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DocumentationIdentifier: MM313622
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM313622 |
| SMILES |
O=CC(C=O)(C=O)C(F)F
|
| InChIKey |
YLEHYEQJXPZVEL-UHFFFAOYSA-N
|
| MW [Da] |
150.08
Automatically obtained from RDkit software. |
| LogP |
-0.17
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM103282
Similarity: 0.7538
Similarity to MM103282
| Tanimoto metric | 0.7538 |
|---|---|
| Cosine metric | 0.8682 |
| Dice metric | 0.8596 |
| MW: | 122.11 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM131030
Similarity: 0.6203
Similarity to MM131030
| Tanimoto metric | 0.6203 |
|---|---|
| Cosine metric | 0.7657 |
| Dice metric | 0.7656 |
| MW: | 140.1 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.77 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM313554
Similarity: 0.604
Similarity to MM313554
| Tanimoto metric | 0.604 |
|---|---|
| Cosine metric | 0.7682 |
| Dice metric | 0.7531 |
| MW: | 152.1 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.37 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+43 more
