General Information of the Compound
| Compound ID |
CP0152981
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| Compound Name |
2-[(4-ethoxyphenyl)methyl]-1-(3-methylbutyl)-N-[2-[2-[2-(1,2,3,4-tetrahydroacridin-9-ylamino)ethoxy]ethoxy]ethyl]benzimidazole-5-carboxamide
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| Structure |
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| Formula |
C41H51N5O4
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| Molecular Weight |
677.89
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| Canonical SMILES |
CCOc1ccc(Cc2nc3cc(ccc3n2CCC(C)C)C(=O)NCCOCCOCCNc2c3CCCCc3nc3ccccc23)cc1
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| InChI |
InChI=1S/C41H51N5O4/c1-4-50-32-16-13-30(14-17-32)27-39-45-37-28-31(15-18-38(37)46(39)22-19-29(2)3)41(47)43-21-24-49-26-25-48-23-20-42-40-33-9-5-7-11-35(33)44-36-12-8-6-10-34(36)40/h5,7,9,11,13-18,28-29H,4,6,8,10,12,19-27H2,1-3H3,(H,42,44)(H,43,47)
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| InChIKey |
KATPQNPJPWWNSE-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