General Information of the Compound
| Compound ID |
CP0569888
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| Compound Name |
6-bromo-2-[(4-bromo-2-fluorophenyl)methyl]-3,4-dihydropyrazino[1,2-a]benzimidazol-1-one
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| Structure |
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| Formula |
C17H12Br2FN3O
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| Molecular Weight |
453.109
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| Canonical SMILES |
Fc1cc(Br)ccc1CN1CCn2c(nc3cccc(Br)c23)C1=O
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| InChI |
InChI=1S/C17H12Br2FN3O/c18-11-5-4-10(13(20)8-11)9-22-6-7-23-15-12(19)2-1-3-14(15)21-16(23)17(22)24/h1-5,8H,6-7,9H2
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| InChIKey |
SJSMRNAIDNGNBW-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