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DocumentationIdentifier: MM349498
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM349498 |
| SMILES |
N#CC(F)C(F)C(=O)CF
|
| InChIKey |
PBKPEMOFRRZBIK-UHFFFAOYSA-N
|
| MW [Da] |
151.09
Automatically obtained from RDkit software. |
| LogP |
0.72
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM172527
Similarity: 0.6395
Similarity to MM172527
| Tanimoto metric | 0.6395 |
|---|---|
| Cosine metric | 0.7997 |
| Dice metric | 0.7801 |
| MW: | 133.1 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.78 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM246114
Similarity: 0.5858
Similarity to MM246114
| Tanimoto metric | 0.5858 |
|---|---|
| Cosine metric | 0.7423 |
| Dice metric | 0.7388 |
| MW: | 147.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM349817
Similarity: 0.5825
Similarity to MM349817
| Tanimoto metric | 0.5825 |
|---|---|
| Cosine metric | 0.7368 |
| Dice metric | 0.7362 |
| MW: | 143.09 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.39 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+45 more
