General Information of the Compound
| Compound ID |
CP0423879
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| Compound Name |
N-[2-[2-[4-[1-(dimethylamino)-2-methylpropan-2-yl]piperidin-1-yl]-2-oxoethoxy]ethyl]-4-methoxy-N,2,6-trimethylbenzenesulfonamide
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| Structure |
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| Formula |
C25H43N3O5S
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| Molecular Weight |
497.702
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| Canonical SMILES |
COc1cc(C)c(c(C)c1)S(=O)(=O)N(C)CCOCC(=O)N1CCC(CC1)C(C)(C)CN(C)C
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| InChI |
InChI=1S/C25H43N3O5S/c1-19-15-22(32-8)16-20(2)24(19)34(30,31)27(7)13-14-33-17-23(29)28-11-9-21(10-12-28)25(3,4)18-26(5)6/h15-16,21H,9-14,17-18H2,1-8H3
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| InChIKey |
KSTVWFLNARVRQT-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