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DocumentationIdentifier: MM149936
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM149936 |
| SMILES |
CC(=O)NC(CF)CF
|
| InChIKey |
NREOLNJAGPMNQV-UHFFFAOYSA-N
|
| MW [Da] |
137.13
Automatically obtained from RDkit software. |
| LogP |
0.43
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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| Tanimoto metric | 0.7353 |
|---|---|
| Cosine metric | 0.8575 |
| Dice metric | 0.8475 |
| MW: | 147.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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| Cosine metric | 0.8141 |
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||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
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| LogP: | 0.87 |
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| AI: | 0
Total active interactions
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| Cosine metric | 0.7825 |
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|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
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| LogP: | 0.09 |
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|---|---|---|---|---|---|
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Total active interactions
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+400 more
