General Information of the Compound
| Compound ID |
CP0146459
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| Compound Name |
3-arylquinazolinone, 1am
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| Structure |
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| Formula |
C14H9IN2O4
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| Molecular Weight |
396.14
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| Canonical SMILES |
Oc1ccc(cc1)-n1cnc2c(I)c(O)cc(O)c2c1=O
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| InChI |
InChI=1S/C14H9IN2O4/c15-12-10(20)5-9(19)11-13(12)16-6-17(14(11)21)7-1-3-8(18)4-2-7/h1-6,18-20H
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| InChIKey |
CTRQGFMTOJOIDH-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