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DocumentationIdentifier: MM35281
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM35281 |
| SMILES |
O=CC(F)(C=O)C=O
|
| InChIKey |
YHLKDIRYLANLLE-UHFFFAOYSA-N
|
| MW [Da] |
118.06
Automatically obtained from RDkit software. |
| LogP |
-0.71
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM25762
Similarity: 0.9
Similarity to MM25762
| Tanimoto metric | 0.9 |
|---|---|
| Cosine metric | 0.9487 |
| Dice metric | 0.9474 |
| MW: | 104.08 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM16569
Similarity: 0.6
Similarity to MM16569
| Tanimoto metric | 0.6 |
|---|---|
| Cosine metric | 0.7746 |
| Dice metric | 0.75 |
| MW: | 90.05 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM35211
Similarity: 0.5902
Similarity to MM35211
| Tanimoto metric | 0.5902 |
|---|---|
| Cosine metric | 0.7539 |
| Dice metric | 0.7423 |
| MW: | 122.07 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+16 more
