General Information of the Compound
| Compound ID |
CP0155067
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| Compound Name |
N-(3,4-dimethoxyphenyl)-2-[1-(2-imidazol-1-ylpyrimidin-4-yl)piperidin-2-yl]acetamide
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| Structure |
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| Formula |
C22H26N6O3
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| Molecular Weight |
422.489
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| Canonical SMILES |
COc1ccc(NC(=O)CC2CCCCN2c2ccnc(n2)-n2ccnc2)cc1OC
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| InChI |
InChI=1S/C22H26N6O3/c1-30-18-7-6-16(13-19(18)31-2)25-21(29)14-17-5-3-4-11-28(17)20-8-9-24-22(26-20)27-12-10-23-15-27/h6-10,12-13,15,17H,3-5,11,14H2,1-2H3,(H,25,29)
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| InChIKey |
AYNOIPXHVJCQGG-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