General Information of the Compound
| Compound ID |
CP0417915
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| Compound Name |
1-[3-(dimethylamino)propyl]-2-[(4-ethoxyphenyl)methyl]-N,N-diethylbenzimidazole-5-carboxamide
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| Structure |
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| Formula |
C26H36N4O2
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| Molecular Weight |
436.6
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| Canonical SMILES |
CCOc1ccc(Cc2nc3cc(ccc3n2CCCN(C)C)C(=O)N(CC)CC)cc1
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| InChI |
InChI=1S/C26H36N4O2/c1-6-29(7-2)26(31)21-12-15-24-23(19-21)27-25(30(24)17-9-16-28(4)5)18-20-10-13-22(14-11-20)32-8-3/h10-15,19H,6-9,16-18H2,1-5H3
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| InChIKey |
VDMQBZFCSFSFOR-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