General Information of the Compound
| Compound ID |
CP0397168
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| Compound Name |
N-[3-[1-(4-cyanophenyl)-3-methyl-6-oxopyridazin-4-yl]phenyl]ethanesulfonamide
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| Structure |
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| Formula |
C20H18N4O3S
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| Molecular Weight |
394.456
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| Canonical SMILES |
CCS(=O)(=O)Nc1cccc(c1)-c1cc(=O)n(nc1C)-c1ccc(cc1)C#N
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| InChI |
InChI=1S/C20H18N4O3S/c1-3-28(26,27)23-17-6-4-5-16(11-17)19-12-20(25)24(22-14(19)2)18-9-7-15(13-21)8-10-18/h4-12,23H,3H2,1-2H3
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| InChIKey |
GUDMOOZYFNQLTO-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