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DocumentationIdentifier: MM293382
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM293382 |
| SMILES |
C=CCC=CC(=O)C(=C)C
|
| InChIKey |
JXSXJIMANLDFQC-UHFFFAOYSA-N
|
| MW [Da] |
136.19
Automatically obtained from RDkit software. |
| LogP |
2.26
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM163421
Similarity: 0.9091
Similarity to MM163421
| Tanimoto metric | 0.9091 |
|---|---|
| Cosine metric | 0.9535 |
| Dice metric | 0.9524 |
| MW: | 124.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM293332
Similarity: 0.8723
Similarity to MM293332
| Tanimoto metric | 0.8723 |
|---|---|
| Cosine metric | 0.9318 |
| Dice metric | 0.9318 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.49 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM255651
Similarity: 0.8155
Similarity to MM255651
| Tanimoto metric | 0.8155 |
|---|---|
| Cosine metric | 0.9 |
| Dice metric | 0.8984 |
| MW: | 138.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+343 more
