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DocumentationIdentifier: MM312633
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM312633 |
| SMILES |
N#CC(CF)(CF)NC=O
|
| InChIKey |
VVVAOYXKMCJFNS-UHFFFAOYSA-N
|
| MW [Da] |
148.11
Automatically obtained from RDkit software. |
| LogP |
-0.07
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM312880
Similarity: 0.7252
Similarity to MM312880
| Tanimoto metric | 0.7252 |
|---|---|
| Cosine metric | 0.8407 |
| Dice metric | 0.8407 |
| MW: | 141.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.51 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM243747
Similarity: 0.6621
Similarity to MM243747
| Tanimoto metric | 0.6621 |
|---|---|
| Cosine metric | 0.7982 |
| Dice metric | 0.7967 |
| MW: | 148.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM229409
Similarity: 0.625
Similarity to MM229409
| Tanimoto metric | 0.625 |
|---|---|
| Cosine metric | 0.772 |
| Dice metric | 0.7692 |
| MW: | 144.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.37 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+118 more
