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DocumentationIdentifier: MM135167
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM135167 |
| SMILES |
CCCC(C)CC(=N)N
|
| InChIKey |
PMCDHPKCRFOFDU-UHFFFAOYSA-N
|
| MW [Da] |
128.22
Automatically obtained from RDkit software. |
| LogP |
1.75
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 | 0.9221 |
|---|---|
| Cosine metric | 0.9602 |
| Dice metric | 0.9595 |
| MW: | 143.23 |
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|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
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| LogP: | 0.69 |
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Total passive interactions
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+439 more
