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DocumentationIdentifier: MM160790
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM160790 |
| SMILES |
CC(O)C(=O)C(F)CO
|
| InChIKey |
QGQRVKOEHKEXIJ-UHFFFAOYSA-N
|
| MW [Da] |
136.12
Automatically obtained from RDkit software. |
| LogP |
-0.73
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
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| Tanimoto metric | 0.7961 |
|---|---|
| Cosine metric | 0.8922 |
| Dice metric | 0.8864 |
| MW: | 152.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.76 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
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| LogP: | -1.55 |
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Total active interactions
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|---|---|---|---|---|---|
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Total passive interactions
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| LogP: | -0.34 |
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+274 more
