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DocumentationIdentifier: MM312643
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM312643 |
| SMILES |
O=COC(C=O)(CO)CO
|
| InChIKey |
ZIUOWZQDRFOQBP-UHFFFAOYSA-N
|
| MW [Da] |
148.11
Automatically obtained from RDkit software. |
| LogP |
-1.92
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM139297
Similarity: 0.6306
Similarity to MM139297
| Tanimoto metric | 0.6306 |
|---|---|
| Cosine metric | 0.7941 |
| Dice metric | 0.7735 |
| MW: | 134.13 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM312461
Similarity: 0.6087
Similarity to MM312461
| Tanimoto metric | 0.6087 |
|---|---|
| Cosine metric | 0.7724 |
| Dice metric | 0.7568 |
| MW: | 150.13 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -2.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM116092
Similarity: 0.5676
Similarity to MM116092
| Tanimoto metric | 0.5676 |
|---|---|
| Cosine metric | 0.7534 |
| Dice metric | 0.7241 |
| MW: | 118.09 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+101 more
