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DocumentationIdentifier: MM179760
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM179760 |
| SMILES |
C=CCN(C=N)C(C)C
|
| InChIKey |
MNWFIBWCWIADNK-UHFFFAOYSA-N
|
| MW [Da] |
126.2
Automatically obtained from RDkit software. |
| LogP |
1.49
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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MM197008
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| Tanimoto metric | 0.7791 |
|---|---|
| Cosine metric | 0.8781 |
| Dice metric | 0.8758 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.49 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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| Tanimoto metric | 0.7717 |
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| Cosine metric | 0.8785 |
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|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
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| LogP: | 1.79 |
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MM178047
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| Tanimoto metric | 0.6892 |
|---|---|
| Cosine metric | 0.8237 |
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| MW: | 124.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.27 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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+396 more
