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DocumentationIdentifier: MM393088
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM393088 |
| SMILES |
COC(CNC=O)C(N)=O
|
| InChIKey |
DBZKZZVIHUOPMA-UHFFFAOYSA-N
|
| MW [Da] |
146.15
Automatically obtained from RDkit software. |
| LogP |
-1.77
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM179825
Similarity: 0.8254
Similarity to MM179825
| Tanimoto metric | 0.8254 |
|---|---|
| Cosine metric | 0.9085 |
| Dice metric | 0.9043 |
| MW: | 132.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM162272
Similarity: 0.7302
Similarity to MM162272
| Tanimoto metric | 0.7302 |
|---|---|
| Cosine metric | 0.8545 |
| Dice metric | 0.844 |
| MW: | 132.12 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -2.42 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM377408
Similarity: 0.726
Similarity to MM377408
| Tanimoto metric | 0.726 |
|---|---|
| Cosine metric | 0.8413 |
| Dice metric | 0.8413 |
| MW: | 146.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.03 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
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