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DocumentationIdentifier: MM162913
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM162913 |
| SMILES |
OCCNCC(F)(F)CO
|
| InChIKey |
KEEOGWXHGIXCKF-UHFFFAOYSA-N
|
| MW [Da] |
155.14
Automatically obtained from RDkit software. |
| LogP |
-0.8
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM36173
Similarity: 0.7217
Similarity to MM36173
| Tanimoto metric | 0.7217 |
|---|---|
| Cosine metric | 0.8386 |
| Dice metric | 0.8384 |
| MW: | 151.16 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.39 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM112582
Similarity: 0.5876
Similarity to MM112582
| Tanimoto metric | 0.5876 |
|---|---|
| Cosine metric | 0.7666 |
| Dice metric | 0.7403 |
| MW: | 121.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM105498
Similarity: 0.5567
Similarity to MM105498
| Tanimoto metric | 0.5567 |
|---|---|
| Cosine metric | 0.7461 |
| Dice metric | 0.7152 |
| MW: | 121.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+276 more
