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DocumentationIdentifier: MM221554
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM221554 |
| SMILES |
CC(C)OC(=O)C(F)(F)F
|
| InChIKey |
ASAXRKSDVDALDT-UHFFFAOYSA-N
|
| MW [Da] |
156.1
Automatically obtained from RDkit software. |
| LogP |
1.5
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM133833
Similarity: 0.8367
Similarity to MM133833
| Tanimoto metric | 0.8367 |
|---|---|
| Cosine metric | 0.9147 |
| Dice metric | 0.9111 |
| MW: | 138.11 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.2 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM132116
Similarity: 0.8163
Similarity to MM132116
| Tanimoto metric | 0.8163 |
|---|---|
| Cosine metric | 0.9035 |
| Dice metric | 0.8989 |
| MW: | 142.08 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM246025
Similarity: 0.6891
Similarity to MM246025
| Tanimoto metric | 0.6891 |
|---|---|
| Cosine metric | 0.8162 |
| Dice metric | 0.8159 |
| MW: | 156.1 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.15 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+195 more
