General Information of the Compound
| Compound ID |
CP0557096
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| Compound Name |
2-[5,7-dimethoxy-4-oxo-2-(3,4,5-trimethoxyphenyl)chromen-3-yl]oxy-N-[(E)-(2-fluorophenyl)methylideneamino]acetamide
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| Structure |
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| Formula |
C29H27FN2O9
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| Molecular Weight |
566.538
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| Canonical SMILES |
COc1cc(OC)c2c(c1)oc(-c1cc(OC)c(OC)c(OC)c1)c(OCC(=O)N\N=C\c1ccccc1F)c2=O
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| InChI |
InChI=1S/C29H27FN2O9/c1-35-18-12-20(36-2)25-21(13-18)41-27(17-10-22(37-3)28(39-5)23(11-17)38-4)29(26(25)34)40-15-24(33)32-31-14-16-8-6-7-9-19(16)30/h6-14H,15H2,1-5H3,(H,32,33)/b31-14+
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| InChIKey |
OURAZCPBBAJBJA-XAZZYMPDSA-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