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DocumentationIdentifier: MM229854
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM229854 |
| SMILES |
N#CC(F)(C#N)C(F)(F)F
|
| InChIKey |
WIEFAJVAACMGRV-UHFFFAOYSA-N
|
| MW [Da] |
152.05
Automatically obtained from RDkit software. |
| LogP |
1.3
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM139946
Similarity: 0.81
Similarity to MM139946
| Tanimoto metric | 0.81 |
|---|---|
| Cosine metric | 0.9 |
| Dice metric | 0.895 |
| MW: | 134.06 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.01 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM229853
Similarity: 0.5878
Similarity to MM229853
| Tanimoto metric | 0.5878 |
|---|---|
| Cosine metric | 0.7488 |
| Dice metric | 0.7404 |
| MW: | 155.05 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.98 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM229863
Similarity: 0.5839
Similarity to MM229863
| Tanimoto metric | 0.5839 |
|---|---|
| Cosine metric | 0.746 |
| Dice metric | 0.7373 |
| MW: | 151.06 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.41 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+24 more
