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DocumentationIdentifier: MM155973
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM155973 |
| SMILES |
C=COC(C)COC=O
|
| InChIKey |
ZXMXHVMGTWKIOG-UHFFFAOYSA-N
|
| MW [Da] |
130.14
Automatically obtained from RDkit software. |
| LogP |
0.71
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM250802
Similarity: 0.7172
Similarity to MM250802
| Tanimoto metric | 0.7172 |
|---|---|
| Cosine metric | 0.8469 |
| Dice metric | 0.8353 |
| MW: | 144.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM87594
Similarity: 0.6632
Similarity to MM87594
| Tanimoto metric | 0.6632 |
|---|---|
| Cosine metric | 0.8016 |
| Dice metric | 0.7975 |
| MW: | 146.14 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.32 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM155795
Similarity: 0.619
Similarity to MM155795
| Tanimoto metric | 0.619 |
|---|---|
| Cosine metric | 0.7655 |
| Dice metric | 0.7647 |
| MW: | 132.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.58 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+265 more
