General Information of the Compound
| Compound ID |
CP0548408
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| Compound Name |
1-benzyl-5-ethyl-2-(4-methylpiperidin-1-yl)benzimidazole
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| Structure |
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| Formula |
C22H27N3
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| Molecular Weight |
333.479
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| Canonical SMILES |
CCc1ccc2n(Cc3ccccc3)c(nc2c1)N1CCC(C)CC1
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| InChI |
InChI=1S/C22H27N3/c1-3-18-9-10-21-20(15-18)23-22(24-13-11-17(2)12-14-24)25(21)16-19-7-5-4-6-8-19/h4-10,15,17H,3,11-14,16H2,1-2H3
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| InChIKey |
IWHRIWJVEQXWJX-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