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DocumentationIdentifier: MM256132
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM256132 |
| SMILES |
CC(CO)C(O)CC(=O)O
|
| InChIKey |
VFXFWGSPGRUWSJ-UHFFFAOYSA-N
|
| MW [Da] |
148.16
Automatically obtained from RDkit software. |
| LogP |
-0.55
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM288125
Similarity: 0.6812
Similarity to MM288125
| Tanimoto metric | 0.6812 |
|---|---|
| Cosine metric | 0.8123 |
| Dice metric | 0.8103 |
| MW: | 146.14 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.34 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
3-hydroxyglutaric Acid
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Similarity to 3-hydroxyglutaric Acid
| Tanimoto metric | 0.6316 |
|---|---|
| Cosine metric | 0.7845 |
| Dice metric | 0.7742 |
| MW: | 148.11 |
||||
|---|---|---|---|---|---|
| PI: | 0
Total passive interactions
|
| LogP: | -0.7 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM254780
Similarity: 0.625
Similarity to MM254780
| Tanimoto metric | 0.625 |
|---|---|
| Cosine metric | 0.783 |
| Dice metric | 0.7692 |
| MW: | 148.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.55 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
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