General Information of the Compound
| Compound ID |
CP0530908
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| Compound Name |
N-[[6-cyclopropyl-2-(4-methylpiperidin-1-yl)pyridin-3-yl]methyl]-2-[3-fluoro-4-(methanesulfonamido)phenyl]propanamide
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| Structure |
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| Formula |
C25H33FN4O3S
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| Molecular Weight |
488.629
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| Canonical SMILES |
CC(C(=O)NCc1ccc(nc1N1CCC(C)CC1)C1CC1)c1ccc(NS(C)(=O)=O)c(F)c1
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| InChI |
InChI=1S/C25H33FN4O3S/c1-16-10-12-30(13-11-16)24-20(7-8-22(28-24)18-4-5-18)15-27-25(31)17(2)19-6-9-23(21(26)14-19)29-34(3,32)33/h6-9,14,16-18,29H,4-5,10-13,15H2,1-3H3,(H,27,31)
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| InChIKey |
CSUNOUBDCDWGDB-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