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DocumentationIdentifier: MM228886
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM228886 |
| SMILES |
N#CC(F)(F)C(F)(F)C=O
|
| InChIKey |
YHJSQFIYKUFKNZ-UHFFFAOYSA-N
|
| MW [Da] |
155.05
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
MM131037
Similarity: 0.6489
Similarity to MM131037
| Tanimoto metric | 0.6489 |
|---|---|
| Cosine metric | 0.8055 |
| Dice metric | 0.787 |
| MW: | 141.07 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.8 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM228887
Similarity: 0.6115
Similarity to MM228887
| Tanimoto metric | 0.6115 |
|---|---|
| Cosine metric | 0.7701 |
| Dice metric | 0.7589 |
| MW: | 152.05 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM228885
Similarity: 0.6115
Similarity to MM228885
| Tanimoto metric | 0.6115 |
|---|---|
| Cosine metric | 0.7701 |
| Dice metric | 0.7589 |
| MW: | 158.05 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.65 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+24 more
