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DocumentationIdentifier: MM316719
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM316719 |
| SMILES |
NC(CO)COC(=O)CO
|
| InChIKey |
KAKNXRDMTXKKSE-UHFFFAOYSA-N
|
| MW [Da] |
149.15
Automatically obtained from RDkit software. |
| LogP |
-2.16
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM144690
Similarity: 0.8381
Similarity to MM144690
| Tanimoto metric | 0.8381 |
|---|---|
| Cosine metric | 0.9155 |
| Dice metric | 0.9119 |
| MW: | 133.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM144323
Similarity: 0.7905
Similarity to MM144323
| Tanimoto metric | 0.7905 |
|---|---|
| Cosine metric | 0.8891 |
| Dice metric | 0.883 |
| MW: | 133.15 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM250681
Similarity: 0.7345
Similarity to MM250681
| Tanimoto metric | 0.7345 |
|---|---|
| Cosine metric | 0.8491 |
| Dice metric | 0.8469 |
| MW: | 147.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+403 more
