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DocumentationIdentifier: MM234916
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM234916 |
| SMILES |
C=CC(=O)C(C)(O)C(=N)N
|
| InChIKey |
MMKITTJYRJLLON-UHFFFAOYSA-N
|
| MW [Da] |
142.16
Automatically obtained from RDkit software. |
| LogP |
-0.57
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM160692
Similarity: 0.6435
Similarity to MM160692
| Tanimoto metric | 0.6435 |
|---|---|
| Cosine metric | 0.8022 |
| Dice metric | 0.7831 |
| MW: | 128.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.96 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM234870
Similarity: 0.6113
Similarity to MM234870
| Tanimoto metric | 0.6113 |
|---|---|
| Cosine metric | 0.7588 |
| Dice metric | 0.7588 |
| MW: | 146.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.77 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM72094
Similarity: 0.574
Similarity to MM72094
| Tanimoto metric | 0.574 |
|---|---|
| Cosine metric | 0.7294 |
| Dice metric | 0.7294 |
| MW: | 140.14 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -1.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+14 more
