General Information of the Compound
| Compound ID |
CP0534638
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| Compound Name |
6-Bromo-4-oxo-2-[3-(quinazolin-2-ylmethoxy)-phenyl]-4H-chromene-8-carboxylic acid
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| Structure |
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| Formula |
C25H15BrN2O5
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| Molecular Weight |
503.308
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| Canonical SMILES |
OC(=O)c1cc(Br)cc2c1oc(cc2=O)-c1cccc(OCc2ncc3ccccc3n2)c1
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| InChI |
InChI=1S/C25H15BrN2O5/c26-16-9-18-21(29)11-22(33-24(18)19(10-16)25(30)31)14-5-3-6-17(8-14)32-13-23-27-12-15-4-1-2-7-20(15)28-23/h1-12H,13H2,(H,30,31)
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| InChIKey |
FEGCUSQYQHOKFE-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