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DocumentationIdentifier: MM235217
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM235217 |
| SMILES |
CC(C)(CCC=O)C(=N)N
|
| InChIKey |
LIEVZGXSJSZYJC-UHFFFAOYSA-N
|
| MW [Da] |
142.2
Automatically obtained from RDkit software. |
| LogP |
0.93
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM132660
Similarity: 0.781
Similarity to MM132660
| Tanimoto metric | 0.781 |
|---|---|
| Cosine metric | 0.8837 |
| Dice metric | 0.877 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.75 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM222143
Similarity: 0.7034
Similarity to MM222143
| Tanimoto metric | 0.7034 |
|---|---|
| Cosine metric | 0.8267 |
| Dice metric | 0.8259 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.99 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM235129
Similarity: 0.6777
Similarity to MM235129
| Tanimoto metric | 0.6777 |
|---|---|
| Cosine metric | 0.8084 |
| Dice metric | 0.8079 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.14 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+226 more
