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DocumentationIdentifier: MM116225
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM116225 |
| SMILES |
C#CC(C#N)CC#N
|
| InChIKey |
ALTCZBWVAYQEDK-UHFFFAOYSA-N
|
| MW [Da] |
104.11
Automatically obtained from RDkit software. |
| LogP |
0.67
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 | 0.8125 |
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| MW: | 118.14 |
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|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
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| LogP: | 0.92 |
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| AI: | 0
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+249 more
