General Information of the Compound
| Compound ID |
CP0192162
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| Compound Name |
5-Oxo-5-[4-({[5-(phenylsulfonyl)-2-(trifluoromethyl)-phenyl]sulfonyl}amino)piperidin-1-yl]pentanoic acid
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| Structure |
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| Formula |
C23H25F3N2O7S2
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| Molecular Weight |
562.588
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| Canonical SMILES |
OC(=O)CCCC(=O)N1CCC(CC1)NS(=O)(=O)c1cc(ccc1C(F)(F)F)S(=O)(=O)c1ccccc1
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| InChI |
InChI=1S/C23H25F3N2O7S2/c24-23(25,26)19-10-9-18(36(32,33)17-5-2-1-3-6-17)15-20(19)37(34,35)27-16-11-13-28(14-12-16)21(29)7-4-8-22(30)31/h1-3,5-6,9-10,15-16,27H,4,7-8,11-14H2,(H,30,31)
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| InChIKey |
YUFZSPIHLDEFRC-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