2,2-difluoro-3-oxobutanal
2D Structure
3D Structure
Source:
General | |
Identifier | MM02193 |
SMILES |
CC(=O)C(F)(F)C=O
|
InChIKey |
NSIFGFWJJQVOBE-UHFFFAOYSA-N
|
MW [Da] |
122.07
Automatically obtained from RDkit software. |
LogP |
0.41
Automatically obtained from RDkit software. |
Links | |
PubChem |
54127989
|
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
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Tanimoto metric | 0.7353 |
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Cosine metric | 0.8575 |
Dice metric | 0.8475 |
MW: | 108.09 |
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PI: | 3
Total passive interactions
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LogP: | 1.23 |
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AI: | 0
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Cosine metric | 0.8373 |
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Cosine metric | 0.8235 |
Dice metric | 0.8235 |
MW: | 122.11 |
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Total passive interactions
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LogP: | 1.62 |
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+44 more