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DocumentationIdentifier: MM365347
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM365347 |
| SMILES |
O=CCOCOC(=O)CO
|
| InChIKey |
PLHBEMGTWHSHME-UHFFFAOYSA-N
|
| MW [Da] |
148.11
Automatically obtained from RDkit software. |
| LogP |
-1.31
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM48611
Similarity: 0.88
Similarity to MM48611
| Tanimoto metric | 0.88 |
|---|---|
| Cosine metric | 0.9381 |
| Dice metric | 0.9362 |
| MW: | 134.13 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM364902
Similarity: 0.8571
Similarity to MM364902
| Tanimoto metric | 0.8571 |
|---|---|
| Cosine metric | 0.9242 |
| Dice metric | 0.9231 |
| MW: | 150.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.51 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM337013
Similarity: 0.8313
Similarity to MM337013
| Tanimoto metric | 0.8313 |
|---|---|
| Cosine metric | 0.908 |
| Dice metric | 0.9079 |
| MW: | 148.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.39 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+234 more
