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DocumentationIdentifier: MM335844
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM335844 |
| SMILES |
C=CN(C=O)C=C(F)CC
|
| InChIKey |
GCEFFOXMQOSLRP-UHFFFAOYSA-N
|
| MW [Da] |
143.16
Automatically obtained from RDkit software. |
| LogP |
1.81
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM143485
Similarity: 0.7778
Similarity to MM143485
| Tanimoto metric | 0.7778 |
|---|---|
| Cosine metric | 0.8819 |
| Dice metric | 0.875 |
| MW: | 131.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM150698
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| Tanimoto metric | 0.7521 |
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| Cosine metric | 0.8673 |
| Dice metric | 0.8585 |
| MW: | 129.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.42 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM267535
Similarity: 0.6842
Similarity to MM267535
| Tanimoto metric | 0.6842 |
|---|---|
| Cosine metric | 0.8133 |
| Dice metric | 0.8125 |
| MW: | 143.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.46 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+114 more
