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DocumentationIdentifier: MM254219
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM254219 |
| SMILES |
C=C(C)C(=C)C(=C)C(C)C
|
| InChIKey |
VYWYXYKLXXSFQI-UHFFFAOYSA-N
|
| MW [Da] |
136.24
Automatically obtained from RDkit software. |
| LogP |
3.33
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM161219
Similarity: 0.75
Similarity to MM161219
| Tanimoto metric | 0.75 |
|---|---|
| Cosine metric | 0.866 |
| Dice metric | 0.8571 |
| MW: | 122.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.94 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM269613
Similarity: 0.7255
Similarity to MM269613
| Tanimoto metric | 0.7255 |
|---|---|
| Cosine metric | 0.8444 |
| Dice metric | 0.8409 |
| MW: | 136.24 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.33 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM351975
Similarity: 0.7193
Similarity to MM351975
| Tanimoto metric | 0.7193 |
|---|---|
| Cosine metric | 0.8369 |
| Dice metric | 0.8367 |
| MW: | 136.24 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.33 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+213 more
