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DocumentationIdentifier: MM281919
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM281919 |
| SMILES |
C=COC(=C)C=CCOC
|
| InChIKey |
YYUKTRCIJQFXCX-UHFFFAOYSA-N
|
| MW [Da] |
140.18
Automatically obtained from RDkit software. |
| LogP |
1.86
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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MM169837
Similarity: 0.7945
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| Tanimoto metric | 0.7945 |
|---|---|
| Cosine metric | 0.8914 |
| Dice metric | 0.8855 |
| MW: | 128.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM107667
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| Tanimoto metric | 0.7534 |
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| Cosine metric | 0.868 |
| Dice metric | 0.8594 |
| MW: | 110.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.24 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM158055
Similarity: 0.75
Similarity to MM158055
| Tanimoto metric | 0.75 |
|---|---|
| Cosine metric | 0.8579 |
| Dice metric | 0.8571 |
| MW: | 122.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+326 more
