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DocumentationIdentifier: MM28518
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM28518 |
| SMILES |
CC(C)(CF)NC=O
|
| InChIKey |
TZACTCDWFSNPGU-UHFFFAOYSA-N
|
| MW [Da] |
119.14
Automatically obtained from RDkit software. |
| LogP |
0.48
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM26186
Similarity: 0.7414
Similarity to MM26186
| Tanimoto metric | 0.7414 |
|---|---|
| Cosine metric | 0.861 |
| Dice metric | 0.8515 |
| MW: | 105.11 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM40087
Similarity: 0.6824
Similarity to MM40087
| Tanimoto metric | 0.6824 |
|---|---|
| Cosine metric | 0.826 |
| Dice metric | 0.8112 |
| MW: | 133.17 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.87 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM139292
Similarity: 0.6304
Similarity to MM139292
| Tanimoto metric | 0.6304 |
|---|---|
| Cosine metric | 0.794 |
| Dice metric | 0.7733 |
| MW: | 133.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.87 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+147 more
