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DocumentationIdentifier: MM25766
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM25766 |
| SMILES |
O=CC(F)(F)C=O
|
| InChIKey |
ZLQCRORFLSOUFF-UHFFFAOYSA-N
|
| MW [Da] |
108.04
Automatically obtained from RDkit software. |
| LogP |
0.02
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM23888
Similarity: 0.8333
Similarity to MM23888
| Tanimoto metric | 0.8333 |
|---|---|
| Cosine metric | 0.9129 |
| Dice metric | 0.9091 |
| MW: | 94.06 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.84 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM16569
Similarity: 0.6667
Similarity to MM16569
| Tanimoto metric | 0.6667 |
|---|---|
| Cosine metric | 0.8165 |
| Dice metric | 0.8 |
| MW: | 90.05 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM25717
Similarity: 0.5769
Similarity to MM25717
| Tanimoto metric | 0.5769 |
|---|---|
| Cosine metric | 0.7372 |
| Dice metric | 0.7317 |
| MW: | 108.09 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.23 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+24 more
