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DocumentationIdentifier: MM380512
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM380512 |
| SMILES |
O=COC(C=O)C(F)=CF
|
| InChIKey |
KUEFALJPHWMVSG-UHFFFAOYSA-N
|
| MW [Da] |
150.08
Automatically obtained from RDkit software. |
| LogP |
0.51
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM180023
Similarity: 0.7403
Similarity to MM180023
| Tanimoto metric | 0.7403 |
|---|---|
| Cosine metric | 0.8604 |
| Dice metric | 0.8507 |
| MW: | 132.09 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.21 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM275435
Similarity: 0.5838
Similarity to MM275435
| Tanimoto metric | 0.5838 |
|---|---|
| Cosine metric | 0.7372 |
| Dice metric | 0.7372 |
| MW: | 146.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.6 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM272821
Similarity: 0.5
Similarity to MM272821
| Tanimoto metric | 0.5 |
|---|---|
| Cosine metric | 0.6695 |
| Dice metric | 0.6667 |
| MW: | 146.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.6 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+15 more
