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DocumentationIdentifier: MM243834
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM243834 |
| SMILES |
CCCC(F)(CC)C(C)=O
|
| InChIKey |
UOSZYUUCIOHPPX-UHFFFAOYSA-N
|
| MW [Da] |
146.21
Automatically obtained from RDkit software. |
| LogP |
2.49
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM132686
Similarity: 0.8839
Similarity to MM132686
| Tanimoto metric | 0.8839 |
|---|---|
| Cosine metric | 0.9402 |
| Dice metric | 0.9384 |
| MW: | 132.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM244008
Similarity: 0.7721
Similarity to MM244008
| Tanimoto metric | 0.7721 |
|---|---|
| Cosine metric | 0.8735 |
| Dice metric | 0.8714 |
| MW: | 146.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM222172
Similarity: 0.7576
Similarity to MM222172
| Tanimoto metric | 0.7576 |
|---|---|
| Cosine metric | 0.8626 |
| Dice metric | 0.8621 |
| MW: | 146.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+263 more
