General Information of the Compound
| Compound ID |
CP0691680
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| Compound Name |
N-(2-Methoxyethyl)-N-methyl-N'-(6-pyridin-4-ylquinazolin-2-yl)benzene-1,4-diamine
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| Structure |
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| Formula |
C23H23N5O
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| Molecular Weight |
385.471
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| Canonical SMILES |
COCCN(C)c1ccc(Nc2ncc3cc(-c4ccncc4)ccc3n2)cc1
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| InChI |
InChI=1S/C23H23N5O/c1-28(13-14-29-2)21-6-4-20(5-7-21)26-23-25-16-19-15-18(3-8-22(19)27-23)17-9-11-24-12-10-17/h3-12,15-16H,13-14H2,1-2H3,(H,25,26,27)
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| InChIKey |
WTCDINHTJWFNSD-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