General Information of the Compound
| Compound ID |
CP0422638
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| Compound Name |
N-[3-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]propyl]-4-methylbenzenesulfonamide
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| Structure |
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| Formula |
C21H27ClN2O3S
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| Molecular Weight |
422.978
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| Canonical SMILES |
Cc1ccc(cc1)S(=O)(=O)NCCCN1CCC(O)(CC1)c1ccc(Cl)cc1
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| InChI |
InChI=1S/C21H27ClN2O3S/c1-17-3-9-20(10-4-17)28(26,27)23-13-2-14-24-15-11-21(25,12-16-24)18-5-7-19(22)8-6-18/h3-10,23,25H,2,11-16H2,1H3
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| InChIKey |
JCZKKGZHOSBLBV-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