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DocumentationIdentifier: MM171560
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM171560 |
| SMILES |
C=CC=CC=C(F)C=C
|
| InChIKey |
NDIBYZPWAHVFOW-UHFFFAOYSA-N
|
| MW [Da] |
124.16
Automatically obtained from RDkit software. |
| LogP |
2.77
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 | 0.931 |
|---|---|
| Cosine metric | 0.9649 |
| Dice metric | 0.9643 |
| MW: | 138.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
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| LogP: | 3.16 |
||||
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| AI: | 0
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Total passive interactions
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Total passive interactions
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| LogP: | 3.16 |
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