General Information of the Compound
| Compound ID |
CP0274862
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| Compound Name |
3-arylquinazolinone, 1aam
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| Structure |
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| Formula |
C15H9F3N2O6S
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| Molecular Weight |
402.306
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| Canonical SMILES |
Oc1ccc(cc1)-n1cnc2cc(O)cc(OS(=O)(=O)C(F)(F)F)c2c1=O
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| InChI |
InChI=1S/C15H9F3N2O6S/c16-15(17,18)27(24,25)26-12-6-10(22)5-11-13(12)14(23)20(7-19-11)8-1-3-9(21)4-2-8/h1-7,21-22H
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| InChIKey |
BBDMJGPZMMWAJY-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