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DocumentationIdentifier: MM263920
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM263920 |
| SMILES |
NC(=O)C=CC(F)F
|
| InChIKey |
OBUMROKBNQHUBJ-UHFFFAOYSA-N
|
| MW [Da] |
121.09
Automatically obtained from RDkit software. |
| LogP |
0.29
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 | 0.8429 |
|---|---|
| Cosine metric | 0.9181 |
| Dice metric | 0.9147 |
| MW: | 139.08 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.59 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
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| LogP: | 0.55 |
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Total active interactions
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|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
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| LogP: | 0.68 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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