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DocumentationIdentifier: MM328042
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM328042 |
| SMILES |
C=CN(C=O)CC(O)C=O
|
| InChIKey |
XIXOQPBIKZFNKR-UHFFFAOYSA-N
|
| MW [Da] |
143.14
Automatically obtained from RDkit software. |
| LogP |
-0.85
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM141851
Similarity: 0.72
Similarity to MM141851
| Tanimoto metric | 0.72 |
|---|---|
| Cosine metric | 0.8485 |
| Dice metric | 0.8372 |
| MW: | 131.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.37 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM328040
Similarity: 0.6892
Similarity to MM328040
| Tanimoto metric | 0.6892 |
|---|---|
| Cosine metric | 0.816 |
| Dice metric | 0.816 |
| MW: | 141.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.14 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM327828
Similarity: 0.6554
Similarity to MM327828
| Tanimoto metric | 0.6554 |
|---|---|
| Cosine metric | 0.792 |
| Dice metric | 0.7918 |
| MW: | 144.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+41 more
