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DocumentationIdentifier: MM355859
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM355859 |
| SMILES |
CN(C=CCO)C(=N)CO
|
| InChIKey |
YUIKNMZYWMSHAL-UHFFFAOYSA-N
|
| MW [Da] |
144.17
Automatically obtained from RDkit software. |
| LogP |
-0.61
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM355857
Similarity: 0.7426
Similarity to MM355857
| Tanimoto metric | 0.7426 |
|---|---|
| Cosine metric | 0.8525 |
| Dice metric | 0.8523 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.81 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM379721
Similarity: 0.7407
Similarity to MM379721
| Tanimoto metric | 0.7407 |
|---|---|
| Cosine metric | 0.8511 |
| Dice metric | 0.8511 |
| MW: | 140.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.94 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM81871
Similarity: 0.7246
Similarity to MM81871
| Tanimoto metric | 0.7246 |
|---|---|
| Cosine metric | 0.8406 |
| Dice metric | 0.8403 |
| MW: | 142.16 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+413 more
