Identifier: MM26163
2D Structure
3D Structure
Source:
General | |
Identifier | MM26163 |
SMILES |
CC(CF)CC=O
|
InChIKey |
CNBMELBLQLSBFG-UHFFFAOYSA-N
|
MW [Da] |
104.12
Automatically obtained from RDkit software. |
LogP |
1.18
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
4-fluoro-3-(fluoromethyl)butanal
Similarity: 0.8182
Similarity to 4-fluoro-3-(fluoromethyl)butanal
Tanimoto metric | 0.8182 |
---|---|
Cosine metric | 0.9045 |
Dice metric | 0.9 |
MW: | 122.11 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 1.13 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM115951
Similarity: 0.75
Similarity to MM115951
Tanimoto metric | 0.75 |
---|---|
Cosine metric | 0.866 |
Dice metric | 0.8571 |
MW: | 118.15 |
||||
---|---|---|---|---|---|
PI: | 3
Total passive interactions
|
LogP: | 1.57 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM35360
Similarity: 0.72
Similarity to MM35360
Tanimoto metric | 0.72 |
---|---|
Cosine metric | 0.8485 |
Dice metric | 0.8372 |
MW: | 118.15 |
||||
---|---|---|---|---|---|
PI: | 1
Total passive interactions
|
LogP: | 1.43 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+371 more