General Information of the Compound
| Compound ID |
CP0411072
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| Compound Name |
3-benzyl-2-[4-methoxy-3-[(4-methoxyphenoxy)methyl]phenyl]-1,2-dihydroquinazolin-4-one
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| Structure |
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| Formula |
C30H28N2O4
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| Molecular Weight |
480.564
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| Canonical SMILES |
COc1ccc(OCc2cc(ccc2OC)C2Nc3ccccc3C(=O)N2Cc2ccccc2)cc1
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| InChI |
InChI=1S/C30H28N2O4/c1-34-24-13-15-25(16-14-24)36-20-23-18-22(12-17-28(23)35-2)29-31-27-11-7-6-10-26(27)30(33)32(29)19-21-8-4-3-5-9-21/h3-18,29,31H,19-20H2,1-2H3
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| InChIKey |
GNMRMJHARVGSIT-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