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DocumentationIdentifier: MM223889
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM223889 |
| SMILES |
CC(CO)C(=O)C(F)(F)F
|
| InChIKey |
UKSRHKFBNPMKAI-UHFFFAOYSA-N
|
| MW [Da] |
156.1
Automatically obtained from RDkit software. |
| LogP |
0.75
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM298284
Similarity: 0.7623
Similarity to MM298284
| Tanimoto metric | 0.7623 |
|---|---|
| Cosine metric | 0.8656 |
| Dice metric | 0.8651 |
| MW: | 154.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.58 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM129898
Similarity: 0.6757
Similarity to MM129898
| Tanimoto metric | 0.6757 |
|---|---|
| Cosine metric | 0.822 |
| Dice metric | 0.8065 |
| MW: | 140.1 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.77 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM111694
Similarity: 0.6306
Similarity to MM111694
| Tanimoto metric | 0.6306 |
|---|---|
| Cosine metric | 0.7941 |
| Dice metric | 0.7735 |
| MW: | 120.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.15 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+193 more
