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DocumentationIdentifier: MM170370
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM170370 |
| SMILES |
C=COC=CC(F)=CF
|
| InChIKey |
QHXZUKCZQACRRV-UHFFFAOYSA-N
|
| MW [Da] |
132.11
Automatically obtained from RDkit software. |
| LogP |
2.44
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM106335
Similarity: 0.7297
Similarity to MM106335
| Tanimoto metric | 0.7297 |
|---|---|
| Cosine metric | 0.8542 |
| Dice metric | 0.8438 |
| MW: | 114.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.14 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM170333
Similarity: 0.7159
Similarity to MM170333
| Tanimoto metric | 0.7159 |
|---|---|
| Cosine metric | 0.8346 |
| Dice metric | 0.8344 |
| MW: | 134.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.32 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM154303
Similarity: 0.675
Similarity to MM154303
| Tanimoto metric | 0.675 |
|---|---|
| Cosine metric | 0.8104 |
| Dice metric | 0.806 |
| MW: | 128.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.53 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+288 more
