General Information of the Compound
| Compound ID |
CP0568395
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| Compound Name |
N-[3-methoxy-5-[2-methyl-5-(4-piperazin-1-ylphenyl)pyridin-3-yl]phenyl]ethanesulfonamide
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| Structure |
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| Formula |
C25H30N4O3S
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| Molecular Weight |
466.607
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| Canonical SMILES |
CCS(=O)(=O)Nc1cc(OC)cc(c1)-c1cc(cnc1C)-c1ccc(cc1)N1CCNCC1
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| InChI |
InChI=1S/C25H30N4O3S/c1-4-33(30,31)28-22-13-20(14-24(16-22)32-3)25-15-21(17-27-18(25)2)19-5-7-23(8-6-19)29-11-9-26-10-12-29/h5-8,13-17,26,28H,4,9-12H2,1-3H3
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| InChIKey |
QKIQUHJMKMTYPI-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