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DocumentationIdentifier: MM142135
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM142135 |
| SMILES |
C=CC(=O)CC(F)CF
|
| InChIKey |
UQYZEJGESIFPDK-UHFFFAOYSA-N
|
| MW [Da] |
134.13
Automatically obtained from RDkit software. |
| LogP |
1.44
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 | 0.7815 |
|---|---|
| Cosine metric | 0.884 |
| Dice metric | 0.8774 |
| MW: | 152.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.74 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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| PI: | 1
Total passive interactions
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| LogP: | 1.49 |
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|---|---|---|---|---|---|
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Total passive interactions
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| LogP: | 1.83 |
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Total active interactions
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+482 more
