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DocumentationIdentifier: MM360092
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM360092 |
| SMILES |
O=COC=C(F)C(O)CF
|
| InChIKey |
BJKQNLYKGIFMOX-UHFFFAOYSA-N
|
| MW [Da] |
152.1
Automatically obtained from RDkit software. |
| LogP |
0.3
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM48398
Similarity: 0.8062
Similarity to MM48398
| Tanimoto metric | 0.8062 |
|---|---|
| Cosine metric | 0.8979 |
| Dice metric | 0.8927 |
| MW: | 134.11 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM51012
Similarity: 0.8062
Similarity to MM51012
| Tanimoto metric | 0.8062 |
|---|---|
| Cosine metric | 0.8979 |
| Dice metric | 0.8927 |
| MW: | 138.11 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.77 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM360090
Similarity: 0.7075
Similarity to MM360090
| Tanimoto metric | 0.7075 |
|---|---|
| Cosine metric | 0.829 |
| Dice metric | 0.8287 |
| MW: | 150.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+113 more
