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DocumentationIdentifier: MM254049
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM254049 |
| SMILES |
CC(O)C(=O)C(O)C(=N)N
|
| InChIKey |
YQSWVJICVCCOKG-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
MM160512
Similarity: 0.7414
Similarity to MM160512
| Tanimoto metric | 0.7414 |
|---|---|
| Cosine metric | 0.861 |
| Dice metric | 0.8515 |
| MW: | 132.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -2.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM297476
Similarity: 0.6517
Similarity to MM297476
| Tanimoto metric | 0.6517 |
|---|---|
| Cosine metric | 0.7901 |
| Dice metric | 0.7892 |
| MW: | 144.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM297478
Similarity: 0.6436
Similarity to MM297478
| Tanimoto metric | 0.6436 |
|---|---|
| Cosine metric | 0.784 |
| Dice metric | 0.7831 |
| MW: | 146.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.77 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+49 more
