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DocumentationIdentifier: MM137898
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM137898 |
| SMILES |
O=CC(F)(F)C(=O)CF
|
| InChIKey |
MCTKIKGQFBYGDV-UHFFFAOYSA-N
|
| MW [Da] |
140.06
Automatically obtained from RDkit software. |
| LogP |
0.36
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM225753
Similarity: 0.8362
Similarity to MM225753
| Tanimoto metric | 0.8362 |
|---|---|
| Cosine metric | 0.9144 |
| Dice metric | 0.9108 |
| MW: | 158.05 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.65 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM186066
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Similarity to MM186066
| Tanimoto metric | 0.7182 |
|---|---|
| Cosine metric | 0.8363 |
| Dice metric | 0.836 |
| MW: | 140.06 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.36 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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2,2-difluoro-3-oxobutanal
Similarity: 0.701
Similarity to 2,2-difluoro-3-oxobutanal
| Tanimoto metric | 0.701 |
|---|---|
| Cosine metric | 0.8373 |
| Dice metric | 0.8242 |
| MW: | 122.07 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.41 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+35 more
