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DocumentationIdentifier: MM292264
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM292264 |
| SMILES |
C=CCC(=C)CCOC=O
|
| InChIKey |
YCSYHVNEBLEENH-UHFFFAOYSA-N
|
| MW [Da] |
140.18
Automatically obtained from RDkit software. |
| LogP |
1.68
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM166612
Similarity: 0.8214
Similarity to MM166612
| Tanimoto metric | 0.8214 |
|---|---|
| Cosine metric | 0.9063 |
| Dice metric | 0.902 |
| MW: | 128.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.52 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM69589
Similarity: 0.6635
Similarity to MM69589
| Tanimoto metric | 0.6635 |
|---|---|
| Cosine metric | 0.798 |
| Dice metric | 0.7977 |
| MW: | 142.15 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.69 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM291882
Similarity: 0.6635
Similarity to MM291882
| Tanimoto metric | 0.6635 |
|---|---|
| Cosine metric | 0.798 |
| Dice metric | 0.7977 |
| MW: | 143.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.45 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+163 more
