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DocumentationIdentifier: MM359184
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM359184 |
| SMILES |
C=CC#CC(=O)OC=CF
|
| InChIKey |
YINKOFIMUXYWKW-UHFFFAOYSA-N
|
| MW [Da] |
140.11
Automatically obtained from RDkit software. |
| LogP |
1.16
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM157615
Similarity: 0.8252
Similarity to MM157615
| Tanimoto metric | 0.8252 |
|---|---|
| Cosine metric | 0.9084 |
| Dice metric | 0.9043 |
| MW: | 128.1 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.99 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM158600
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| Tanimoto metric | 0.8058 |
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| Cosine metric | 0.8977 |
| Dice metric | 0.8925 |
| MW: | 122.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.86 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM283053
Similarity: 0.7217
Similarity to MM283053
| Tanimoto metric | 0.7217 |
|---|---|
| Cosine metric | 0.8391 |
| Dice metric | 0.8384 |
| MW: | 136.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.25 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+222 more
