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DocumentationIdentifier: MM333781
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM333781 |
| SMILES |
COCC(O)C(O)C(=O)O
|
| InChIKey |
JNNQKCGFFAZGPU-UHFFFAOYSA-N
|
| MW [Da] |
150.13
Automatically obtained from RDkit software. |
| LogP |
-1.56
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM379341
Similarity: 0.76
Similarity to MM379341
| Tanimoto metric | 0.76 |
|---|---|
| Cosine metric | 0.8718 |
| Dice metric | 0.8636 |
| MW: | 136.1 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -2.21 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM396716
Similarity: 0.6934
Similarity to MM396716
| Tanimoto metric | 0.6934 |
|---|---|
| Cosine metric | 0.8214 |
| Dice metric | 0.819 |
| MW: | 150.09 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -2.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM333874
Similarity: 0.6899
Similarity to MM333874
| Tanimoto metric | 0.6899 |
|---|---|
| Cosine metric | 0.8181 |
| Dice metric | 0.8165 |
| MW: | 150.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.56 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+193 more
