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DocumentationIdentifier: MM301638
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM301638 |
| SMILES |
CC(CCCC=O)C(=N)N
|
| InChIKey |
XAHVSOOCUDBQOM-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
MM162123
Similarity: 0.8065
Similarity to MM162123
| Tanimoto metric | 0.8065 |
|---|---|
| Cosine metric | 0.898 |
| Dice metric | 0.8929 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.75 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM254653
Similarity: 0.7653
Similarity to MM254653
| Tanimoto metric | 0.7653 |
|---|---|
| Cosine metric | 0.8695 |
| Dice metric | 0.8671 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.99 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM245132
Similarity: 0.6909
Similarity to MM245132
| Tanimoto metric | 0.6909 |
|---|---|
| Cosine metric | 0.8172 |
| Dice metric | 0.8172 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.99 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+381 more
