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DocumentationIdentifier: MM201574
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM201574 |
| SMILES |
CCOC=C(CC)CC
|
| InChIKey |
YJLBVUBIBTZSPZ-UHFFFAOYSA-N
|
| MW [Da] |
128.22
Automatically obtained from RDkit software. |
| LogP |
2.73
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 | 0.8644 |
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| Cosine metric | 0.9297 |
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| PI: | 3
Total passive interactions
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| LogP: | 2.34 |
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| AI: | 0
Total active interactions
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Total passive interactions
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| LogP: | 2.89 |
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