General Information of the Compound
| Compound ID |
CP0364708
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| Compound Name |
N-[8-[(6-chloro-1,2,3,4-tetrahydroacridin-9-yl)amino]octyl]-3-(6-hydroxy-7-methoxy-2-methyl-3,4-dihydrochromen-2-yl)propanamide
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| Formula |
C35H46ClN3O4
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| Molecular Weight |
608.223
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| Canonical SMILES |
COc1cc2OC(C)(CCC(=O)NCCCCCCCCNc3c4CCCCc4nc4cc(Cl)ccc34)CCc2cc1O
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| InChI |
InChI=1S/C35H46ClN3O4/c1-35(17-15-24-21-30(40)32(42-2)23-31(24)43-35)18-16-33(41)37-19-9-5-3-4-6-10-20-38-34-26-11-7-8-12-28(26)39-29-22-25(36)13-14-27(29)34/h13-14,21-23,40H,3-12,15-20H2,1-2H3,(H,37,41)(H,38,39)
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| InChIKey |
JQKJWDFQBYGCOQ-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