General Information of the Compound
| Compound ID |
CP0431579
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| Compound Name |
2-[(4-ethoxyphenyl)methyl]-N,N-diethyl-1-[3-(1,2,3,4-tetrahydroacridin-9-ylamino)propyl]benzimidazole-5-carboxamide
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| Structure |
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| Formula |
C37H43N5O2
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| Molecular Weight |
589.784
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| Canonical SMILES |
CCOc1ccc(Cc2nc3cc(ccc3n2CCCNc2c3CCCCc3nc3ccccc23)C(=O)N(CC)CC)cc1
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| InChI |
InChI=1S/C37H43N5O2/c1-4-41(5-2)37(43)27-18-21-34-33(25-27)40-35(24-26-16-19-28(20-17-26)44-6-3)42(34)23-11-22-38-36-29-12-7-9-14-31(29)39-32-15-10-8-13-30(32)36/h7,9,12,14,16-21,25H,4-6,8,10-11,13,15,22-24H2,1-3H3,(H,38,39)
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| InChIKey |
ZVJIYGXYCVEXOA-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