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DocumentationIdentifier: MM261925
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM261925 |
| SMILES |
COCC(O)CC(=O)OC
|
| InChIKey |
VKCKOTRHMPAORK-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
MM142013
Similarity: 0.8774
Similarity to MM142013
| Tanimoto metric | 0.8774 |
|---|---|
| Cosine metric | 0.9367 |
| Dice metric | 0.9347 |
| MW: | 134.13 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM275024
Similarity: 0.8113
Similarity to MM275024
| Tanimoto metric | 0.8113 |
|---|---|
| Cosine metric | 0.9007 |
| Dice metric | 0.8958 |
| MW: | 134.13 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.53 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM348919
Similarity: 0.744
Similarity to MM348919
| Tanimoto metric | 0.744 |
|---|---|
| Cosine metric | 0.8535 |
| Dice metric | 0.8532 |
| MW: | 148.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.44 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+350 more
