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DocumentationIdentifier: MM105014
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM105014 |
| SMILES |
C=C(F)C=C(F)CF
|
| InChIKey |
PHQPFXXBTDSEFB-UHFFFAOYSA-N
|
| MW [Da] |
122.09
Automatically obtained from RDkit software. |
| LogP |
2.29
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM143898
Similarity: 0.775
Similarity to MM143898
| Tanimoto metric | 0.775 |
|---|---|
| Cosine metric | 0.8803 |
| Dice metric | 0.8732 |
| MW: | 136.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.68 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM108885
Similarity: 0.7429
Similarity to MM108885
| Tanimoto metric | 0.7429 |
|---|---|
| Cosine metric | 0.8526 |
| Dice metric | 0.8525 |
| MW: | 122.09 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM97217
Similarity: 0.7097
Similarity to MM97217
| Tanimoto metric | 0.7097 |
|---|---|
| Cosine metric | 0.8424 |
| Dice metric | 0.8302 |
| MW: | 104.1 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.34 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+442 more
