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DocumentationIdentifier: MM244373
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM244373 |
| SMILES |
CC(=O)C(C)(CO)C(F)F
|
| InChIKey |
KBTIBYOTEMZVKT-UHFFFAOYSA-N
|
| MW [Da] |
152.14
Automatically obtained from RDkit software. |
| LogP |
0.84
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM132917
Similarity: 0.6176
Similarity to MM132917
| Tanimoto metric | 0.6176 |
|---|---|
| Cosine metric | 0.7859 |
| Dice metric | 0.7636 |
| MW: | 136.14 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.87 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM389052
Similarity: 0.6061
Similarity to MM389052
| Tanimoto metric | 0.6061 |
|---|---|
| Cosine metric | 0.755 |
| Dice metric | 0.7547 |
| MW: | 154.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.58 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM139883
Similarity: 0.6029
Similarity to MM139883
| Tanimoto metric | 0.6029 |
|---|---|
| Cosine metric | 0.7765 |
| Dice metric | 0.7523 |
| MW: | 138.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.45 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+72 more
