 Phase II
Basic Information
| ChEMBL ID | CHEMBL22207 |
| Name | RACEMETHORPHAN |
| Phase | Phase II |
| Structure Type | MOL |
| InChI Key | MKXZASYAUGDDCJ-UHFFFAOYSA-N |
4
Targets
6
Activities
1
Assay Types
0
PK Parameters
10
Publications
8
Known Names
Molecular Properties
271.4
MW (Da)
3.38
ALogP
2
HBA
0
HBD
12.5
PSA (Ų)
0.78
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Racemic |
Activity Summary
IC50 6 meas. best 6.62
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glutamate [NMDA] receptor CHEMBL2094124 | IC50 | 6.62 | 6.465 | 240.0 | 2 |
| Glutamate NMDA receptor CHEMBL1907608 | IC50 | 6.23 | 5.965 | 590.0 | 2 |
| Sodium channel alpha subunits; brain (Types I, II, III) CHEMBL2095171 | IC50 | 5.89 | 5.89 | 1300.0 | 1 |
| Opioid receptor CHEMBL2095192 | IC50 | 5.7 | 5.7 | 2000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glutamate [NMDA] receptor | IC50 | = | 240.0 | nM | 6.62 | Binding affinity against dextromethorpin binding site associated with N-methyl-D... | 1433216 |
| Glutamate [NMDA] receptor | IC50 | = | 490.0 | nM | 6.31 | Inhibition of [3H]1 binding to dextromethorpin binding site of guinea pig micros... | 1433216 |
| Glutamate NMDA receptor | IC50 | = | 590.0 | nM | 6.23 | Binding affinity against dextromethorpin binding site of N-methyl-D-aspartate gl... | 1433216 |
| Sodium channel alpha subunits; brain (Types I, II, III) | IC50 | = | 1300.0 | nM | 5.89 | Binding of [3H]batrachotoxin (BTX) to rat brain sodium channel | 10406642 |
| Glutamate NMDA receptor | IC50 | = | 2000.0 | nM | 5.7 | Binding affinity against TCP binding site associated with N-methyl-D-aspartate g... | 1433216 |
| Opioid receptor | IC50 | = | 2000.0 | nM | 5.7 | Concentration required to inhibit [3H]naltrexone binding to Opioid receptors | 6292420 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 31158845 | 10.1038/s41586-019-1291-3 | ADMET | 61 |
| 11425529 | 10.1016/s0960-894x(01)00262-1 | Rattus norvegicus | 6 |
| 1433216 | 10.1021/jm00100a019 | Rattus norvegicus | 3 |
| 1433216 | 10.1021/jm00100a019 | Glutamate NMDA receptor | 3 |
| 10406642 | 10.1016/s0960-894x(99)00271-1 | Mus musculus | 3 |
| 1433216 | 10.1021/jm00100a019 | Glutamate [NMDA] receptor | 2 |
| 10406642 | 10.1016/s0960-894x(99)00271-1 | Sodium channel alpha subunits; brain (Types I, II, III) | 2 |
| 10406642 | 10.1016/s0960-894x(99)00271-1 | ADMET | 2 |
| 6292420 | 10.1021/jm00352a037 | Mus musculus | 2 |
| 6292420 | 10.1021/jm00352a037 | Opioid receptor | 1 |
Data from ChEMBL 36 via Core Engine