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DocumentationIdentifier: MM107668
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM107668 |
| SMILES |
C=COC(=C)C=CF
|
| InChIKey |
GQMSGVNEJXYELX-UHFFFAOYSA-N
|
| MW [Da] |
114.12
Automatically obtained from RDkit software. |
| LogP |
2.14
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 | 0.7821 |
|---|---|
| Cosine metric | 0.8843 |
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| MW: | 132.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.44 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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| PI: | 2
Total passive interactions
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| LogP: | 1.63 |
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|---|---|---|---|---|---|
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Total passive interactions
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| LogP: | 2.92 |
||||
|---|---|---|---|---|---|
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Total active interactions
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+175 more
