General Information of the Compound
| Compound ID |
CP0534899
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| Compound Name |
2-N-(4-chloro-2-methoxy-6-methylphenyl)-4-N-(4-chlorophenyl)-4-N-(2-methoxyethyl)-3-methylbenzimidazole-2,4-diamine;hydrochloride
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| Structure |
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| Formula |
C25H27Cl3N4O2
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| Molecular Weight |
521.876
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| Canonical SMILES |
Cl.COCCN(c1ccc(Cl)cc1)c1cccc2nc(Nc3c(C)cc(Cl)cc3OC)n(C)c12
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| InChI |
InChI=1S/C25H26Cl2N4O2.ClH/c1-16-14-18(27)15-22(33-4)23(16)29-25-28-20-6-5-7-21(24(20)30(25)2)31(12-13-32-3)19-10-8-17(26)9-11-19;/h5-11,14-15H,12-13H2,1-4H3,(H,28,29);1H
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| InChIKey |
CWNWCOHYWIARBH-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