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DocumentationIdentifier: MM340373
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM340373 |
| SMILES |
C=C(C)CCC(CC)CC
|
| InChIKey |
MVQBCULUUVGZKR-UHFFFAOYSA-N
|
| MW [Da] |
140.27
Automatically obtained from RDkit software. |
| LogP |
3.78
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM144217
Similarity: 0.9298
Similarity to MM144217
| Tanimoto metric | 0.9298 |
|---|---|
| Cosine metric | 0.9643 |
| Dice metric | 0.9636 |
| MW: | 126.24 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3.39 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM316245
Similarity: 0.791
Similarity to MM316245
| Tanimoto metric | 0.791 |
|---|---|
| Cosine metric | 0.8844 |
| Dice metric | 0.8833 |
| MW: | 140.27 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3.78 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM162116
Similarity: 0.75
Similarity to MM162116
| Tanimoto metric | 0.75 |
|---|---|
| Cosine metric | 0.8579 |
| Dice metric | 0.8571 |
| MW: | 126.24 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3.39 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
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