General Information of the Compound
| Compound ID |
CP0488093
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| Compound Name |
N-[2-[2-[4-[2-(dimethylamino)-1-hydroxyethyl]piperidin-1-yl]-2-oxoethoxy]ethyl]-4-methoxy-N,2,6-trimethylbenzenesulfonamide
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| Structure |
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| Formula |
C23H39N3O6S
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| Molecular Weight |
485.647
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| Canonical SMILES |
COc1cc(C)c(c(C)c1)S(=O)(=O)N(C)CCOCC(=O)N1CCC(CC1)C(O)CN(C)C
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| InChI |
InChI=1S/C23H39N3O6S/c1-17-13-20(31-6)14-18(2)23(17)33(29,30)25(5)11-12-32-16-22(28)26-9-7-19(8-10-26)21(27)15-24(3)4/h13-14,19,21,27H,7-12,15-16H2,1-6H3
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| InChIKey |
NXSSFURWGIWRME-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