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DocumentationIdentifier: MM235554
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM235554 |
| SMILES |
O=CC#CC(F)(F)C(F)F
|
| InChIKey |
YBMNIWZUNLJGLH-UHFFFAOYSA-N
|
| MW [Da] |
154.06
Automatically obtained from RDkit software. |
| LogP |
1.09
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM163528
Similarity: 0.7547
Similarity to MM163528
| Tanimoto metric | 0.7547 |
|---|---|
| Cosine metric | 0.8687 |
| Dice metric | 0.8602 |
| MW: | 136.07 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.79 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM235529
Similarity: 0.6457
Similarity to MM235529
| Tanimoto metric | 0.6457 |
|---|---|
| Cosine metric | 0.7848 |
| Dice metric | 0.7847 |
| MW: | 155.09 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.85 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM235530
Similarity: 0.6357
Similarity to MM235530
| Tanimoto metric | 0.6357 |
|---|---|
| Cosine metric | 0.7773 |
| Dice metric | 0.7773 |
| MW: | 156.08 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.88 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+135 more
