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DocumentationIdentifier: MM225752
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM225752 |
| SMILES |
CC(F)(C#N)C(=O)C(F)F
|
| InChIKey |
CBHFEBMYMHNQCA-UHFFFAOYSA-N
|
| MW [Da] |
151.09
Automatically obtained from RDkit software. |
| LogP |
1.07
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM307317
Similarity: 0.7052
Similarity to MM307317
| Tanimoto metric | 0.7052 |
|---|---|
| Cosine metric | 0.8282 |
| Dice metric | 0.8271 |
| MW: | 144.08 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM223922
Similarity: 0.5886
Similarity to MM223922
| Tanimoto metric | 0.5886 |
|---|---|
| Cosine metric | 0.746 |
| Dice metric | 0.741 |
| MW: | 155.05 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.98 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM307401
Similarity: 0.5701
Similarity to MM307401
| Tanimoto metric | 0.5701 |
|---|---|
| Cosine metric | 0.7304 |
| Dice metric | 0.7262 |
| MW: | 143.09 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.39 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+42 more
