General Information of the Compound
| Compound ID |
CP0082776
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| Compound Name |
1-[(4-methoxyphenyl)methyl]-N-[4-[(7-methoxy-1,2,3,4-tetrahydroacridin-9-yl)amino]butyl]-4-oxoquinoline-3-carboxamide
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| Structure |
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| Formula |
C36H38N4O4
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| Molecular Weight |
590.724
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| Canonical SMILES |
COc1ccc(Cn2cc(C(=O)NCCCCNc3c4CCCCc4nc4ccc(OC)cc34)c(=O)c3ccccc23)cc1
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| InChI |
InChI=1S/C36H38N4O4/c1-43-25-15-13-24(14-16-25)22-40-23-30(35(41)28-10-4-6-12-33(28)40)36(42)38-20-8-7-19-37-34-27-9-3-5-11-31(27)39-32-18-17-26(44-2)21-29(32)34/h4,6,10,12-18,21,23H,3,5,7-9,11,19-20,22H2,1-2H3,(H,37,39)(H,38,42)
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| InChIKey |
ZSHSEWWPKNLRHP-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