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DocumentationIdentifier: MM399233
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM399233 |
| SMILES |
C=CC(C)(O)CCC(C)C
|
| InChIKey |
SQZZIWOOJKZCDF-UHFFFAOYSA-N
|
| MW [Da] |
142.24
Automatically obtained from RDkit software. |
| LogP |
2.36
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 | 0.908 |
|---|---|
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| Dice metric | 0.9518 |
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||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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Total passive interactions
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Total passive interactions
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| LogP: | 1.09 |
||||
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| AI: | 0
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