General Information of the Compound
| Compound ID |
CP0426573
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| Compound Name |
6-(4-amino-2-methoxyphenyl)-3-[2-(2,5-dimethoxyphenyl)ethyl]quinazolin-4-one
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| Structure |
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| Formula |
C25H25N3O4
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| Molecular Weight |
431.492
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| Canonical SMILES |
COc1ccc(OC)c(CCn2cnc3ccc(cc3c2=O)-c2ccc(N)cc2OC)c1
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| InChI |
InChI=1S/C25H25N3O4/c1-30-19-6-9-23(31-2)17(12-19)10-11-28-15-27-22-8-4-16(13-21(22)25(28)29)20-7-5-18(26)14-24(20)32-3/h4-9,12-15H,10-11,26H2,1-3H3
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| InChIKey |
QBDAAIVUYJFOMZ-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