General Information of the Compound
| Compound ID |
CP0411649
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| Compound Name |
2-[3-fluoro-4-(methanesulfonamido)phenyl]-N-[[6-(4-fluorophenyl)-2-(4-methylpiperidin-1-yl)pyridin-3-yl]methyl]propanamide
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| Structure |
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| Formula |
C28H32F2N4O3S
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| Molecular Weight |
542.652
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| Canonical SMILES |
CC(C(=O)NCc1ccc(nc1N1CCC(C)CC1)-c1ccc(F)cc1)c1ccc(NS(C)(=O)=O)c(F)c1
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| InChI |
InChI=1S/C28H32F2N4O3S/c1-18-12-14-34(15-13-18)27-22(7-10-25(32-27)20-4-8-23(29)9-5-20)17-31-28(35)19(2)21-6-11-26(24(30)16-21)33-38(3,36)37/h4-11,16,18-19,33H,12-15,17H2,1-3H3,(H,31,35)
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| InChIKey |
DNNVDAWHZPFRIT-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