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DocumentationIdentifier: MM68170
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM68170 |
| SMILES |
CC(F)C=C(C=O)C(C)O
|
| InChIKey |
XEPNMCDCIFHUEF-UHFFFAOYSA-N
|
| MW [Da] |
146.16
Automatically obtained from RDkit software. |
| LogP |
0.85
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM134207
Similarity: 0.6667
Similarity to MM134207
| Tanimoto metric | 0.6667 |
|---|---|
| Cosine metric | 0.8165 |
| Dice metric | 0.8 |
| MW: | 132.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.67 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM396743
Similarity: 0.6529
Similarity to MM396743
| Tanimoto metric | 0.6529 |
|---|---|
| Cosine metric | 0.7932 |
| Dice metric | 0.79 |
| MW: | 146.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.85 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM383626
Similarity: 0.6264
Similarity to MM383626
| Tanimoto metric | 0.6264 |
|---|---|
| Cosine metric | 0.7707 |
| Dice metric | 0.7703 |
| MW: | 146.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.36 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+274 more
