General Information of the Compound
| Compound ID |
CP0373918
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| Compound Name |
4'-(2-(5-((tetrahydro-2H-pyran-4-yl)methyl)-1H-imidazol-2-yl)ethyl)biphenyl-2-carboxylic acid
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| Structure |
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| Formula |
C24H26N2O3
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| Molecular Weight |
390.483
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| Canonical SMILES |
OC(=O)c1ccccc1-c1ccc(CCc2ncc(CC3CCOCC3)[nH]2)cc1
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| InChI |
InChI=1S/C24H26N2O3/c27-24(28)22-4-2-1-3-21(22)19-8-5-17(6-9-19)7-10-23-25-16-20(26-23)15-18-11-13-29-14-12-18/h1-6,8-9,16,18H,7,10-15H2,(H,25,26)(H,27,28)
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| InChIKey |
LJXLTARUYZNXPN-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