General Information of the Compound
| Compound ID |
CP0363227
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| Compound Name |
N-[7-[(6-chloro-1,2,3,4-tetrahydroacridin-9-yl)amino]heptyl]-2-(7-methoxy-2-methyl-6-phenylmethoxy-3,4-dihydrochromen-2-yl)acetamide
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| Formula |
C40H48ClN3O4
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| Molecular Weight |
670.294
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| Canonical SMILES |
COc1cc2OC(C)(CC(=O)NCCCCCCCNc3c4CCCCc4nc4cc(Cl)ccc34)CCc2cc1OCc1ccccc1
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| InChI |
InChI=1S/C40H48ClN3O4/c1-40(20-19-29-23-37(36(46-2)25-35(29)48-40)47-27-28-13-7-6-8-14-28)26-38(45)42-21-11-4-3-5-12-22-43-39-31-15-9-10-16-33(31)44-34-24-30(41)17-18-32(34)39/h6-8,13-14,17-18,23-25H,3-5,9-12,15-16,19-22,26-27H2,1-2H3,(H,42,45)(H,43,44)
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| InChIKey |
JYPJKGLZUCPORL-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