General Information of the Compound
| Compound ID |
CP0401461
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| Compound Name |
4'-(2-(5-(3,3-dimethylbutyl)-1H-imidazol-2-yl)ethyl)biphenyl-2-carboxylic acid
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| Structure |
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| Formula |
C24H28N2O2
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| Molecular Weight |
376.5
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| Canonical SMILES |
CC(C)(C)CCc1cnc(CCc2ccc(cc2)-c2ccccc2C(O)=O)[nH]1
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| InChI |
InChI=1S/C24H28N2O2/c1-24(2,3)15-14-19-16-25-22(26-19)13-10-17-8-11-18(12-9-17)20-6-4-5-7-21(20)23(27)28/h4-9,11-12,16H,10,13-15H2,1-3H3,(H,25,26)(H,27,28)
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| InChIKey |
NYMDURHSWWLOQX-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