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DocumentationIdentifier: MM297474
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM297474 |
| SMILES |
CC(=O)C(O)C(=O)CCO
|
| InChIKey |
PYKSIKHWBUKGDK-UHFFFAOYSA-N
|
| MW [Da] |
146.14
Automatically obtained from RDkit software. |
| LogP |
-1.11
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM173243
Similarity: 0.7522
Similarity to MM173243
| Tanimoto metric | 0.7522 |
|---|---|
| Cosine metric | 0.8673 |
| Dice metric | 0.8586 |
| MW: | 132.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.5 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM50321
Similarity: 0.6417
Similarity to MM50321
| Tanimoto metric | 0.6417 |
|---|---|
| Cosine metric | 0.7903 |
| Dice metric | 0.7817 |
| MW: | 130.14 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.08 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM269278
Similarity: 0.6408
Similarity to MM269278
| Tanimoto metric | 0.6408 |
|---|---|
| Cosine metric | 0.7815 |
| Dice metric | 0.7811 |
| MW: | 146.14 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+73 more
