General Information of the Compound
| Compound ID |
CP0547501
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| Compound Name |
N-(2-fluoro-4-pyridin-3-ylphenyl)benzamide
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| Structure |
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| Formula |
C18H13FN2O
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| Molecular Weight |
292.313
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| Canonical SMILES |
Fc1cc(ccc1NC(=O)c1ccccc1)-c1cccnc1
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| InChI |
InChI=1S/C18H13FN2O/c19-16-11-14(15-7-4-10-20-12-15)8-9-17(16)21-18(22)13-5-2-1-3-6-13/h1-12H,(H,21,22)
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| InChIKey |
PWZMPZVPDXSUEG-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Protein ID: PT01546, ATP-dependent translocase ABCB1
Protein ID: PT02516, Multidrug resistance-associated protein 1