General Information of the Compound
| Compound ID |
CP0509238
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| Compound Name |
2-N-(4-bromo-2-methoxy-6-methylphenyl)-4-N,4-N-diethyl-3-methylbenzimidazole-2,4-diamine;hydrochloride
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| Structure |
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| Formula |
C20H26BrClN4O
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| Molecular Weight |
453.812
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| Canonical SMILES |
Cl.CCN(CC)c1cccc2nc(Nc3c(C)cc(Br)cc3OC)n(C)c12
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| InChI |
InChI=1S/C20H25BrN4O.ClH/c1-6-25(7-2)16-10-8-9-15-19(16)24(4)20(22-15)23-18-13(3)11-14(21)12-17(18)26-5;/h8-12H,6-7H2,1-5H3,(H,22,23);1H
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| InChIKey |
SDTKPJLLGHZWFC-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