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DocumentationIdentifier: MM244349
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM244349 |
| SMILES |
CC(=O)C(C)(CF)C(C)C
|
| InChIKey |
YMUZWFWXCDBYQU-UHFFFAOYSA-N
|
| MW [Da] |
146.21
Automatically obtained from RDkit software. |
| LogP |
2.21
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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MM180985
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| Tanimoto metric | 0.7241 |
|---|---|
| Cosine metric | 0.851 |
| Dice metric | 0.84 |
| MW: | 132.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.82 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM243898
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Similarity to MM243898
| Tanimoto metric | 0.6312 |
|---|---|
| Cosine metric | 0.7739 |
| Dice metric | 0.7739 |
| MW: | 146.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.14 |
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Total active interactions
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MM222826
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Similarity to MM222826
| Tanimoto metric | 0.6299 |
|---|---|
| Cosine metric | 0.7751 |
| Dice metric | 0.7729 |
| MW: | 146.21 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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+205 more
