General Information of the Compound
| Compound ID |
CP0523545
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| Compound Name |
3-methoxy-N-[5-[5-(2-methyl-1-oxo-3H-isoindol-5-yl)thiophen-2-yl]pyridin-3-yl]benzenesulfonamide
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| Structure |
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| Formula |
C25H21N3O4S2
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| Molecular Weight |
491.594
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| Canonical SMILES |
COc1cccc(c1)S(=O)(=O)Nc1cncc(c1)-c1ccc(s1)-c1ccc2C(=O)N(C)Cc2c1
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| InChI |
InChI=1S/C25H21N3O4S2/c1-28-15-18-10-16(6-7-22(18)25(28)29)23-8-9-24(33-23)17-11-19(14-26-13-17)27-34(30,31)21-5-3-4-20(12-21)32-2/h3-14,27H,15H2,1-2H3
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| InChIKey |
PWGQCZZPSXKYBE-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