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DocumentationIdentifier: MM305336
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM305336 |
| SMILES |
C=COC(CCO)C(N)=O
|
| InChIKey |
JHWNSRMCOYFQPI-UHFFFAOYSA-N
|
| MW [Da] |
145.16
Automatically obtained from RDkit software. |
| LogP |
-0.62
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM179823
Similarity: 0.7956
Similarity to MM179823
| Tanimoto metric | 0.7956 |
|---|---|
| Cosine metric | 0.892 |
| Dice metric | 0.8862 |
| MW: | 133.15 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM305233
Similarity: 0.679
Similarity to MM305233
| Tanimoto metric | 0.679 |
|---|---|
| Cosine metric | 0.8088 |
| Dice metric | 0.8088 |
| MW: | 147.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.74 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM305338
Similarity: 0.6706
Similarity to MM305338
| Tanimoto metric | 0.6706 |
|---|---|
| Cosine metric | 0.8033 |
| Dice metric | 0.8028 |
| MW: | 147.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.36 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+123 more
