General Information of the Compound
| Compound ID |
CP0440144
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| Compound Name |
4'-(2-(5-(2-ethyl-2-methylbutyl)-1H-imidazol-2-yl)ethyl)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 |
CCC(C)(CC)Cc1cnc(CCc2ccc(cc2)-c2ccccc2C(O)=O)[nH]1
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| InChI |
InChI=1S/C25H30N2O2/c1-4-25(3,5-2)16-20-17-26-23(27-20)15-12-18-10-13-19(14-11-18)21-8-6-7-9-22(21)24(28)29/h6-11,13-14,17H,4-5,12,15-16H2,1-3H3,(H,26,27)(H,28,29)
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| InChIKey |
NHRKZINOOWUIJM-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
Protein ID: PT05422, Bombesin receptor subtype-3
Protein ID: PT01996, Bombesin receptor subtype-3