General Information of the Compound
| Compound ID |
CP0574433
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| Compound Name |
N-[8-[(6-chloro-1,2,3,4-tetrahydroacridin-9-yl)amino]octyl]-2-(7-methoxy-2-methyl-6-phenylmethoxy-3,4-dihydrochromen-2-yl)acetamide
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| Formula |
C41H50ClN3O4
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| Molecular Weight |
684.321
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| Canonical SMILES |
COc1cc2OC(C)(CC(=O)NCCCCCCCCNc3c4CCCCc4nc4cc(Cl)ccc34)CCc2cc1OCc1ccccc1
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| InChI |
InChI=1S/C41H50ClN3O4/c1-41(21-20-30-24-38(37(47-2)26-36(30)49-41)48-28-29-14-8-7-9-15-29)27-39(46)43-22-12-5-3-4-6-13-23-44-40-32-16-10-11-17-34(32)45-35-25-31(42)18-19-33(35)40/h7-9,14-15,18-19,24-26H,3-6,10-13,16-17,20-23,27-28H2,1-2H3,(H,43,46)(H,44,45)
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| InChIKey |
GTUYMOXZKSCJQY-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