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DocumentationIdentifier: MM163945
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM163945 |
| SMILES |
C=COC=C(F)C(=C)F
|
| InChIKey |
ZZCKSQINDSAKCV-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
MM108895
Similarity: 0.8046
Similarity to MM108895
| Tanimoto metric | 0.8046 |
|---|---|
| Cosine metric | 0.897 |
| Dice metric | 0.8917 |
| MW: | 120.1 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.93 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM296957
Similarity: 0.7071
Similarity to MM296957
| Tanimoto metric | 0.7071 |
|---|---|
| Cosine metric | 0.8288 |
| Dice metric | 0.8284 |
| MW: | 150.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.9 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM114811
Similarity: 0.6782
Similarity to MM114811
| Tanimoto metric | 0.6782 |
|---|---|
| Cosine metric | 0.8235 |
| Dice metric | 0.8082 |
| MW: | 114.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.14 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+83 more
