General Information of the Compound
| Compound ID |
CP0441127
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| Compound Name |
4-chloro-N-(4-chloro-2-methoxy-6-methylphenyl)-1-methyl-7-pentan-3-ylbenzimidazol-2-amine
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| Structure |
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| Formula |
C21H25Cl2N3O
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| Molecular Weight |
406.357
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| Canonical SMILES |
CCC(CC)c1ccc(Cl)c2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12
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| InChI |
InChI=1S/C21H25Cl2N3O/c1-6-13(7-2)15-8-9-16(23)19-20(15)26(4)21(25-19)24-18-12(3)10-14(22)11-17(18)27-5/h8-11,13H,6-7H2,1-5H3,(H,24,25)
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| InChIKey |
IOPWDZODVKYZNG-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