General Information of the Compound
| Compound ID |
CP0463425
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| Compound Name |
N-[10-(dimethylamino)decyl]-2-[(4-ethoxyphenyl)methyl]-1-(3-methylbutyl)benzimidazole-5-carboxamide
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| Structure |
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| Formula |
C34H52N4O2
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| Molecular Weight |
548.816
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| Canonical SMILES |
CCOc1ccc(Cc2nc3cc(ccc3n2CCC(C)C)C(=O)NCCCCCCCCCCN(C)C)cc1
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| InChI |
InChI=1S/C34H52N4O2/c1-6-40-30-18-15-28(16-19-30)25-33-36-31-26-29(17-20-32(31)38(33)24-21-27(2)3)34(39)35-22-13-11-9-7-8-10-12-14-23-37(4)5/h15-20,26-27H,6-14,21-25H2,1-5H3,(H,35,39)
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| InChIKey |
HJRTXLVNPHKZKY-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
Protein ID: PT01298, Cannabinoid receptor 1
Protein ID: PT00834, Cannabinoid receptor 2