Identifier: MM165953
2D Structure
3D Structure
Source:
General | |
Identifier | MM165953 |
SMILES |
CCOCCC(F)C=O
|
InChIKey |
JUHLSUQFUXYPQQ-UHFFFAOYSA-N
|
MW [Da] |
134.15
Automatically obtained from RDkit software. |
LogP |
0.95
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
2-fluoro-4-methoxybutanal
Similarity: 0.8472
Similarity to 2-fluoro-4-methoxybutanal
Tanimoto metric | 0.8472 |
---|---|
Cosine metric | 0.9204 |
Dice metric | 0.9173 |
MW: | 120.12 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 0.56 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM166100
Similarity: 0.7093
Similarity to MM166100
Tanimoto metric | 0.7093 |
---|---|
Cosine metric | 0.8301 |
Dice metric | 0.8299 |
MW: | 134.11 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 0.09 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM239641
Similarity: 0.7059
Similarity to MM239641
Tanimoto metric | 0.7059 |
---|---|
Cosine metric | 0.8402 |
Dice metric | 0.8276 |
MW: | 148.18 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 1.34 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+358 more