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DocumentationIdentifier: MM213224
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM213224 |
| SMILES |
CC=COCCNCC
|
| InChIKey |
YXXZZQPFFSNURK-UHFFFAOYSA-N
|
| MW [Da] |
129.2
Automatically obtained from RDkit software. |
| LogP |
1.15
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 | 0.875 |
|---|---|
| Cosine metric | 0.9354 |
| Dice metric | 0.9333 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
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| LogP: | 0.08 |
||||
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| AI: | 0
Total active interactions
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Total passive interactions
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Total passive interactions
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