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DocumentationIdentifier: MM159242
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM159242 |
| SMILES |
C=CC=C(F)C=CCF
|
| InChIKey |
GRJZPOBQVLXGME-UHFFFAOYSA-N
|
| MW [Da] |
130.14
Automatically obtained from RDkit software. |
| LogP |
2.55
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM107981
Similarity: 0.8065
Similarity to MM107981
| Tanimoto metric | 0.8065 |
|---|---|
| Cosine metric | 0.898 |
| Dice metric | 0.8929 |
| MW: | 112.15 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.6 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM285382
Similarity: 0.7887
Similarity to MM285382
| Tanimoto metric | 0.7887 |
|---|---|
| Cosine metric | 0.8821 |
| Dice metric | 0.8819 |
| MW: | 144.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.94 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM284372
Similarity: 0.7826
Similarity to MM284372
| Tanimoto metric | 0.7826 |
|---|---|
| Cosine metric | 0.8781 |
| Dice metric | 0.878 |
| MW: | 138.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+337 more
