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DocumentationIdentifier: MM293215
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM293215 |
| SMILES |
CC(C)C(=O)C=CCC=O
|
| InChIKey |
INXHCUHCLOOYBR-UHFFFAOYSA-N
|
| MW [Da] |
140.18
Automatically obtained from RDkit software. |
| LogP |
1.36
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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MM163359
Similarity: 0.8816
Similarity to MM163359
| Tanimoto metric | 0.8816 |
|---|---|
| Cosine metric | 0.9389 |
| Dice metric | 0.9371 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.18 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM293139
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| Tanimoto metric | 0.8625 |
|---|---|
| Cosine metric | 0.9264 |
| Dice metric | 0.9262 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.57 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM255572
Similarity: 0.7976
Similarity to MM255572
| Tanimoto metric | 0.7976 |
|---|---|
| Cosine metric | 0.8874 |
| Dice metric | 0.8874 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.42 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
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