General Information of the Compound
| Compound ID |
CP0527756
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| Compound Name |
4-(8-Methyl-4-oxo-3,4-dihydro-quinazolin-2-yl)-benzoic acid methyl ester
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| Structure |
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| Formula |
C17H14N2O3
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| Molecular Weight |
294.31
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| Canonical SMILES |
COC(=O)c1ccc(cc1)-c1nc2c(C)cccc2c(=O)[nH]1
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| InChI |
InChI=1S/C17H14N2O3/c1-10-4-3-5-13-14(10)18-15(19-16(13)20)11-6-8-12(9-7-11)17(21)22-2/h3-9H,1-2H3,(H,18,19,20)
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| InChIKey |
INIBNMGTPXJURH-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