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DocumentationIdentifier: MM261588
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM261588 |
| SMILES |
COCC(O)CN(C)C=O
|
| InChIKey |
UDSBBLVVHMGBEG-UHFFFAOYSA-N
|
| MW [Da] |
147.17
Automatically obtained from RDkit software. |
| LogP |
-0.92
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
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MM141720
Similarity: 0.8113
Similarity to MM141720
| Tanimoto metric | 0.8113 |
|---|---|
| Cosine metric | 0.9007 |
| Dice metric | 0.8958 |
| MW: | 133.15 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1.57 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM155765
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| Tanimoto metric | 0.7547 |
|---|---|
| Cosine metric | 0.8687 |
| Dice metric | 0.8602 |
| MW: | 133.15 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1.26 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM326336
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Similarity to MM326336
| Tanimoto metric | 0.7154 |
|---|---|
| Cosine metric | 0.8351 |
| Dice metric | 0.8341 |
| MW: | 147.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.92 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+221 more
