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DocumentationIdentifier: MM376531
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM376531 |
| SMILES |
N#CC(NC=O)C(F)CF
|
| InChIKey |
MIMUGXVAVUZJPM-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
MM52186
Similarity: 0.75
Similarity to MM52186
| Tanimoto metric | 0.75 |
|---|---|
| Cosine metric | 0.866 |
| Dice metric | 0.8571 |
| MW: | 130.12 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.02 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM376826
Similarity: 0.6236
Similarity to MM376826
| Tanimoto metric | 0.6236 |
|---|---|
| Cosine metric | 0.7684 |
| Dice metric | 0.7682 |
| MW: | 141.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.51 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM232042
Similarity: 0.6
Similarity to MM232042
| Tanimoto metric | 0.6 |
|---|---|
| Cosine metric | 0.75 |
| Dice metric | 0.75 |
| MW: | 144.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.37 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+60 more
