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DocumentationIdentifier: MM308142
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM308142 |
| SMILES |
O=COCC(O)(CO)CO
|
| InChIKey |
QIEYHNUSYRHBFN-UHFFFAOYSA-N
|
| MW [Da] |
150.13
Automatically obtained from RDkit software. |
| LogP |
-2.12
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM138263
Similarity: 0.9277
Similarity to MM138263
| Tanimoto metric | 0.9277 |
|---|---|
| Cosine metric | 0.9632 |
| Dice metric | 0.9625 |
| MW: | 134.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM139235
Similarity: 0.7108
Similarity to MM139235
| Tanimoto metric | 0.7108 |
|---|---|
| Cosine metric | 0.8431 |
| Dice metric | 0.831 |
| MW: | 136.15 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1.65 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM308138
Similarity: 0.6667
Similarity to MM308138
| Tanimoto metric | 0.6667 |
|---|---|
| Cosine metric | 0.809 |
| Dice metric | 0.8 |
| MW: | 148.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.71 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+309 more
