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DocumentationIdentifier: MM130007
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM130007 |
| SMILES |
CCC(C)CC(F)(F)F
|
| InChIKey |
BJLHXROPECKRHX-UHFFFAOYSA-N
|
| MW [Da] |
140.15
Automatically obtained from RDkit software. |
| LogP |
2.98
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 | 0.931 |
|---|---|
| Cosine metric | 0.9649 |
| Dice metric | 0.9643 |
| MW: | 154.18 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3.38 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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Total passive interactions
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|---|---|---|---|---|---|
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Total passive interactions
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| LogP: | 3.23 |
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+471 more
