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DocumentationIdentifier: MM235551
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM235551 |
| SMILES |
CC(F)C(C)(F)C#CC#N
|
| InChIKey |
ADRIJOLTXZVQTR-UHFFFAOYSA-N
|
| MW [Da] |
143.14
Automatically obtained from RDkit software. |
| LogP |
1.6
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM311755
Similarity: 0.7823
Similarity to MM311755
| Tanimoto metric | 0.7823 |
|---|---|
| Cosine metric | 0.8783 |
| Dice metric | 0.8779 |
| MW: | 143.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.6 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM231719
Similarity: 0.726
Similarity to MM231719
| Tanimoto metric | 0.726 |
|---|---|
| Cosine metric | 0.8434 |
| Dice metric | 0.8413 |
| MW: | 143.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.6 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM139033
Similarity: 0.6444
Similarity to MM139033
| Tanimoto metric | 0.6444 |
|---|---|
| Cosine metric | 0.8028 |
| Dice metric | 0.7838 |
| MW: | 125.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.65 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+100 more
