General Information of the Compound
| Compound ID |
CP0506427
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| Compound Name |
4-methoxy-N,2,6-trimethyl-N-[2-[2-[4-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)piperazin-1-yl]-2-oxoethoxy]ethyl]benzenesulfonamide
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| Structure |
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| Formula |
C26H42N4O5S
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| Molecular Weight |
522.712
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| Canonical SMILES |
COc1cc(C)c(c(C)c1)S(=O)(=O)N(C)CCOCC(=O)N1CCN(CC1)C1CC2CCC(C1)N2C
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| InChI |
InChI=1S/C26H42N4O5S/c1-19-14-24(34-5)15-20(2)26(19)36(32,33)27(3)12-13-35-18-25(31)30-10-8-29(9-11-30)23-16-21-6-7-22(17-23)28(21)4/h14-15,21-23H,6-13,16-18H2,1-5H3
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| InChIKey |
RJCKXVIRXLYMSH-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