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DocumentationIdentifier: MM26551
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM26551 |
| SMILES |
C=COC(=C)C=O
|
| InChIKey |
SMFLTAARSDNHRE-UHFFFAOYSA-N
|
| MW [Da] |
98.1
Automatically obtained from RDkit software. |
| LogP |
0.86
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 | 0.7778 |
|---|---|
| Cosine metric | 0.8819 |
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| MW: | 86.09 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
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Total passive interactions
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|---|---|---|---|---|---|
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Total passive interactions
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+138 more
