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DocumentationIdentifier: MM254934
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM254934 |
| SMILES |
CC(C)COC(=O)C(F)F
|
| InChIKey |
KXAUIPCPTYSFIS-UHFFFAOYSA-N
|
| MW [Da] |
152.14
Automatically obtained from RDkit software. |
| LogP |
1.45
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM144688
Similarity: 0.7872
Similarity to MM144688
| Tanimoto metric | 0.7872 |
|---|---|
| Cosine metric | 0.8873 |
| Dice metric | 0.881 |
| MW: | 134.15 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM254935
Similarity: 0.7043
Similarity to MM254935
| Tanimoto metric | 0.7043 |
|---|---|
| Cosine metric | 0.8272 |
| Dice metric | 0.8265 |
| MW: | 156.1 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.15 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM108375
Similarity: 0.6809
Similarity to MM108375
| Tanimoto metric | 0.6809 |
|---|---|
| Cosine metric | 0.8251 |
| Dice metric | 0.8101 |
| MW: | 124.09 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.81 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+416 more
