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DocumentationIdentifier: MM389965
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM389965 |
| SMILES |
C=CC(=O)C(C=O)C(=C)C
|
| InChIKey |
WZDIUDABJVFSDT-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
MM160680
Similarity: 0.7669
Similarity to MM160680
| Tanimoto metric | 0.7669 |
|---|---|
| Cosine metric | 0.8757 |
| Dice metric | 0.8681 |
| MW: | 124.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.95 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM308215
Similarity: 0.6853
Similarity to MM308215
| Tanimoto metric | 0.6853 |
|---|---|
| Cosine metric | 0.8177 |
| Dice metric | 0.8133 |
| MW: | 140.18 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.36 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM298889
Similarity: 0.6792
Similarity to MM298889
| Tanimoto metric | 0.6792 |
|---|---|
| Cosine metric | 0.809 |
| Dice metric | 0.809 |
| MW: | 138.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+91 more
