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DocumentationIdentifier: MM323875
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM323875 |
| SMILES |
C#CC(=C)C#CC(=O)C#C
|
| InChIKey |
ZTTYIZWBZLDYJN-UHFFFAOYSA-N
|
| MW [Da] |
128.13
Automatically obtained from RDkit software. |
| LogP |
0.38
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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MM146223
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| Tanimoto metric | 0.8478 |
|---|---|
| Cosine metric | 0.9208 |
| Dice metric | 0.9176 |
| MW: | 118.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.77 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM146218
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| Tanimoto metric | 0.8478 |
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| Cosine metric | 0.9208 |
| Dice metric | 0.9176 |
| MW: | 118.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.77 |
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Total active interactions
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MM253045
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Similarity to MM253045
| Tanimoto metric | 0.78 |
|---|---|
| Cosine metric | 0.8769 |
| Dice metric | 0.8764 |
| MW: | 132.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
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| LogP: | 1.16 |
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Total active interactions
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