General Information of the Compound
| Compound ID |
CP0441375
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| Compound Name |
methyl 4-[4-oxo-2-(1-phenylethyl)-1,2-dihydroquinazolin-3-yl]benzoate
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| Structure |
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| Formula |
C24H22N2O3
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| Molecular Weight |
386.451
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| Canonical SMILES |
COC(=O)c1ccc(cc1)N1C(Nc2ccccc2C1=O)C(C)c1ccccc1
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| InChI |
InChI=1S/C24H22N2O3/c1-16(17-8-4-3-5-9-17)22-25-21-11-7-6-10-20(21)23(27)26(22)19-14-12-18(13-15-19)24(28)29-2/h3-16,22,25H,1-2H3
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| InChIKey |
XXBZVNPPIUPMNT-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