General Information of the Compound
| Compound ID |
CP0319318
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| Compound Name |
N-[7-[(6-chloro-1,2,3,4-tetrahydroacridin-9-yl)amino]heptyl]-2-(6-hydroxy-7-methoxy-2-methyl-3,4-dihydrochromen-2-yl)acetamide
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| Formula |
C33H42ClN3O4
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| Molecular Weight |
580.169
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| Canonical SMILES |
COc1cc2OC(C)(CC(=O)NCCCCCCCNc3c4CCCCc4nc4cc(Cl)ccc34)CCc2cc1O
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| InChI |
InChI=1S/C33H42ClN3O4/c1-33(15-14-22-18-28(38)30(40-2)20-29(22)41-33)21-31(39)35-16-8-4-3-5-9-17-36-32-24-10-6-7-11-26(24)37-27-19-23(34)12-13-25(27)32/h12-13,18-20,38H,3-11,14-17,21H2,1-2H3,(H,35,39)(H,36,37)
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| InChIKey |
NFMKVTKMAZTQRZ-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