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DocumentationIdentifier: MM272083
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM272083 |
| SMILES |
CCCC(C#N)NC(C)C
|
| InChIKey |
MJGRNENJNJGRKJ-UHFFFAOYSA-N
|
| MW [Da] |
140.23
Automatically obtained from RDkit software. |
| LogP |
1.68
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 | 0.8182 |
|---|---|
| Cosine metric | 0.9045 |
| Dice metric | 0.9 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.43 |
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|---|---|---|---|---|---|
| AI: | 0
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|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
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| LogP: | 0.79 |
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|---|---|
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| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
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| LogP: | 1.68 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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+369 more
