General Information of the Compound
| Compound ID |
CP0173340
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| Compound Name |
2-[4-(1,3-dimethyl-2,4-dioxo-5H-pyrrolo[3,2-d]pyrimidin-6-yl)phenoxy]-N-phenylacetamide
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| Structure |
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| Formula |
C22H20N4O4
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| Molecular Weight |
404.426
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| Canonical SMILES |
Cn1c2cc([nH]c2c(=O)n(C)c1=O)-c1ccc(OCC(=O)Nc2ccccc2)cc1
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| InChI |
InChI=1S/C22H20N4O4/c1-25-18-12-17(24-20(18)21(28)26(2)22(25)29)14-8-10-16(11-9-14)30-13-19(27)23-15-6-4-3-5-7-15/h3-12,24H,13H2,1-2H3,(H,23,27)
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| InChIKey |
BUEJCBZTDZRXBI-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