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DocumentationIdentifier: MM308590
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM308590 |
| SMILES |
CC(C=O)(CO)OCCO
|
| InChIKey |
IZUQJZRKGIUETK-UHFFFAOYSA-N
|
| MW [Da] |
148.16
Automatically obtained from RDkit software. |
| LogP |
-1.05
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM42238
Similarity: 0.8788
Similarity to MM42238
| Tanimoto metric | 0.8788 |
|---|---|
| Cosine metric | 0.9374 |
| Dice metric | 0.9355 |
| MW: | 132.16 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.03 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM308844
Similarity: 0.8585
Similarity to MM308844
| Tanimoto metric | 0.8585 |
|---|---|
| Cosine metric | 0.9239 |
| Dice metric | 0.9239 |
| MW: | 146.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.85 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM312579
Similarity: 0.75
Similarity to MM312579
| Tanimoto metric | 0.75 |
|---|---|
| Cosine metric | 0.8574 |
| Dice metric | 0.8571 |
| MW: | 148.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.05 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+310 more
