General Information of the Compound
| Compound ID |
CP0493107
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| Compound Name |
4-Oxo-2-[4-(quinazolin-2-ylmethoxy)-phenyl]-4H-chromene-8-carboxylic acid
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| Structure |
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| Formula |
C25H16N2O5
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| Molecular Weight |
424.412
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| Canonical SMILES |
OC(=O)c1cccc2c1oc(cc2=O)-c1ccc(OCc2ncc3ccccc3n2)cc1
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| InChI |
InChI=1S/C25H16N2O5/c28-21-12-22(32-24-18(21)5-3-6-19(24)25(29)30)15-8-10-17(11-9-15)31-14-23-26-13-16-4-1-2-7-20(16)27-23/h1-13H,14H2,(H,29,30)
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| InChIKey |
AECCUSOSVDWESX-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