General Information of the Compound
| Compound ID |
CP0519293
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| Compound Name |
N-[[4-tert-butyl-2-[(4-fluorophenyl)methoxy]phenyl]methyl]-2-[3-fluoro-4-(methanesulfonamido)phenyl]propanamide
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| Structure |
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| Formula |
C28H32F2N2O4S
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| Molecular Weight |
530.637
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| Canonical SMILES |
CC(C(=O)NCc1ccc(cc1OCc1ccc(F)cc1)C(C)(C)C)c1ccc(NS(C)(=O)=O)c(F)c1
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| InChI |
InChI=1S/C28H32F2N2O4S/c1-18(20-9-13-25(24(30)14-20)32-37(5,34)35)27(33)31-16-21-8-10-22(28(2,3)4)15-26(21)36-17-19-6-11-23(29)12-7-19/h6-15,18,32H,16-17H2,1-5H3,(H,31,33)
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| InChIKey |
WQJONQBBUHRJIM-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