General Information of the Compound
| Compound ID |
CP0461884
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| Compound Name |
2-Benzo[1,3]dioxol-5-yl-4-propoxy-2H-chromene-3-carboxylic acid
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| Structure |
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| Formula |
C20H18O6
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| Molecular Weight |
354.358
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| Canonical SMILES |
CCCOC1=C(C(Oc2ccccc12)c1ccc2OCOc2c1)C(O)=O
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| InChI |
InChI=1S/C20H18O6/c1-2-9-23-19-13-5-3-4-6-14(13)26-18(17(19)20(21)22)12-7-8-15-16(10-12)25-11-24-15/h3-8,10,18H,2,9,11H2,1H3,(H,21,22)
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| InChIKey |
WESUKUIFGNEJJQ-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