General Information of the Compound
| Compound ID |
CP0265172
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| Compound Name |
N-[3-[2-amino-5-(4-piperazin-1-ylphenyl)pyridin-3-yl]-5-methoxyphenyl]propane-2-sulfonamide
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| Structure |
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| Formula |
C25H31N5O3S
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| Molecular Weight |
481.622
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| Canonical SMILES |
COc1cc(NS(=O)(=O)C(C)C)cc(c1)-c1cc(cnc1N)-c1ccc(cc1)N1CCNCC1
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| InChI |
InChI=1S/C25H31N5O3S/c1-17(2)34(31,32)29-21-12-19(13-23(15-21)33-3)24-14-20(16-28-25(24)26)18-4-6-22(7-5-18)30-10-8-27-9-11-30/h4-7,12-17,27,29H,8-11H2,1-3H3,(H2,26,28)
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| InChIKey |
AGBKRFXLWIHJQH-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