General Information of the Compound
| Compound ID |
CP0165128
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| Compound Name |
2-[(4-ethoxyphenyl)methyl]-N,N-diethyl-1-[5-(1,2,3,4-tetrahydroacridin-9-ylamino)pentyl]benzimidazole-5-carboxamide
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| Structure |
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| Formula |
C39H47N5O2
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| Molecular Weight |
617.838
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| Canonical SMILES |
CCOc1ccc(Cc2nc3cc(ccc3n2CCCCCNc2c3CCCCc3nc3ccccc23)C(=O)N(CC)CC)cc1
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| InChI |
InChI=1S/C39H47N5O2/c1-4-43(5-2)39(45)29-20-23-36-35(27-29)42-37(26-28-18-21-30(22-19-28)46-6-3)44(36)25-13-7-12-24-40-38-31-14-8-10-16-33(31)41-34-17-11-9-15-32(34)38/h8,10,14,16,18-23,27H,4-7,9,11-13,15,17,24-26H2,1-3H3,(H,40,41)
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| InChIKey |
GWZNJBBWDDNMOZ-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