General Information of the Compound
| Compound ID |
CP0512470
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| Compound Name |
N-[5-[2-amino-5-(3-methylsulfonylphenyl)pyridin-3-yl]-2-methoxyphenyl]propane-1-sulfonamide
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| Structure |
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| Formula |
C22H25N3O5S2
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| Molecular Weight |
475.592
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| Canonical SMILES |
CCCS(=O)(=O)Nc1cc(ccc1OC)-c1cc(cnc1N)-c1cccc(c1)S(C)(=O)=O
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| InChI |
InChI=1S/C22H25N3O5S2/c1-4-10-32(28,29)25-20-13-16(8-9-21(20)30-2)19-12-17(14-24-22(19)23)15-6-5-7-18(11-15)31(3,26)27/h5-9,11-14,25H,4,10H2,1-3H3,(H2,23,24)
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| InChIKey |
KAEJEDBJAIIDDU-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