General Information of the Compound
| Compound ID |
CP0447657
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| Compound Name |
5-(Dimethylamino)-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-1-naphthalenesulfonamide
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| Structure |
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| Formula |
C25H32N4O3S
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| Molecular Weight |
468.623
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| Canonical SMILES |
COc1ccccc1N1CCN(CCNS(=O)(=O)c2cccc3c(cccc23)N(C)C)CC1
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| InChI |
InChI=1S/C25H32N4O3S/c1-27(2)22-11-6-9-21-20(22)8-7-13-25(21)33(30,31)26-14-15-28-16-18-29(19-17-28)23-10-4-5-12-24(23)32-3/h4-13,26H,14-19H2,1-3H3
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| InChIKey |
AQKSXUFYPJNQLY-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