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DocumentationIdentifier: MM171851
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM171851 |
| SMILES |
COCC(O)C(O)CO
|
| InChIKey |
ZBSLONNAPOEUFH-UHFFFAOYSA-N
|
| MW [Da] |
136.15
Automatically obtained from RDkit software. |
| LogP |
-1.65
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM292617
Similarity: 0.9701
Similarity to MM292617
| Tanimoto metric | 0.9701 |
|---|---|
| Cosine metric | 0.985 |
| Dice metric | 0.9848 |
| MW: | 150.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM108082
Similarity: 0.8615
Similarity to MM108082
| Tanimoto metric | 0.8615 |
|---|---|
| Cosine metric | 0.9282 |
| Dice metric | 0.9256 |
| MW: | 120.15 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.63 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM155664
Similarity: 0.791
Similarity to MM155664
| Tanimoto metric | 0.791 |
|---|---|
| Cosine metric | 0.8864 |
| Dice metric | 0.8833 |
| MW: | 134.18 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.03 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+580 more
