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DocumentationIdentifier: MM316607
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM316607 |
| SMILES |
O=C(O)C(O)CCO
|
| InChIKey |
UFYGCFHQAXXBCF-UHFFFAOYSA-N
|
| MW [Da] |
120.1
Automatically obtained from RDkit software. |
| LogP |
-1.19
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
Malic Acid
Similarity: 0.7701
Similarity to Malic Acid
| Tanimoto metric | 0.7701 |
|---|---|
| Cosine metric | 0.8776 |
| Dice metric | 0.8701 |
| MW: | 134.09 |
||||
|---|---|---|---|---|---|
| PI: | 7
Total passive interactions
|
| LogP: | -1.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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Similarity to 2-Hydroxybutyric Acid
| Tanimoto metric | 0.7612 |
|---|---|
| Cosine metric | 0.8725 |
| Dice metric | 0.8644 |
| MW: | 104.11 |
||||
|---|---|---|---|---|---|
| PI: | 11
Total passive interactions
|
| LogP: | -0.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM365265
Similarity: 0.7273
Similarity to MM365265
| Tanimoto metric | 0.7273 |
|---|---|
| Cosine metric | 0.8421 |
| Dice metric | 0.8421 |
| MW: | 118.09 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.98 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+336 more
