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DocumentationIdentifier: MM343927
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM343927 |
| SMILES |
CCN(C=O)C=CC(=N)N
|
| InChIKey |
AYBFHKLAYMHPFE-UHFFFAOYSA-N
|
| MW [Da] |
141.17
Automatically obtained from RDkit software. |
| LogP |
-0.09
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM145622
Similarity: 0.7407
Similarity to MM145622
| Tanimoto metric | 0.7407 |
|---|---|
| Cosine metric | 0.8607 |
| Dice metric | 0.8511 |
| MW: | 127.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM321925
Similarity: 0.656
Similarity to MM321925
| Tanimoto metric | 0.656 |
|---|---|
| Cosine metric | 0.793 |
| Dice metric | 0.7923 |
| MW: | 141.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.22 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM41192
Similarity: 0.632
Similarity to MM41192
| Tanimoto metric | 0.632 |
|---|---|
| Cosine metric | 0.7759 |
| Dice metric | 0.7745 |
| MW: | 141.17 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.08 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+152 more
