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DocumentationIdentifier: MM135071
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM135071 |
| SMILES |
CC(F)CC(F)CCO
|
| InChIKey |
CHIVZKSNNIYJIK-UHFFFAOYSA-N
|
| MW [Da] |
138.16
Automatically obtained from RDkit software. |
| LogP |
1.46
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 | 0.8193 |
|---|---|
| Cosine metric | 0.9051 |
| Dice metric | 0.9007 |
| MW: | 154.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.43 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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| Cosine metric | 0.8575 |
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|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
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| LogP: | 1.07 |
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| AI: | 0
Total active interactions
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MM223078
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| Tanimoto metric | 0.7158 |
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| Cosine metric | 0.846 |
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|---|---|---|---|---|---|
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Total passive interactions
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| LogP: | 1.84 |
||||
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+471 more
