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DocumentationIdentifier: MM77988
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM77988 |
| SMILES |
C=COC(C=O)(CO)CO
|
| InChIKey |
VZGLHKRFMOSDPW-UHFFFAOYSA-N
|
| MW [Da] |
146.14
Automatically obtained from RDkit software. |
| LogP |
-0.93
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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MM42274
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| Tanimoto metric | 0.8393 |
|---|---|
| Cosine metric | 0.9161 |
| Dice metric | 0.9126 |
| MW: | 130.14 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM310079
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| Tanimoto metric | 0.7176 |
|---|---|
| Cosine metric | 0.8356 |
| Dice metric | 0.8356 |
| MW: | 144.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.49 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM243177
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Similarity to MM243177
| Tanimoto metric | 0.6812 |
|---|---|
| Cosine metric | 0.8108 |
| Dice metric | 0.8103 |
| MW: | 144.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.75 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+250 more
