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DocumentationN-(2-methylpentan-3-ylidene)hydroxylamine
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM01582 |
| SMILES |
CCC(=NO)C(C)C
|
| InChIKey |
MNKQRNPROVRGKF-UHFFFAOYSA-N
|
| MW [Da] |
115.18
Automatically obtained from RDkit software. |
| LogP |
1.88
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
72733907
|
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
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| Tanimoto metric | 0.9286 |
|---|---|
| Cosine metric | 0.9636 |
| Dice metric | 0.963 |
| MW: | 129.2 |
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| PI: | 3
Total passive interactions
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| LogP: | 2.13 |
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| AI: | 0
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| Tanimoto metric | 0.7692 |
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| Cosine metric | 0.8771 |
| Dice metric | 0.8696 |
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| LogP: | 1.49 |
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Total passive interactions
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