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DocumentationIdentifier: MM306930
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM306930 |
| SMILES |
C=CC(O)CC(O)C(=O)O
|
| InChIKey |
ZDALKXWKNOYXDF-UHFFFAOYSA-N
|
| MW [Da] |
146.14
Automatically obtained from RDkit software. |
| LogP |
-0.63
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
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MM43731
Similarity: 0.6357
Similarity to MM43731
| Tanimoto metric | 0.6357 |
|---|---|
| Cosine metric | 0.7973 |
| Dice metric | 0.7773 |
| MW: | 130.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM269485
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Similarity to MM269485
| Tanimoto metric | 0.6211 |
|---|---|
| Cosine metric | 0.7663 |
| Dice metric | 0.7663 |
| MW: | 146.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.63 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM432608
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Similarity to MM432608
| Tanimoto metric | 0.6063 |
|---|---|
| Cosine metric | 0.7549 |
| Dice metric | 0.7549 |
| MW: | 145.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+138 more
