General Information of the Compound
| Compound ID |
CP0484608
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| Compound Name |
8-bromo-3-(4-methoxyphenyl)pyrimido[1,6-a]benzimidazole
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| Structure |
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| Formula |
C17H12BrN3O
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| Molecular Weight |
354.207
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| Canonical SMILES |
COc1ccc(cc1)-c1cc2nc3ccc(Br)cc3n2cn1
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| InChI |
InChI=1S/C17H12BrN3O/c1-22-13-5-2-11(3-6-13)15-9-17-20-14-7-4-12(18)8-16(14)21(17)10-19-15/h2-10H,1H3
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| InChIKey |
LXFDDRLDJDMVTP-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