General Information of the Compound
| Compound ID |
CP0314376
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| Compound Name |
1-[(4-methoxyphenyl)methyl]-N-[8-[(7-methoxy-1,2,3,4-tetrahydroacridin-9-yl)amino]octyl]-4-oxoquinoline-3-carboxamide
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| Structure |
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| Formula |
C40H46N4O4
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| Molecular Weight |
646.832
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| Canonical SMILES |
COc1ccc(Cn2cc(C(=O)NCCCCCCCCNc3c4CCCCc4nc4ccc(OC)cc34)c(=O)c3ccccc23)cc1
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| InChI |
InChI=1S/C40H46N4O4/c1-47-29-19-17-28(18-20-29)26-44-27-34(39(45)32-14-8-10-16-37(32)44)40(46)42-24-12-6-4-3-5-11-23-41-38-31-13-7-9-15-35(31)43-36-22-21-30(48-2)25-33(36)38/h8,10,14,16-22,25,27H,3-7,9,11-13,15,23-24,26H2,1-2H3,(H,41,43)(H,42,46)
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| InChIKey |
VLANAFJEJWETOO-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