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DocumentationIdentifier: MM397650
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM397650 |
| SMILES |
O=CC(CC=CF)=C(F)F
|
| InChIKey |
TTXFMQLMRSTBNK-UHFFFAOYSA-N
|
| MW [Da] |
150.1
Automatically obtained from RDkit software. |
| LogP |
2.21
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM180889
Similarity: 0.8571
Similarity to MM180889
| Tanimoto metric | 0.8571 |
|---|---|
| Cosine metric | 0.9258 |
| Dice metric | 0.9231 |
| MW: | 132.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.91 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM200392
Similarity: 0.7551
Similarity to MM200392
| Tanimoto metric | 0.7551 |
|---|---|
| Cosine metric | 0.869 |
| Dice metric | 0.8605 |
| MW: | 132.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.91 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM276288
Similarity: 0.7154
Similarity to MM276288
| Tanimoto metric | 0.7154 |
|---|---|
| Cosine metric | 0.8362 |
| Dice metric | 0.8341 |
| MW: | 146.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+251 more
