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DocumentationIdentifier: MM244426
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM244426 |
| SMILES |
CC(C)C(C)(C=O)C(=N)N
|
| InChIKey |
YETYJTSYFKOKDK-UHFFFAOYSA-N
|
| MW [Da] |
142.2
Automatically obtained from RDkit software. |
| LogP |
0.78
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM181030
Similarity: 0.7364
Similarity to MM181030
| Tanimoto metric | 0.7364 |
|---|---|
| Cosine metric | 0.8582 |
| Dice metric | 0.8482 |
| MW: | 128.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.39 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM220796
Similarity: 0.7113
Similarity to MM220796
| Tanimoto metric | 0.7113 |
|---|---|
| Cosine metric | 0.8329 |
| Dice metric | 0.8313 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.78 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM132902
Similarity: 0.6279
Similarity to MM132902
| Tanimoto metric | 0.6279 |
|---|---|
| Cosine metric | 0.7924 |
| Dice metric | 0.7714 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.6 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+82 more
