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DocumentationIdentifier: MM65284
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM65284 |
| SMILES |
C#CC(=C)OC(=O)COC
|
| InChIKey |
LAZUZHWQSDEVTI-UHFFFAOYSA-N
|
| MW [Da] |
140.14
Automatically obtained from RDkit software. |
| LogP |
0.32
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
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MM43266
Similarity: 0.8417
Similarity to MM43266
| Tanimoto metric | 0.8417 |
|---|---|
| Cosine metric | 0.9174 |
| Dice metric | 0.914 |
| MW: | 126.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.33 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM334598
Similarity: 0.6375
Similarity to MM334598
| Tanimoto metric | 0.6375 |
|---|---|
| Cosine metric | 0.7814 |
| Dice metric | 0.7786 |
| MW: | 144.1 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.03 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM104679
Similarity: 0.6333
Similarity to MM104679
| Tanimoto metric | 0.6333 |
|---|---|
| Cosine metric | 0.7958 |
| Dice metric | 0.7755 |
| MW: | 110.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.7 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+168 more
