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DocumentationIdentifier: MM264227
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM264227 |
| SMILES |
C=CC(=O)OC(C)C=CF
|
| InChIKey |
JEWRPXNTWBIFPA-UHFFFAOYSA-N
|
| MW [Da] |
144.15
Automatically obtained from RDkit software. |
| LogP |
1.59
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM142402
Similarity: 0.7477
Similarity to MM142402
| Tanimoto metric | 0.7477 |
|---|---|
| Cosine metric | 0.8647 |
| Dice metric | 0.8556 |
| MW: | 126.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM330529
Similarity: 0.6983
Similarity to MM330529
| Tanimoto metric | 0.6983 |
|---|---|
| Cosine metric | 0.8254 |
| Dice metric | 0.8223 |
| MW: | 138.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.46 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM264142
Similarity: 0.6842
Similarity to MM264142
| Tanimoto metric | 0.6842 |
|---|---|
| Cosine metric | 0.8133 |
| Dice metric | 0.8125 |
| MW: | 146.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.81 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+333 more
