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DocumentationIdentifier: MM224817
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM224817 |
| SMILES |
C=C(CN)CCC(F)(F)F
|
| InChIKey |
MYASZQUTCUDOKI-UHFFFAOYSA-N
|
| MW [Da] |
153.15
Automatically obtained from RDkit software. |
| LogP |
1.84
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 | 0.8571 |
|---|---|
| Cosine metric | 0.9258 |
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| MW: | 135.16 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 1.55 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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| PI: | 3
Total passive interactions
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Total passive interactions
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| LogP: | 1.94 |
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