General Information of the Compound
Compound ID |
CP0440148
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Compound Name |
4'-(2-(5-butyl-1H-imidazol-2-yl)-3-methylbutyl)biphenyl-2-carboxylic acid
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Structure |
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Formula |
C25H30N2O2
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Molecular Weight |
390.527
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Canonical SMILES |
CCCCc1cnc([nH]1)C(Cc1ccc(cc1)-c1ccccc1C(O)=O)C(C)C
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InChI |
InChI=1S/C25H30N2O2/c1-4-5-8-20-16-26-24(27-20)23(17(2)3)15-18-11-13-19(14-12-18)21-9-6-7-10-22(21)25(28)29/h6-7,9-14,16-17,23H,4-5,8,15H2,1-3H3,(H,26,27)(H,28,29)
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InChIKey |
FGLQQIPVIQVKNL-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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
Protein ID: PT05422, Bombesin receptor subtype-3
Protein ID: PT01996, Bombesin receptor subtype-3