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DocumentationIdentifier: MM319862
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM319862 |
| SMILES |
CC(CO)C(F)(C=O)CO
|
| InChIKey |
VIOWBSLJMGRGAJ-UHFFFAOYSA-N
|
| MW [Da] |
150.15
Automatically obtained from RDkit software. |
| LogP |
-0.49
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM42557
Similarity: 0.7537
Similarity to MM42557
| Tanimoto metric | 0.7537 |
|---|---|
| Cosine metric | 0.8682 |
| Dice metric | 0.8596 |
| MW: | 134.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.54 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM41536
Similarity: 0.7313
Similarity to MM41536
| Tanimoto metric | 0.7313 |
|---|---|
| Cosine metric | 0.8552 |
| Dice metric | 0.8448 |
| MW: | 134.15 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.54 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM229822
Similarity: 0.6497
Similarity to MM229822
| Tanimoto metric | 0.6497 |
|---|---|
| Cosine metric | 0.7903 |
| Dice metric | 0.7877 |
| MW: | 152.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.63 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+122 more
