General Information of the Compound
| Compound ID |
CP0969575
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| Compound Name |
N-(5-cyano-2-(4-(2,4-difluorophenoxy)piperidin-1-yl)phenyl)-1-cyclohexyl-2-oxo-1,2-dihydropyridine-3-carboxamide
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| Structure |
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| Formula |
C30H30F2N4O3
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| Molecular Weight |
532.591
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| Canonical SMILES |
N#Cc1ccc(N2CCC(Oc3ccc(F)cc3F)CC2)c(NC(=O)c2cccn(C3CCCCC3)c2=O)c1
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| InChI |
InChI=1S/C30H30F2N4O3/c31-21-9-11-28(25(32)18-21)39-23-12-15-35(16-13-23)27-10-8-20(19-33)17-26(27)34-29(37)24-7-4-14-36(30(24)38)22-5-2-1-3-6-22/h4,7-11,14,17-18,22-23H,1-3,5-6,12-13,15-16H2,(H,34,37)
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| InChIKey |
IZNZTRMMPXEYJD-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