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DocumentationIdentifier: MM166686
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM166686 |
| SMILES |
C=CCOCC(=O)OC
|
| InChIKey |
WTZZKRFPAXYNTE-UHFFFAOYSA-N
|
| MW [Da] |
130.14
Automatically obtained from RDkit software. |
| LogP |
0.36
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 | 0.7927 |
|---|---|
| Cosine metric | 0.8868 |
| Dice metric | 0.8844 |
| MW: | 144.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
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| LogP: | 0.75 |
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| AI: | 0
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| PI: | 2
Total passive interactions
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| LogP: | 0.27 |
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Total passive interactions
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+210 more
