General Information of the Compound
| Compound ID |
CP0577492
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| Compound Name |
4-[2-[5-methyl-2,4-dioxo-3-(2-phenylethyl)thieno[2,3-d]pyrimidin-1-yl]ethyl]benzenesulfonamide
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| Structure |
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| Formula |
C23H23N3O4S2
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| Molecular Weight |
469.588
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| Canonical SMILES |
Cc1csc2n(CCc3ccc(cc3)S(N)(=O)=O)c(=O)n(CCc3ccccc3)c(=O)c12
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| InChI |
InChI=1S/C23H23N3O4S2/c1-16-15-31-22-20(16)21(27)25(13-11-17-5-3-2-4-6-17)23(28)26(22)14-12-18-7-9-19(10-8-18)32(24,29)30/h2-10,15H,11-14H2,1H3,(H2,24,29,30)
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| InChIKey |
VXFMWTLIICWJCG-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