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DocumentationIdentifier: MM293234
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM293234 |
| SMILES |
C=CCC(C)C(=C)CCC
|
| InChIKey |
LYYBRTYRZBOYME-UHFFFAOYSA-N
|
| MW [Da] |
138.25
Automatically obtained from RDkit software. |
| LogP |
3.55
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM245575
Similarity: 0.8556
Similarity to MM245575
| Tanimoto metric | 0.8556 |
|---|---|
| Cosine metric | 0.923 |
| Dice metric | 0.9222 |
| MW: | 138.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.55 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM172495
Similarity: 0.85
Similarity to MM172495
| Tanimoto metric | 0.85 |
|---|---|
| Cosine metric | 0.922 |
| Dice metric | 0.9189 |
| MW: | 124.23 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM348777
Similarity: 0.7882
Similarity to MM348777
| Tanimoto metric | 0.7882 |
|---|---|
| Cosine metric | 0.8828 |
| Dice metric | 0.8816 |
| MW: | 140.27 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.78 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+358 more
