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DocumentationIdentifier: MM288584
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM288584 |
| SMILES |
CC(=CC(C)(F)F)C(N)=O
|
| InChIKey |
OZRXKYPDVPIONS-UHFFFAOYSA-N
|
| MW [Da] |
149.14
Automatically obtained from RDkit software. |
| LogP |
1.07
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM272579
Similarity: 0.6978
Similarity to MM272579
| Tanimoto metric | 0.6978 |
|---|---|
| Cosine metric | 0.8354 |
| Dice metric | 0.822 |
| MW: | 135.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.68 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM298375
Similarity: 0.6766
Similarity to MM298375
| Tanimoto metric | 0.6766 |
|---|---|
| Cosine metric | 0.8072 |
| Dice metric | 0.8071 |
| MW: | 145.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM298851
Similarity: 0.6588
Similarity to MM298851
| Tanimoto metric | 0.6588 |
|---|---|
| Cosine metric | 0.7944 |
| Dice metric | 0.7943 |
| MW: | 145.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+237 more
