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DocumentationIdentifier: MM386303
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM386303 |
| SMILES |
CCOCC(CO)OC=O
|
| InChIKey |
CJBRKSMFIVAPFM-UHFFFAOYSA-N
|
| MW [Da] |
148.16
Automatically obtained from RDkit software. |
| LogP |
-0.44
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM177846
Similarity: 0.7952
Similarity to MM177846
| Tanimoto metric | 0.7952 |
|---|---|
| Cosine metric | 0.8917 |
| Dice metric | 0.8859 |
| MW: | 134.13 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.83 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM291467
Similarity: 0.7528
Similarity to MM291467
| Tanimoto metric | 0.7528 |
|---|---|
| Cosine metric | 0.8607 |
| Dice metric | 0.859 |
| MW: | 148.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.44 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM87594
Similarity: 0.6505
Similarity to MM87594
| Tanimoto metric | 0.6505 |
|---|---|
| Cosine metric | 0.7885 |
| Dice metric | 0.7882 |
| MW: | 146.14 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.32 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+63 more
