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DocumentationIdentifier: MM180855
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM180855 |
| SMILES |
CC(C)=C(CF)NC=O
|
| InChIKey |
ZEAJXJCMADKWEK-UHFFFAOYSA-N
|
| MW [Da] |
131.15
Automatically obtained from RDkit software. |
| LogP |
1
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM276257
Similarity: 0.708
Similarity to MM276257
| Tanimoto metric | 0.708 |
|---|---|
| Cosine metric | 0.8414 |
| Dice metric | 0.8291 |
| MW: | 145.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.39 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM385132
Similarity: 0.6879
Similarity to MM385132
| Tanimoto metric | 0.6879 |
|---|---|
| Cosine metric | 0.8294 |
| Dice metric | 0.8151 |
| MW: | 141.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.61 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM385062
Similarity: 0.6879
Similarity to MM385062
| Tanimoto metric | 0.6879 |
|---|---|
| Cosine metric | 0.8294 |
| Dice metric | 0.8151 |
| MW: | 145.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+321 more
