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DocumentationIdentifier: MM298694
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM298694 |
| SMILES |
C=CC(CC)C(=C)C(=C)C
|
| InChIKey |
YVZUUALFCIZYFL-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
MM254132
Similarity: 0.8305
Similarity to MM254132
| Tanimoto metric | 0.8305 |
|---|---|
| Cosine metric | 0.9076 |
| Dice metric | 0.9074 |
| MW: | 136.24 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.33 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM298624
Similarity: 0.787
Similarity to MM298624
| Tanimoto metric | 0.787 |
|---|---|
| Cosine metric | 0.8851 |
| Dice metric | 0.8808 |
| MW: | 138.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.55 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM161040
Similarity: 0.7736
Similarity to MM161040
| Tanimoto metric | 0.7736 |
|---|---|
| Cosine metric | 0.8795 |
| Dice metric | 0.8723 |
| MW: | 122.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.94 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+211 more
