General Information of the Compound
| Compound ID |
CP0543560
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| Compound Name |
N-(1-butyl-3-oxo-1H-2-benzofuran-5-yl)-3,4-bis(3,4-dimethoxyphenyl)-2,5-dioxopyrrole-1-carboxamide
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| Structure |
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| Formula |
C33H32N2O9
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| Molecular Weight |
600.624
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| Canonical SMILES |
CCCCC1OC(=O)c2cc(NC(=O)N3C(=O)C(=C(C3=O)c3ccc(OC)c(OC)c3)c3ccc(OC)c(OC)c3)ccc12
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| InChI |
InChI=1S/C33H32N2O9/c1-6-7-8-23-21-12-11-20(17-22(21)32(38)44-23)34-33(39)35-30(36)28(18-9-13-24(40-2)26(15-18)42-4)29(31(35)37)19-10-14-25(41-3)27(16-19)43-5/h9-17,23H,6-8H2,1-5H3,(H,34,39)
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| InChIKey |
CJULHKRTFUNYTB-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