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DocumentationIdentifier: MM355181
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM355181 |
| SMILES |
C#CC(=O)C(F)=C(F)C=O
|
| InChIKey |
UIOUPKOMCLGWQA-UHFFFAOYSA-N
|
| MW [Da] |
144.08
Automatically obtained from RDkit software. |
| LogP |
0.54
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM175680
Similarity: 0.72
Similarity to MM175680
| Tanimoto metric | 0.72 |
|---|---|
| Cosine metric | 0.8485 |
| Dice metric | 0.8372 |
| MW: | 126.09 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.24 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM355195
Similarity: 0.6957
Similarity to MM355195
| Tanimoto metric | 0.6957 |
|---|---|
| Cosine metric | 0.8211 |
| Dice metric | 0.8205 |
| MW: | 140.09 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.97 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM355179
Similarity: 0.6737
Similarity to MM355179
| Tanimoto metric | 0.6737 |
|---|---|
| Cosine metric | 0.8063 |
| Dice metric | 0.805 |
| MW: | 142.1 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.53 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+86 more
