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DocumentationIdentifier: MM320276
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM320276 |
| SMILES |
C#CC(F)C(F)(C#N)C#N
|
| InChIKey |
IHTHRHSUZYHYDI-UHFFFAOYSA-N
|
| MW [Da] |
140.09
Automatically obtained from RDkit software. |
| LogP |
0.71
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM306751
Similarity: 0.6724
Similarity to MM306751
| Tanimoto metric | 0.6724 |
|---|---|
| Cosine metric | 0.8062 |
| Dice metric | 0.8041 |
| MW: | 139.1 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.82 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM306738
Similarity: 0.6497
Similarity to MM306738
| Tanimoto metric | 0.6497 |
|---|---|
| Cosine metric | 0.7899 |
| Dice metric | 0.7877 |
| MW: | 140.09 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.71 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM320246
Similarity: 0.6118
Similarity to MM320246
| Tanimoto metric | 0.6118 |
|---|---|
| Cosine metric | 0.7632 |
| Dice metric | 0.7592 |
| MW: | 141.08 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.6 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+22 more
