General Information of the Compound
| Compound ID |
CP0383774
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| Compound Name |
4-(1-Isopropyl-6-methoxy-2-oxo-1,2-dihydro-quinazolin-4-yl)-benzoic acid methyl ester
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| Structure |
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| Formula |
C20H20N2O4
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| Molecular Weight |
352.39
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| Canonical SMILES |
COC(=O)c1ccc(cc1)-c1nc(=O)n(C(C)C)c2ccc(OC)cc12
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| InChI |
InChI=1S/C20H20N2O4/c1-12(2)22-17-10-9-15(25-3)11-16(17)18(21-20(22)24)13-5-7-14(8-6-13)19(23)26-4/h5-12H,1-4H3
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| InChIKey |
IXKAKFWEQZXNCD-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