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DocumentationIdentifier: MM354954
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM354954 |
| SMILES |
C=CC(=O)C(C)=C(C)CC
|
| InChIKey |
MZZUHNOGJFKRIB-UHFFFAOYSA-N
|
| MW [Da] |
138.21
Automatically obtained from RDkit software. |
| LogP |
2.49
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM175582
Similarity: 0.8036
Similarity to MM175582
| Tanimoto metric | 0.8036 |
|---|---|
| Cosine metric | 0.8964 |
| Dice metric | 0.8911 |
| MW: | 124.18 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM360901
Similarity: 0.7583
Similarity to MM360901
| Tanimoto metric | 0.7583 |
|---|---|
| Cosine metric | 0.8642 |
| Dice metric | 0.8626 |
| MW: | 136.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.26 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM355044
Similarity: 0.7442
Similarity to MM355044
| Tanimoto metric | 0.7442 |
|---|---|
| Cosine metric | 0.8533 |
| Dice metric | 0.8533 |
| MW: | 138.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+341 more
