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DocumentationIdentifier: MM235147
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM235147 |
| SMILES |
CCCCC(C)(F)C(C)=O
|
| InChIKey |
BJCRRWCFLNPSLF-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: 0.8182
Similarity to MM132686
| Tanimoto metric | 0.8182 |
|---|---|
| Cosine metric | 0.9045 |
| Dice metric | 0.9 |
| MW: | 132.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM243834
Similarity: 0.7388
Similarity to MM243834
| Tanimoto metric | 0.7388 |
|---|---|
| Cosine metric | 0.8504 |
| Dice metric | 0.8498 |
| MW: | 146.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.49 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM222172
Similarity: 0.7214
Similarity to MM222172
| Tanimoto metric | 0.7214 |
|---|---|
| Cosine metric | 0.8382 |
| Dice metric | 0.8382 |
| MW: | 146.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+278 more
