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DocumentationIdentifier: MM337547
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM337547 |
| SMILES |
C=CC(=CC(C)C=C)CC
|
| InChIKey |
SRNWDZAUCDMMMU-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 |
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MM150858
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| Tanimoto metric | 0.7805 |
|---|---|
| Cosine metric | 0.8835 |
| Dice metric | 0.8767 |
| MW: | 124.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM274418
Similarity: 0.7609
Similarity to MM274418
| Tanimoto metric | 0.7609 |
|---|---|
| Cosine metric | 0.8643 |
| Dice metric | 0.8642 |
| MW: | 136.24 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.33 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM335563
Similarity: 0.7447
Similarity to MM335563
| Tanimoto metric | 0.7447 |
|---|---|
| Cosine metric | 0.8537 |
| Dice metric | 0.8537 |
| MW: | 136.24 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.33 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
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