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DocumentationIdentifier: MM413188
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM413188 |
| SMILES |
C=CC(=CF)CCCCC
|
| InChIKey |
GVIIGVLHSSISNG-UHFFFAOYSA-N
|
| MW [Da] |
142.22
Automatically obtained from RDkit software. |
| LogP |
3.61
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 | 0.9054 |
|---|---|
| Cosine metric | 0.9515 |
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||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
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| LogP: | 3.22 |
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| AI: | 0
Total active interactions
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