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DocumentationIdentifier: MM146242
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM146242 |
| SMILES |
CC=C(F)C#CC(F)F
|
| InChIKey |
LVHIGWXQQKRRIT-UHFFFAOYSA-N
|
| MW [Da] |
134.1
Automatically obtained from RDkit software. |
| LogP |
2.13
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 | 0.8471 |
|---|---|
| Cosine metric | 0.9204 |
| Dice metric | 0.9172 |
| MW: | 144.1 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.74 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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Total passive interactions
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| LogP: | 1.83 |
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Total passive interactions
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| LogP: | 1.31 |
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