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DocumentationIdentifier: MM348539
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM348539 |
| SMILES |
CC(C=O)C(O)COC=O
|
| InChIKey |
VEVYIBPQGAPVMD-UHFFFAOYSA-N
|
| MW [Da] |
146.14
Automatically obtained from RDkit software. |
| LogP |
-0.64
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM155948
Similarity: 0.7238
Similarity to MM155948
| Tanimoto metric | 0.7238 |
|---|---|
| Cosine metric | 0.8508 |
| Dice metric | 0.8398 |
| MW: | 132.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.89 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM362450
Similarity: 0.7143
Similarity to MM362450
| Tanimoto metric | 0.7143 |
|---|---|
| Cosine metric | 0.8337 |
| Dice metric | 0.8333 |
| MW: | 146.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.22 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM348537
Similarity: 0.6746
Similarity to MM348537
| Tanimoto metric | 0.6746 |
|---|---|
| Cosine metric | 0.8057 |
| Dice metric | 0.8057 |
| MW: | 144.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.34 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+214 more
