General Information of the Compound
| Compound ID |
CP0545330
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| Compound Name |
6-Bromo-4-oxo-2-[3-(quinolin-2-ylmethoxy)-phenyl]-4H-chromene-8-carboxylic acid
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| Structure |
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| Formula |
C26H16BrNO5
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| Molecular Weight |
502.32
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| Canonical SMILES |
OC(=O)c1cc(Br)cc2c1oc(cc2=O)-c1cccc(OCc2ccc3ccccc3n2)c1
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| InChI |
InChI=1S/C26H16BrNO5/c27-17-11-20-23(29)13-24(33-25(20)21(12-17)26(30)31)16-5-3-6-19(10-16)32-14-18-9-8-15-4-1-2-7-22(15)28-18/h1-13H,14H2,(H,30,31)
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| InChIKey |
RWSGESKPMHFVQG-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