General Information of the Compound
| Compound ID |
CP0387658
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| Compound Name |
3-(2-ethoxyphenyl)-2-[(4-methylpiperazin-1-yl)methyl]quinazolin-4-one
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| Structure |
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| Formula |
C22H26N4O2
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| Molecular Weight |
378.476
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| Canonical SMILES |
CCOc1ccccc1-n1c(CN2CCN(C)CC2)nc2ccccc2c1=O
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| InChI |
InChI=1S/C22H26N4O2/c1-3-28-20-11-7-6-10-19(20)26-21(16-25-14-12-24(2)13-15-25)23-18-9-5-4-8-17(18)22(26)27/h4-11H,3,12-16H2,1-2H3
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| InChIKey |
JTWPBQZMXSQRCM-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