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DocumentationIdentifier: MM160850
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM160850 |
| SMILES |
C=CC(C)C(=C)C(C)C
|
| InChIKey |
RGUAKBSSGBMTGZ-UHFFFAOYSA-N
|
| MW [Da] |
124.23
Automatically obtained from RDkit software. |
| LogP |
3.02
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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| Tanimoto metric | 0.8525 |
|---|---|
| Cosine metric | 0.9233 |
| Dice metric | 0.9204 |
| MW: | 110.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
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| LogP: | 2.77 |
||||
|---|---|---|---|---|---|
| AI: | 0
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Total passive interactions
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Total passive interactions
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| LogP: | 3.41 |
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