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DocumentationIdentifier: MM298847
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM298847 |
| SMILES |
C=CCC(=C)C(=C)C(C)C
|
| InChIKey |
ANLLQVXMGIYTHH-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
MM352124
Similarity: 0.8431
Similarity to MM352124
| Tanimoto metric | 0.8431 |
|---|---|
| Cosine metric | 0.9168 |
| Dice metric | 0.9149 |
| MW: | 136.24 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.33 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM161140
Similarity: 0.75
Similarity to MM161140
| Tanimoto metric | 0.75 |
|---|---|
| Cosine metric | 0.866 |
| Dice metric | 0.8571 |
| MW: | 124.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM254202
Similarity: 0.7333
Similarity to MM254202
| Tanimoto metric | 0.7333 |
|---|---|
| Cosine metric | 0.8532 |
| Dice metric | 0.8462 |
| MW: | 138.25 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3.41 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+490 more
