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DocumentationIdentifier: MM257778
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM257778 |
| SMILES |
CCC(F)COCC(C)=O
|
| InChIKey |
ZSYFGWAMHWUZHQ-UHFFFAOYSA-N
|
| MW [Da] |
148.18
Automatically obtained from RDkit software. |
| LogP |
1.34
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM258103
Similarity: 0.79
Similarity to MM258103
| Tanimoto metric | 0.79 |
|---|---|
| Cosine metric | 0.8827 |
| Dice metric | 0.8827 |
| MW: | 148.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.34 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM363361
Similarity: 0.7113
Similarity to MM363361
| Tanimoto metric | 0.7113 |
|---|---|
| Cosine metric | 0.8335 |
| Dice metric | 0.8313 |
| MW: | 148.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.34 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM165600
Similarity: 0.6854
Similarity to MM165600
| Tanimoto metric | 0.6854 |
|---|---|
| Cosine metric | 0.8279 |
| Dice metric | 0.8133 |
| MW: | 134.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+264 more
