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DocumentationIdentifier: MM255021
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM255021 |
| SMILES |
CC(N)C(=N)NCC(N)=O
|
| InChIKey |
JACFUEMFRDDIRK-UHFFFAOYSA-N
|
| MW [Da] |
144.18
Automatically obtained from RDkit software. |
| LogP |
-1.61
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM144939
Similarity: 0.72
Similarity to MM144939
| Tanimoto metric | 0.72 |
|---|---|
| Cosine metric | 0.8485 |
| Dice metric | 0.8372 |
| MW: | 129.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.55 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM144940
Similarity: 0.664
Similarity to MM144940
| Tanimoto metric | 0.664 |
|---|---|
| Cosine metric | 0.8149 |
| Dice metric | 0.7981 |
| MW: | 130.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -2 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM350471
Similarity: 0.6358
Similarity to MM350471
| Tanimoto metric | 0.6358 |
|---|---|
| Cosine metric | 0.7774 |
| Dice metric | 0.7773 |
| MW: | 143.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.64 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+96 more
