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DocumentationIdentifier: MM225667
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM225667 |
| SMILES |
CC(=O)C(C)C(F)(F)C=O
|
| InChIKey |
AJSSRHBWANREHI-UHFFFAOYSA-N
|
| MW [Da] |
150.12
Automatically obtained from RDkit software. |
| LogP |
1.05
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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MM129877
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| Tanimoto metric | 0.7483 |
|---|---|
| Cosine metric | 0.865 |
| Dice metric | 0.856 |
| MW: | 136.14 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.87 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM160232
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| Cosine metric | 0.8278 |
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| MW: | 132.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
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| LogP: | 0.75 |
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| AI: | 0
Total active interactions
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MM222831
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Similarity to MM222831
| Tanimoto metric | 0.6102 |
|---|---|
| Cosine metric | 0.7579 |
| Dice metric | 0.7579 |
| MW: | 150.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.26 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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