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DocumentationIdentifier: MM225664
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM225664 |
| SMILES |
CC(=O)C(O)C(C)(F)C=O
|
| InChIKey |
HJZUUNYXBMTKBI-UHFFFAOYSA-N
|
| MW [Da] |
148.13
Automatically obtained from RDkit software. |
| LogP |
-0.14
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM160258
Similarity: 0.6761
Similarity to MM160258
| Tanimoto metric | 0.6761 |
|---|---|
| Cosine metric | 0.8223 |
| Dice metric | 0.8068 |
| MW: | 134.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.53 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM234745
Similarity: 0.6697
Similarity to MM234745
| Tanimoto metric | 0.6697 |
|---|---|
| Cosine metric | 0.8026 |
| Dice metric | 0.8022 |
| MW: | 148.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.14 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM223770
Similarity: 0.5869
Similarity to MM223770
| Tanimoto metric | 0.5869 |
|---|---|
| Cosine metric | 0.7403 |
| Dice metric | 0.7396 |
| MW: | 150.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.34 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+28 more
