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DocumentationIdentifier: MM329095
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM329095 |
| SMILES |
C#CC(=O)NC(CF)CF
|
| InChIKey |
BZQUIMJNYJUWJU-UHFFFAOYSA-N
|
| MW [Da] |
147.12
Automatically obtained from RDkit software. |
| LogP |
0.04
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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MM42935
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Similarity to MM42935
| Tanimoto metric | 0.902 |
|---|---|
| Cosine metric | 0.9497 |
| Dice metric | 0.9485 |
| MW: | 129.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM264783
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Similarity to MM264783
| Tanimoto metric | 0.7541 |
|---|---|
| Cosine metric | 0.8608 |
| Dice metric | 0.8598 |
| MW: | 143.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM149936
Similarity: 0.7353
Similarity to MM149936
| Tanimoto metric | 0.7353 |
|---|---|
| Cosine metric | 0.8575 |
| Dice metric | 0.8475 |
| MW: | 137.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.43 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+198 more
