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DocumentationIdentifier: MM243803
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM243803 |
| SMILES |
CCCC(C)(CF)C(=O)O
|
| InChIKey |
QFWQFGWVOCGVNJ-UHFFFAOYSA-N
|
| MW [Da] |
148.18
Automatically obtained from RDkit software. |
| LogP |
1.85
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 | 0.7647 |
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| Cosine metric | 0.8745 |
| Dice metric | 0.8667 |
| MW: | 134.15 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
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| LogP: | 1.46 |
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| AI: | 0
Total active interactions
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Total passive interactions
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Total passive interactions
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| LogP: | 1.41 |
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+155 more
