General Information of the Compound
| Compound ID |
CP0709454
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| Compound Name |
2-({[2-Isopropyl-1-(pyridin-4-yl)-1H-benzimidazol-6-yl]oxy}methyl)quinoline
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| Structure |
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| Formula |
C25H22N4O
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| Molecular Weight |
394.478
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| Canonical SMILES |
CC(C)c1nc2ccc(OCc3ccc4ccccc4n3)cc2n1-c1ccncc1
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| InChI |
InChI=1S/C25H22N4O/c1-17(2)25-28-23-10-9-21(15-24(23)29(25)20-11-13-26-14-12-20)30-16-19-8-7-18-5-3-4-6-22(18)27-19/h3-15,17H,16H2,1-2H3
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| InChIKey |
FDRUIRDXJMXGMP-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