General Information of the Compound
| Compound ID |
CP0528380
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| Compound Name |
1-methyl-6-(3-phenylpiperidin-1-yl)-4-(pyrimidin-4-yl)pyridin-2(1H)-one
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| Structure |
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| Formula |
C21H22N4O
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| Molecular Weight |
346.434
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| Canonical SMILES |
Cn1c(cc(cc1=O)-c1ccncn1)N1CCCC(C1)c1ccccc1
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| InChI |
InChI=1S/C21H22N4O/c1-24-20(12-18(13-21(24)26)19-9-10-22-15-23-19)25-11-5-8-17(14-25)16-6-3-2-4-7-16/h2-4,6-7,9-10,12-13,15,17H,5,8,11,14H2,1H3
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| InChIKey |
NHOFDLRPFQRUEJ-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