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DocumentationIdentifier: MM268853
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM268853 |
| SMILES |
CNC(=O)C(O)CC(N)=O
|
| InChIKey |
CZHQHZPJYOAOPP-UHFFFAOYSA-N
|
| MW [Da] |
146.15
Automatically obtained from RDkit software. |
| LogP |
-2.03
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM245655
Similarity: 0.8714
Similarity to MM245655
| Tanimoto metric | 0.8714 |
|---|---|
| Cosine metric | 0.9314 |
| Dice metric | 0.9313 |
| MW: | 146.15 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -2.03 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM172538
Similarity: 0.797
Similarity to MM172538
| Tanimoto metric | 0.797 |
|---|---|
| Cosine metric | 0.8927 |
| Dice metric | 0.887 |
| MW: | 131.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.32 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM172380
Similarity: 0.782
Similarity to MM172380
| Tanimoto metric | 0.782 |
|---|---|
| Cosine metric | 0.8843 |
| Dice metric | 0.8776 |
| MW: | 132.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1.56 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+156 more
