General Information of the Compound
| Compound ID |
CP0429260
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| Compound Name |
4-methoxy-N-[2-(7-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 |
COc1ccc2cccc(CCNS(=O)(=O)c3ccc(OC)c(c3)N3CCN(C)CC3)c2c1
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| InChI |
InChI=1S/C25H31N3O4S/c1-27-13-15-28(16-14-27)24-18-22(9-10-25(24)32-3)33(29,30)26-12-11-20-6-4-5-19-7-8-21(31-2)17-23(19)20/h4-10,17-18,26H,11-16H2,1-3H3
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| InChIKey |
PRFXDHWSXMLZQY-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