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DocumentationIdentifier: MM373198
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM373198 |
| SMILES |
CC(=O)C(CF)NCC=O
|
| InChIKey |
AVXMGAPKURCSSM-UHFFFAOYSA-N
|
| MW [Da] |
147.15
Automatically obtained from RDkit software. |
| LogP |
-0.3
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
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MM39342
Similarity: 0.7431
Similarity to MM39342
| Tanimoto metric | 0.7431 |
|---|---|
| Cosine metric | 0.8529 |
| Dice metric | 0.8526 |
| MW: | 143.16 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.14 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM304824
Similarity: 0.6948
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| Tanimoto metric | 0.6948 |
|---|---|
| Cosine metric | 0.8217 |
| Dice metric | 0.8199 |
| MW: | 151.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.82 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM383040
Similarity: 0.5882
Similarity to MM383040
| Tanimoto metric | 0.5882 |
|---|---|
| Cosine metric | 0.7407 |
| Dice metric | 0.7407 |
| MW: | 147.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+99 more
