Identifier: MM97950
2D Structure
3D Structure
Source:
General | |
Identifier | MM97950 |
SMILES |
O=CC(F)CCO
|
InChIKey |
VTBQTGKEQWKCFX-UHFFFAOYSA-N
|
MW [Da] |
106.1
Automatically obtained from RDkit software. |
LogP |
-0.09
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: 0.7541
Similarity to 2-fluoro-4-methoxybutanal
Tanimoto metric | 0.7541 |
---|---|
Cosine metric | 0.8684 |
Dice metric | 0.8598 |
MW: | 120.12 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 0.56 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM111548
Similarity: 0.6765
Similarity to MM111548
Tanimoto metric | 0.6765 |
---|---|
Cosine metric | 0.8225 |
Dice metric | 0.807 |
MW: | 120.12 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 0.15 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM28544
Similarity: 0.6571
Similarity to MM28544
Tanimoto metric | 0.6571 |
---|---|
Cosine metric | 0.8106 |
Dice metric | 0.7931 |
MW: | 120.12 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 0.3 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+332 more