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DocumentationIdentifier: MM292347
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM292347 |
| SMILES |
C=COC(=O)COCC=O
|
| InChIKey |
TYVXRHDRQBSZPA-UHFFFAOYSA-N
|
| MW [Da] |
144.13
Automatically obtained from RDkit software. |
| LogP |
-0.11
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM156418
Similarity: 0.9114
Similarity to MM156418
| Tanimoto metric | 0.9114 |
|---|---|
| Cosine metric | 0.9547 |
| Dice metric | 0.9536 |
| MW: | 130.14 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.71 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM292139
Similarity: 0.7742
Similarity to MM292139
| Tanimoto metric | 0.7742 |
|---|---|
| Cosine metric | 0.8735 |
| Dice metric | 0.8727 |
| MW: | 144.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM292414
Similarity: 0.766
Similarity to MM292414
| Tanimoto metric | 0.766 |
|---|---|
| Cosine metric | 0.8685 |
| Dice metric | 0.8675 |
| MW: | 140.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.32 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+333 more
