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DocumentationIdentifier: MM324783
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM324783 |
| SMILES |
C=CC(F)=CCN(C)C=O
|
| InChIKey |
WCWSOFZWWQIZDO-UHFFFAOYSA-N
|
| MW [Da] |
143.16
Automatically obtained from RDkit software. |
| LogP |
1.11
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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MM146351
Similarity: 0.81
Similarity to MM146351
| Tanimoto metric | 0.81 |
|---|---|
| Cosine metric | 0.9 |
| Dice metric | 0.895 |
| MW: | 131.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.95 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM345975
Similarity: 0.675
Similarity to MM345975
| Tanimoto metric | 0.675 |
|---|---|
| Cosine metric | 0.806 |
| Dice metric | 0.806 |
| MW: | 145.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.34 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM324676
Similarity: 0.6585
Similarity to MM324676
| Tanimoto metric | 0.6585 |
|---|---|
| Cosine metric | 0.7943 |
| Dice metric | 0.7941 |
| MW: | 145.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.34 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+199 more
