General Information of the Compound
| Compound ID |
CP0553444
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| Compound Name |
N-[2-[2-[2-[(6-chloro-1,2,3,4-tetrahydroacridin-9-yl)amino]ethoxy]ethoxy]ethyl]-2-(6-hydroxy-7-methoxy-2-methyl-3,4-dihydrochromen-2-yl)acetamide
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| Formula |
C32H40ClN3O6
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| Molecular Weight |
598.14
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| Canonical SMILES |
COc1cc2OC(C)(CC(=O)NCCOCCOCCNc3c4CCCCc4nc4cc(Cl)ccc34)CCc2cc1O
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| InChI |
InChI=1S/C32H40ClN3O6/c1-32(10-9-21-17-27(37)29(39-2)19-28(21)42-32)20-30(38)34-11-13-40-15-16-41-14-12-35-31-23-5-3-4-6-25(23)36-26-18-22(33)7-8-24(26)31/h7-8,17-19,37H,3-6,9-16,20H2,1-2H3,(H,34,38)(H,35,36)
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| InChIKey |
JNVGOUUUZBVXPV-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