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DocumentationIdentifier: MM293384
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM293384 |
| SMILES |
C=C(C)C(=O)C=CCC=O
|
| InChIKey |
BBKYGACNESFIAM-UHFFFAOYSA-N
|
| MW [Da] |
138.17
Automatically obtained from RDkit software. |
| LogP |
1.28
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM163421
Similarity: 0.8791
Similarity to MM163421
| Tanimoto metric | 0.8791 |
|---|---|
| Cosine metric | 0.9376 |
| Dice metric | 0.9357 |
| MW: | 124.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM293332
Similarity: 0.8454
Similarity to MM293332
| Tanimoto metric | 0.8454 |
|---|---|
| Cosine metric | 0.9163 |
| Dice metric | 0.9162 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.49 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM293382
Similarity: 0.8081
Similarity to MM293382
| Tanimoto metric | 0.8081 |
|---|---|
| Cosine metric | 0.894 |
| Dice metric | 0.8939 |
| MW: | 136.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.26 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+345 more
