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DocumentationIdentifier: MM376823
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM376823 |
| SMILES |
C=CC(F)C(C=O)NC=O
|
| InChIKey |
ICVVBNAZNPLEKT-UHFFFAOYSA-N
|
| MW [Da] |
145.13
Automatically obtained from RDkit software. |
| LogP |
-0.18
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 | 0.7133 |
|---|---|
| Cosine metric | 0.8446 |
| Dice metric | 0.8327 |
| MW: | 131.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.65 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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| PI: | 2
Total passive interactions
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| LogP: | 0.05 |
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Total active interactions
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MM272535
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| Tanimoto metric | 0.5 |
|---|---|
| Cosine metric | 0.668 |
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| MW: | 145.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
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| LogP: | 0.17 |
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Total active interactions
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+24 more
