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DocumentationIdentifier: MM223774
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM223774 |
| SMILES |
CC(C(=O)CO)C(C)(F)F
|
| InChIKey |
FPXNAZYVDKJOQX-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
MM129877
Similarity: 0.6948
Similarity to MM129877
| Tanimoto metric | 0.6948 |
|---|---|
| Cosine metric | 0.8335 |
| Dice metric | 0.8199 |
| MW: | 136.14 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.87 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM232006
Similarity: 0.6807
Similarity to MM232006
| Tanimoto metric | 0.6807 |
|---|---|
| Cosine metric | 0.8144 |
| Dice metric | 0.81 |
| MW: | 152.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.84 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM39974
Similarity: 0.6169
Similarity to MM39974
| Tanimoto metric | 0.6169 |
|---|---|
| Cosine metric | 0.7854 |
| Dice metric | 0.7631 |
| MW: | 138.11 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.59 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+116 more
