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DocumentationIdentifier: MM264373
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM264373 |
| SMILES |
C=C(C=CC)CN(C)C=O
|
| InChIKey |
WXZQQMZNZFBIDS-UHFFFAOYSA-N
|
| MW [Da] |
139.2
Automatically obtained from RDkit software. |
| LogP |
1.21
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM142404
Similarity: 0.819
Similarity to MM142404
| Tanimoto metric | 0.819 |
|---|---|
| Cosine metric | 0.905 |
| Dice metric | 0.9005 |
| MW: | 125.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.82 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM305018
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| Tanimoto metric | 0.7429 |
|---|---|
| Cosine metric | 0.8619 |
| Dice metric | 0.8525 |
| MW: | 125.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.86 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM332682
Similarity: 0.6899
Similarity to MM332682
| Tanimoto metric | 0.6899 |
|---|---|
| Cosine metric | 0.8171 |
| Dice metric | 0.8165 |
| MW: | 139.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.21 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+159 more
