General Information of the Compound
| Compound ID |
CP0387831
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| Compound Name |
2-[3-fluoro-4-(methanesulfonamido)phenyl]-N-[[2-heptan-4-yloxy-6-(trifluoromethyl)pyridin-3-yl]methyl]propanamide
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| Structure |
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| Formula |
C24H31F4N3O4S
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| Molecular Weight |
533.588
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| Canonical SMILES |
CCCC(CCC)Oc1nc(ccc1CNC(=O)C(C)c1ccc(NS(C)(=O)=O)c(F)c1)C(F)(F)F
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| InChI |
InChI=1S/C24H31F4N3O4S/c1-5-7-18(8-6-2)35-23-17(10-12-21(30-23)24(26,27)28)14-29-22(32)15(3)16-9-11-20(19(25)13-16)31-36(4,33)34/h9-13,15,18,31H,5-8,14H2,1-4H3,(H,29,32)
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| InChIKey |
LTKJXVCSBXHSNS-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