General Information of the Compound
| Compound ID |
CP0718315
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| Compound Name |
2-{[(2-Isobutyl-1-phenyl-1H-benzimidazol-6-yl)oxy]methyl}quinoline
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| Structure |
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| Formula |
C27H25N3O
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| Molecular Weight |
407.517
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| Canonical SMILES |
CC(C)Cc1nc2ccc(OCc3ccc4ccccc4n3)cc2n1-c1ccccc1
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| InChI |
InChI=1S/C27H25N3O/c1-19(2)16-27-29-25-15-14-23(17-26(25)30(27)22-9-4-3-5-10-22)31-18-21-13-12-20-8-6-7-11-24(20)28-21/h3-15,17,19H,16,18H2,1-2H3
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| InChIKey |
RCLCJLXVDIQAAY-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