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DocumentationIdentifier: MM164008
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM164008 |
| SMILES |
C=C(F)C(F)=CC=CC
|
| InChIKey |
LRXBSKCDHZHMAP-UHFFFAOYSA-N
|
| MW [Da] |
130.14
Automatically obtained from RDkit software. |
| LogP |
2.9
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
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| Tanimoto metric | 0.9036 |
|---|---|
| Cosine metric | 0.9506 |
| Dice metric | 0.9494 |
| MW: | 142.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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| Tanimoto metric | 0.8354 |
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||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
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| LogP: | 2.9 |
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Total active interactions
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|---|---|---|---|---|---|
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Total passive interactions
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| LogP: | 2.51 |
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+240 more
