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DocumentationIdentifier: MM389096
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM389096 |
| SMILES |
COC(C(=O)CO)C(F)F
|
| InChIKey |
OGLQGZXUAYFVJB-UHFFFAOYSA-N
|
| MW [Da] |
154.11
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
MM160359
Similarity: 0.7
Similarity to MM160359
| Tanimoto metric | 0.7 |
|---|---|
| Cosine metric | 0.8367 |
| Dice metric | 0.8235 |
| MW: | 140.09 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.83 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM38655
Similarity: 0.5929
Similarity to MM38655
| Tanimoto metric | 0.5929 |
|---|---|
| Cosine metric | 0.77 |
| Dice metric | 0.7444 |
| MW: | 120.12 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.56 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM109081
Similarity: 0.5357
Similarity to MM109081
| Tanimoto metric | 0.5357 |
|---|---|
| Cosine metric | 0.7319 |
| Dice metric | 0.6977 |
| MW: | 124.09 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.2 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+169 more
