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DocumentationIdentifier: MM222396
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM222396 |
| SMILES |
CC(C)(CC=O)C(F)(F)F
|
| InChIKey |
FMTVAYVETMIKHT-UHFFFAOYSA-N
|
| MW [Da] |
154.13
Automatically obtained from RDkit software. |
| LogP |
2.16
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM132614
Similarity: 0.8072
Similarity to MM132614
| Tanimoto metric | 0.8072 |
|---|---|
| Cosine metric | 0.8985 |
| Dice metric | 0.8933 |
| MW: | 136.14 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.87 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM132043
Similarity: 0.7831
Similarity to MM132043
| Tanimoto metric | 0.7831 |
|---|---|
| Cosine metric | 0.8849 |
| Dice metric | 0.8784 |
| MW: | 140.1 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.77 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM234579
Similarity: 0.6204
Similarity to MM234579
| Tanimoto metric | 0.6204 |
|---|---|
| Cosine metric | 0.7667 |
| Dice metric | 0.7657 |
| MW: | 150.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+208 more
