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DocumentationIdentifier: MM372454
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM372454 |
| SMILES |
C=C(CCC)C(=C)C(C)O
|
| InChIKey |
KEQWZQPPGFXKDK-UHFFFAOYSA-N
|
| MW [Da] |
140.23
Automatically obtained from RDkit software. |
| LogP |
2.28
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM398164
Similarity: 0.848
Similarity to MM398164
| Tanimoto metric | 0.848 |
|---|---|
| Cosine metric | 0.9182 |
| Dice metric | 0.9177 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM372046
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| Tanimoto metric | 0.8393 |
|---|---|
| Cosine metric | 0.9161 |
| Dice metric | 0.9126 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.89 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM343614
Similarity: 0.784
Similarity to MM343614
| Tanimoto metric | 0.784 |
|---|---|
| Cosine metric | 0.8789 |
| Dice metric | 0.8789 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.86 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+329 more
