General Information of the Compound
| Compound ID |
CP0516570
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| Compound Name |
1-[1-(2-chlorophenyl)sulfonylpiperidin-4-yl]-4-(4-methoxyphenyl)piperidin-4-ol
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| Structure |
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| Formula |
C23H29ClN2O4S
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| Molecular Weight |
465.015
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| Canonical SMILES |
COc1ccc(cc1)C1(O)CCN(CC1)C1CCN(CC1)S(=O)(=O)c1ccccc1Cl
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| InChI |
InChI=1S/C23H29ClN2O4S/c1-30-20-8-6-18(7-9-20)23(27)12-16-25(17-13-23)19-10-14-26(15-11-19)31(28,29)22-5-3-2-4-21(22)24/h2-9,19,27H,10-17H2,1H3
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| InChIKey |
IJJGIGWUWWJATH-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