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DocumentationIdentifier: MM135436
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM135436 |
| SMILES |
C=COC(=O)CC(C)F
|
| InChIKey |
QOYMDAMPYBPTHQ-UHFFFAOYSA-N
|
| MW [Da] |
132.13
Automatically obtained from RDkit software. |
| LogP |
1.42
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 | 0.7823 |
|---|---|
| Cosine metric | 0.8845 |
| Dice metric | 0.8778 |
| MW: | 144.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.59 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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| Cosine metric | 0.8793 |
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||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
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| LogP: | 0.91 |
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Total active interactions
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|---|---|---|---|---|---|
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Total passive interactions
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| LogP: | 1.03 |
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+249 more
