General Information of the Compound
Compound ID |
CP0965351
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Compound Name |
2-[6-(8-fluoro-2-naphthyl)-2-oxo-1H-pyridin-3-yl]-3-methyl-N-(4-pyridyl)butanamide
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Structure |
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Formula |
C25H22FN3O2
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Molecular Weight |
415.468
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Canonical SMILES |
CC(C)C(C(=O)Nc1ccncc1)c1ccc(-c2ccc3cccc(F)c3c2)[nH]c1=O
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InChI |
InChI=1S/C25H22FN3O2/c1-15(2)23(25(31)28-18-10-12-27-13-11-18)19-8-9-22(29-24(19)30)17-7-6-16-4-3-5-21(26)20(16)14-17/h3-15,23H,1-2H3,(H,29,30)(H,27,28,31)
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InChIKey |
ZBVHPTWFCNFGTJ-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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