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DocumentationIdentifier: MM389969
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM389969 |
| SMILES |
C=CC(=O)C(C=C)C(C)=O
|
| InChIKey |
JMUAGOBCAYMCGD-UHFFFAOYSA-N
|
| MW [Da] |
138.17
Automatically obtained from RDkit software. |
| LogP |
1.13
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM389965
Similarity: 0.6667
Similarity to MM389965
| Tanimoto metric | 0.6667 |
|---|---|
| Cosine metric | 0.803 |
| Dice metric | 0.8 |
| MW: | 138.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM234912
Similarity: 0.6277
Similarity to MM234912
| Tanimoto metric | 0.6277 |
|---|---|
| Cosine metric | 0.7713 |
| Dice metric | 0.7713 |
| MW: | 140.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.36 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM298889
Similarity: 0.6184
Similarity to MM298889
| Tanimoto metric | 0.6184 |
|---|---|
| Cosine metric | 0.7673 |
| Dice metric | 0.7642 |
| MW: | 138.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+45 more
