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DocumentationIdentifier: MM278796
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM278796 |
| SMILES |
CCCC(=O)OCC=CF
|
| InChIKey |
WYMRFJUZCIQSRJ-UHFFFAOYSA-N
|
| MW [Da] |
146.16
Automatically obtained from RDkit software. |
| LogP |
1.81
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM167527
Similarity: 0.8144
Similarity to MM167527
| Tanimoto metric | 0.8144 |
|---|---|
| Cosine metric | 0.9025 |
| Dice metric | 0.8977 |
| MW: | 132.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.42 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM278795
Similarity: 0.7182
Similarity to MM278795
| Tanimoto metric | 0.7182 |
|---|---|
| Cosine metric | 0.8363 |
| Dice metric | 0.836 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.91 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM260595
Similarity: 0.7117
Similarity to MM260595
| Tanimoto metric | 0.7117 |
|---|---|
| Cosine metric | 0.8318 |
| Dice metric | 0.8316 |
| MW: | 150.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.72 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+378 more
