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DocumentationIdentifier: MM299815
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM299815 |
| SMILES |
CCOC(C)C(O)C(=O)O
|
| InChIKey |
DJQOLVAOGRCCJT-UHFFFAOYSA-N
|
| MW [Da] |
148.16
Automatically obtained from RDkit software. |
| LogP |
-0.14
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM312965
Similarity: 0.8056
Similarity to MM312965
| Tanimoto metric | 0.8056 |
|---|---|
| Cosine metric | 0.8975 |
| Dice metric | 0.8923 |
| MW: | 134.13 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.53 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM333874
Similarity: 0.6824
Similarity to MM333874
| Tanimoto metric | 0.6824 |
|---|---|
| Cosine metric | 0.8112 |
| Dice metric | 0.8112 |
| MW: | 150.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.56 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM309972
Similarity: 0.6724
Similarity to MM309972
| Tanimoto metric | 0.6724 |
|---|---|
| Cosine metric | 0.8042 |
| Dice metric | 0.8041 |
| MW: | 146.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.02 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+57 more
