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DocumentationIdentifier: MM136193
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM136193 |
| SMILES |
CC(C=C(F)F)OC=O
|
| InChIKey |
AJVPBNWRGHZIAH-UHFFFAOYSA-N
|
| MW [Da] |
136.1
Automatically obtained from RDkit software. |
| LogP |
1.33
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM107562
Similarity: 0.7875
Similarity to MM107562
| Tanimoto metric | 0.7875 |
|---|---|
| Cosine metric | 0.8874 |
| Dice metric | 0.8811 |
| MW: | 118.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.03 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM273996
Similarity: 0.6957
Similarity to MM273996
| Tanimoto metric | 0.6957 |
|---|---|
| Cosine metric | 0.8341 |
| Dice metric | 0.8205 |
| MW: | 151.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.27 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM106569
Similarity: 0.6375
Similarity to MM106569
| Tanimoto metric | 0.6375 |
|---|---|
| Cosine metric | 0.7984 |
| Dice metric | 0.7786 |
| MW: | 122.07 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.94 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+126 more
