General Information of the Compound
| Compound ID |
CP0846753
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| Compound Name |
1-(2-(benzyloxy)-5-bromobenzyl)-1H-imidazole-5-carboxylic acid
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| Structure |
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| Formula |
C18H15BrN2O3
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| Molecular Weight |
387.233
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| Canonical SMILES |
O=C(O)c1cncn1Cc1cc(Br)ccc1OCc1ccccc1
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| InChI |
InChI=1S/C18H15BrN2O3/c19-15-6-7-17(24-11-13-4-2-1-3-5-13)14(8-15)10-21-12-20-9-16(21)18(22)23/h1-9,12H,10-11H2,(H,22,23)
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| InChIKey |
JMZRTWKYYHKYBJ-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