General Information of the Compound
| Compound ID |
CP0968684
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| Compound Name |
N-(5-cyano-2-(4-(3,5-difluorophenoxy)piperidin-1-yl)phenyl)-1-methyl-2-oxo-1,2-dihydropyridine-3-carboxamide
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| Structure |
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| Formula |
C25H22F2N4O3
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| Molecular Weight |
464.472
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| Canonical SMILES |
Cn1cccc(C(=O)Nc2cc(C#N)ccc2N2CCC(Oc3cc(F)cc(F)c3)CC2)c1=O
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| InChI |
InChI=1S/C25H22F2N4O3/c1-30-8-2-3-21(25(30)33)24(32)29-22-11-16(15-28)4-5-23(22)31-9-6-19(7-10-31)34-20-13-17(26)12-18(27)14-20/h2-5,8,11-14,19H,6-7,9-10H2,1H3,(H,29,32)
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| InChIKey |
XADUSHGAQNQPCG-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