General Information of the Compound
| Compound ID |
CP0437499
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| Compound Name |
Benzo[1,3]dioxol-5-yl-(3,4-dimethoxy-acridin-9-yl)-acetic acid methyl ester
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| Structure |
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| Formula |
C25H21NO6
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| Molecular Weight |
431.444
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| Canonical SMILES |
COC(=O)C(c1ccc2OCOc2c1)c1c2ccccc2nc2c(OC)c(OC)ccc12
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| InChI |
InChI=1S/C25H21NO6/c1-28-19-11-9-16-22(15-6-4-5-7-17(15)26-23(16)24(19)29-2)21(25(27)30-3)14-8-10-18-20(12-14)32-13-31-18/h4-12,21H,13H2,1-3H3
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| InChIKey |
WJKGYOIXXYWTDD-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