General Information of the Compound
| Compound ID |
CP0666463
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| Compound Name |
2-({[1-(Pyridin-4-ylmethyl)-1H-benzimidazol-6-yl]oxy}methyl)quinoline
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| Structure |
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| Formula |
C23H18N4O
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| Molecular Weight |
366.424
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| Canonical SMILES |
c1ccc2nc(COc3ccc4ncn(Cc5ccncc5)c4c3)ccc2c1
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| InChI |
InChI=1S/C23H18N4O/c1-2-4-21-18(3-1)5-6-19(26-21)15-28-20-7-8-22-23(13-20)27(16-25-22)14-17-9-11-24-12-10-17/h1-13,16H,14-15H2
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| InChIKey |
LBLWFPNDOVTIFN-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