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DocumentationIdentifier: MM160692
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM160692 |
| SMILES |
C=CC(=O)C(O)C(=N)N
|
| InChIKey |
BSOGUQLXZFYANN-UHFFFAOYSA-N
|
| MW [Da] |
128.13
Automatically obtained from RDkit software. |
| LogP |
-0.96
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
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MM350530
Similarity: 0.7514
Similarity to MM350530
| Tanimoto metric | 0.7514 |
|---|---|
| Cosine metric | 0.8668 |
| Dice metric | 0.858 |
| MW: | 142.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.91 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM109112
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Similarity to MM109112
| Tanimoto metric | 0.705 |
|---|---|
| Cosine metric | 0.8397 |
| Dice metric | 0.827 |
| MW: | 116.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM254153
Similarity: 0.6847
Similarity to MM254153
| Tanimoto metric | 0.6847 |
|---|---|
| Cosine metric | 0.8275 |
| Dice metric | 0.8129 |
| MW: | 142.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.57 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+53 more
