General Information of the Compound
| Compound ID |
CP0545332
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| Compound Name |
4-oxo-8-(4-(quinolin-2-ylmethoxy)benzylcarbamoyl)-4H-chromene-2-carboxylic acid
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| Structure |
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| Formula |
C28H20N2O6
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| Molecular Weight |
480.476
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| Canonical SMILES |
OC(=O)c1cc(=O)c2cccc(C(=O)NCc3ccc(OCc4ccc5ccccc5n4)cc3)c2o1
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| InChI |
InChI=1S/C28H20N2O6/c31-24-14-25(28(33)34)36-26-21(24)5-3-6-22(26)27(32)29-15-17-8-12-20(13-9-17)35-16-19-11-10-18-4-1-2-7-23(18)30-19/h1-14H,15-16H2,(H,29,32)(H,33,34)
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| InChIKey |
ZMZXNYUFWIFRSV-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