General Information of the Compound
| Compound ID |
CP0458379
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| Compound Name |
N-[2-(3,4-dimethoxyphenyl)ethyl]-6-methoxy-9-oxo-10H-acridine-4-carboxamide
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| Structure |
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| Formula |
C25H24N2O5
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| Molecular Weight |
432.476
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| Canonical SMILES |
COc1ccc2c(c1)[nH]c1c(cccc1c2=O)C(=O)NCCc1ccc(OC)c(OC)c1
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| InChI |
InChI=1S/C25H24N2O5/c1-30-16-8-9-17-20(14-16)27-23-18(24(17)28)5-4-6-19(23)25(29)26-12-11-15-7-10-21(31-2)22(13-15)32-3/h4-10,13-14H,11-12H2,1-3H3,(H,26,29)(H,27,28)
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| InChIKey |
RRRJUZUVULGLAB-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