General Information of the Compound
| Compound ID |
CP0931265
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| Compound Name |
N-(5-cyano-2-(4-(2,4-difluorophenoxy)piperidin-1-yl)phenyl)-1-(3-methoxypropyl)-2-oxo-1,2-dihydropyridine-3-carboxamide
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| Structure |
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| Formula |
C28H28F2N4O4
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| Molecular Weight |
522.552
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| Canonical SMILES |
COCCCn1cccc(C(=O)Nc2cc(C#N)ccc2N2CCC(Oc3ccc(F)cc3F)CC2)c1=O
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| InChI |
InChI=1S/C28H28F2N4O4/c1-37-15-3-12-34-11-2-4-22(28(34)36)27(35)32-24-16-19(18-31)5-7-25(24)33-13-9-21(10-14-33)38-26-8-6-20(29)17-23(26)30/h2,4-8,11,16-17,21H,3,9-10,12-15H2,1H3,(H,32,35)
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| InChIKey |
RKTJOTHFSBFXTO-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