General Information of the Compound
| Compound ID |
CP0478492
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| Compound Name |
4-(Benzyloxy)-1-{4-[2-(piperidin-1-yl)ethoxy]phenyl}-pyridin-2(1H)-one
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| Structure |
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| Formula |
C25H28N2O3
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| Molecular Weight |
404.51
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| Canonical SMILES |
O=c1cc(OCc2ccccc2)ccn1-c1ccc(OCCN2CCCCC2)cc1
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| InChI |
InChI=1S/C25H28N2O3/c28-25-19-24(30-20-21-7-3-1-4-8-21)13-16-27(25)22-9-11-23(12-10-22)29-18-17-26-14-5-2-6-15-26/h1,3-4,7-13,16,19H,2,5-6,14-15,17-18,20H2
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| InChIKey |
LOVAEQYMKDVCHF-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: PT01027, Melanin-concentrating hormone receptor 1
Protein ID: PT00897, Potassium voltage-gated channel subfamily H member 2