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DocumentationIdentifier: MM307848
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM307848 |
| SMILES |
CCOCC(O)(CO)CO
|
| InChIKey |
AHYWCHQAFAVALO-UHFFFAOYSA-N
|
| MW [Da] |
150.17
Automatically obtained from RDkit software. |
| LogP |
-1.26
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM41810
Similarity: 0.9221
Similarity to MM41810
| Tanimoto metric | 0.9221 |
|---|---|
| Cosine metric | 0.9602 |
| Dice metric | 0.9595 |
| MW: | 134.18 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.23 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM58961
Similarity: 0.8353
Similarity to MM58961
| Tanimoto metric | 0.8353 |
|---|---|
| Cosine metric | 0.9103 |
| Dice metric | 0.9103 |
| MW: | 148.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.42 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM227800
Similarity: 0.7802
Similarity to MM227800
| Tanimoto metric | 0.7802 |
|---|---|
| Cosine metric | 0.8776 |
| Dice metric | 0.8765 |
| MW: | 148.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.15 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+505 more
