General Information of the Compound
| Compound ID |
CP0401621
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| Compound Name |
N-[2-(4-methoxyphenyl)ethyl]-2-(8-methyl-4-oxoquinazolin-3-yl)acetamide
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| Structure |
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| Formula |
C20H21N3O3
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| Molecular Weight |
351.406
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| Canonical SMILES |
COc1ccc(CCNC(=O)Cn2cnc3c(C)cccc3c2=O)cc1
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| InChI |
InChI=1S/C20H21N3O3/c1-14-4-3-5-17-19(14)22-13-23(20(17)25)12-18(24)21-11-10-15-6-8-16(26-2)9-7-15/h3-9,13H,10-12H2,1-2H3,(H,21,24)
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| InChIKey |
JVRMWCAONJEANX-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