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DocumentationIdentifier: MM351667
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM351667 |
| SMILES |
C=C(CCCC)C(=O)CC
|
| InChIKey |
BMYPWMYPVLZNRL-UHFFFAOYSA-N
|
| MW [Da] |
140.23
Automatically obtained from RDkit software. |
| LogP |
2.71
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM162593
Similarity: 0.8721
Similarity to MM162593
| Tanimoto metric | 0.8721 |
|---|---|
| Cosine metric | 0.9339 |
| Dice metric | 0.9317 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.32 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM351675
Similarity: 0.8387
Similarity to MM351675
| Tanimoto metric | 0.8387 |
|---|---|
| Cosine metric | 0.9123 |
| Dice metric | 0.9123 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.71 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM173590
Similarity: 0.8295
Similarity to MM173590
| Tanimoto metric | 0.8295 |
|---|---|
| Cosine metric | 0.909 |
| Dice metric | 0.9068 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.32 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
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