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DocumentationIdentifier: MM199941
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM199941 |
| SMILES |
O=COCC(=CF)CF
|
| InChIKey |
SGKRFJMZNZSJQD-UHFFFAOYSA-N
|
| MW [Da] |
136.1
Automatically obtained from RDkit software. |
| LogP |
0.98
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM113879
Similarity: 0.7079
Similarity to MM113879
| Tanimoto metric | 0.7079 |
|---|---|
| Cosine metric | 0.8413 |
| Dice metric | 0.8289 |
| MW: | 118.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.03 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM199938
Similarity: 0.6214
Similarity to MM199938
| Tanimoto metric | 0.6214 |
|---|---|
| Cosine metric | 0.7681 |
| Dice metric | 0.7665 |
| MW: | 134.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.01 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM414856
Similarity: 0.6054
Similarity to MM414856
| Tanimoto metric | 0.6054 |
|---|---|
| Cosine metric | 0.7781 |
| Dice metric | 0.7542 |
| MW: | 150.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.37 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+148 more
