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DocumentationIdentifier: MM239067
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM239067 |
| SMILES |
C#CC(F)(F)C(C#N)C#N
|
| InChIKey |
RVEUUMONUGVOCF-UHFFFAOYSA-N
|
| MW [Da] |
140.09
Automatically obtained from RDkit software. |
| LogP |
0.92
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM16030
Similarity: 0.7105
Similarity to MM16030
| Tanimoto metric | 0.7105 |
|---|---|
| Cosine metric | 0.8429 |
| Dice metric | 0.8308 |
| MW: | 122.1 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.62 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM233615
Similarity: 0.7092
Similarity to MM233615
| Tanimoto metric | 0.7092 |
|---|---|
| Cosine metric | 0.8311 |
| Dice metric | 0.8299 |
| MW: | 143.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.8 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM01829
Similarity: 0.6754
Similarity to MM01829
| Tanimoto metric | 0.6754 |
|---|---|
| Cosine metric | 0.8219 |
| Dice metric | 0.8063 |
| MW: | 130.1 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 1.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+91 more
