General Information of the Compound
| Compound ID |
CP0077509
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| Compound Name |
1-[(4-methoxyphenyl)methyl]-4-oxo-N-[3-(1,2,3,4-tetrahydroacridin-9-ylamino)propyl]quinoline-3-carboxamide
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| Structure |
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| Formula |
C34H34N4O3
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| Molecular Weight |
546.671
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| Canonical SMILES |
COc1ccc(Cn2cc(C(=O)NCCCNc3c4CCCCc4nc4ccccc34)c(=O)c3ccccc23)cc1
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| InChI |
InChI=1S/C34H34N4O3/c1-41-24-17-15-23(16-18-24)21-38-22-28(33(39)27-11-4-7-14-31(27)38)34(40)36-20-8-19-35-32-25-9-2-5-12-29(25)37-30-13-6-3-10-26(30)32/h2,4-5,7,9,11-12,14-18,22H,3,6,8,10,13,19-21H2,1H3,(H,35,37)(H,36,40)
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| InChIKey |
KVDGLEHCVWVBQY-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