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DocumentationIdentifier: MM361324
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM361324 |
| SMILES |
O=C(CO)C(F)=CC=CF
|
| InChIKey |
MAUIOBGNPLRYMO-UHFFFAOYSA-N
|
| MW [Da] |
148.11
Automatically obtained from RDkit software. |
| LogP |
0.88
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM175535
Similarity: 0.8672
Similarity to MM175535
| Tanimoto metric | 0.8672 |
|---|---|
| Cosine metric | 0.9312 |
| Dice metric | 0.9289 |
| MW: | 130.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.59 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM164006
Similarity: 0.7188
Similarity to MM164006
| Tanimoto metric | 0.7188 |
|---|---|
| Cosine metric | 0.8478 |
| Dice metric | 0.8364 |
| MW: | 132.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.91 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM66679
Similarity: 0.6667
Similarity to MM66679
| Tanimoto metric | 0.6667 |
|---|---|
| Cosine metric | 0.803 |
| Dice metric | 0.8 |
| MW: | 144.15 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.98 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+141 more
