General Information of the Compound
| Compound ID |
CP0165027
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| Compound Name |
1-[(4-methoxyphenyl)methyl]-4-oxo-N-[6-(1,2,3,4-tetrahydroacridin-9-ylamino)hexyl]quinoline-3-carboxamide
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| Structure |
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| Formula |
C37H40N4O3
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| Molecular Weight |
588.752
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| Canonical SMILES |
COc1ccc(Cn2cc(C(=O)NCCCCCCNc3c4CCCCc4nc4ccccc34)c(=O)c3ccccc23)cc1
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| InChI |
InChI=1S/C37H40N4O3/c1-44-27-20-18-26(19-21-27)24-41-25-31(36(42)30-14-6-9-17-34(30)41)37(43)39-23-11-3-2-10-22-38-35-28-12-4-7-15-32(28)40-33-16-8-5-13-29(33)35/h4,6-7,9,12,14-15,17-21,25H,2-3,5,8,10-11,13,16,22-24H2,1H3,(H,38,40)(H,39,43)
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| InChIKey |
JXQZTEXAQLHFFG-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