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DocumentationIdentifier: MM362121
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM362121 |
| SMILES |
CC(CO)C(O)CNC=O
|
| InChIKey |
PJQCDGWVOBECEB-UHFFFAOYSA-N
|
| MW [Da] |
147.17
Automatically obtained from RDkit software. |
| LogP |
-1.28
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM47833
Similarity: 0.7453
Similarity to MM47833
| Tanimoto metric | 0.7453 |
|---|---|
| Cosine metric | 0.8633 |
| Dice metric | 0.8541 |
| MW: | 131.18 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.25 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM402354
Similarity: 0.6273
Similarity to MM402354
| Tanimoto metric | 0.6273 |
|---|---|
| Cosine metric | 0.7844 |
| Dice metric | 0.7709 |
| MW: | 147.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM165694
Similarity: 0.6132
Similarity to MM165694
| Tanimoto metric | 0.6132 |
|---|---|
| Cosine metric | 0.7831 |
| Dice metric | 0.7602 |
| MW: | 131.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.25 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+234 more
