General Information of the Compound
| Compound ID |
CP0522073
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| Compound Name |
N-[4-(2-aminoethoxy)-3-(2-methylpyrazol-3-yl)phenyl]-3-methoxybenzamide
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| Structure |
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| Formula |
C20H22N4O3
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| Molecular Weight |
366.421
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| Canonical SMILES |
COc1cccc(c1)C(=O)Nc1ccc(OCCN)c(c1)-c1ccnn1C
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| InChI |
InChI=1S/C20H22N4O3/c1-24-18(8-10-22-24)17-13-15(6-7-19(17)27-11-9-21)23-20(25)14-4-3-5-16(12-14)26-2/h3-8,10,12-13H,9,11,21H2,1-2H3,(H,23,25)
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| InChIKey |
IKKJKPILQDHCDI-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: PT00825, 5-hydroxytryptamine receptor 2A
Protein ID: PT00939, 5-hydroxytryptamine receptor 2C