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DocumentationIdentifier: MM136358
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM136358 |
| SMILES |
C=CC=C(F)C=C(F)F
|
| InChIKey |
HFMRUTMKBRWKHR-UHFFFAOYSA-N
|
| MW [Da] |
134.1
Automatically obtained from RDkit software. |
| LogP |
2.81
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM104901
Similarity: 0.8308
Similarity to MM104901
| Tanimoto metric | 0.8308 |
|---|---|
| Cosine metric | 0.9115 |
| Dice metric | 0.9076 |
| MW: | 122.09 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.64 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM107984
Similarity: 0.7692
Similarity to MM107984
| Tanimoto metric | 0.7692 |
|---|---|
| Cosine metric | 0.8771 |
| Dice metric | 0.8696 |
| MW: | 116.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.51 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM146772
Similarity: 0.7397
Similarity to MM146772
| Tanimoto metric | 0.7397 |
|---|---|
| Cosine metric | 0.8506 |
| Dice metric | 0.8504 |
| MW: | 134.1 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.81 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
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