General Information of the Compound
| Compound ID |
CP0377775
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| Compound Name |
1-hydroxy-1-[1-[2-(3,4,5-trimethoxyphenyl)-1-benzofuran-5-yl]ethyl]urea
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| Structure |
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| Formula |
C20H22N2O6
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| Molecular Weight |
386.404
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| Canonical SMILES |
COc1cc(cc(OC)c1OC)-c1cc2cc(ccc2o1)C(C)N(O)C(N)=O
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| InChI |
InChI=1S/C20H22N2O6/c1-11(22(24)20(21)23)12-5-6-15-13(7-12)8-16(28-15)14-9-17(25-2)19(27-4)18(10-14)26-3/h5-11,24H,1-4H3,(H2,21,23)
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| InChIKey |
ZWXHXOHBNIWKQK-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