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DocumentationIdentifier: MM197223
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM197223 |
| SMILES |
COC(CO)C(=O)CO
|
| InChIKey |
XDXPZIFBWNGOKO-UHFFFAOYSA-N
|
| MW [Da] |
134.13
Automatically obtained from RDkit software. |
| LogP |
-1.44
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM407721
Similarity: 0.8547
Similarity to MM407721
| Tanimoto metric | 0.8547 |
|---|---|
| Cosine metric | 0.9245 |
| Dice metric | 0.9217 |
| MW: | 148.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.79 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM38654
Similarity: 0.77
Similarity to MM38654
| Tanimoto metric | 0.77 |
|---|---|
| Cosine metric | 0.8775 |
| Dice metric | 0.8701 |
| MW: | 118.13 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.42 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM172937
Similarity: 0.7143
Similarity to MM172937
| Tanimoto metric | 0.7143 |
|---|---|
| Cosine metric | 0.8341 |
| Dice metric | 0.8333 |
| MW: | 134.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.44 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+340 more
