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DocumentationIdentifier: MM143792
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM143792 |
| SMILES |
C=C(C#N)C=C(C)CC
|
| InChIKey |
XQNYNSKCBUHKDZ-UHFFFAOYSA-N
|
| MW [Da] |
121.18
Automatically obtained from RDkit software. |
| LogP |
2.42
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 | 0.8851 |
|---|---|
| Cosine metric | 0.9408 |
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||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
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| LogP: | 2.81 |
||||
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| LogP: | 2.81 |
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