General Information of the Compound
Compound ID |
CP0566398
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Compound Name |
4-methoxy-N-[2-(4-methoxynaphthalen-1-yl)ethyl]-3-(4-methylpiperazin-1-yl)benzenesulfonamide
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Structure |
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Formula |
C25H31N3O4S
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Molecular Weight |
469.607
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Canonical SMILES |
COc1ccc(cc1N1CCN(C)CC1)S(=O)(=O)NCCc1ccc(OC)c2ccccc12
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InChI |
InChI=1S/C25H31N3O4S/c1-27-14-16-28(17-15-27)23-18-20(9-11-25(23)32-3)33(29,30)26-13-12-19-8-10-24(31-2)22-7-5-4-6-21(19)22/h4-11,18,26H,12-17H2,1-3H3
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InChIKey |
FIOCMWWBXGQEOI-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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