General Information of the Compound
| Compound ID |
CP0533047
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| Compound Name |
3-chloro-1-(2-methylpropyl)-4-(4-phenylpiperidin-1-yl)pyridin-2-one
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| Structure |
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| Formula |
C20H25ClN2O
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| Molecular Weight |
344.886
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| Canonical SMILES |
CC(C)Cn1ccc(N2CCC(CC2)c2ccccc2)c(Cl)c1=O
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| InChI |
InChI=1S/C20H25ClN2O/c1-15(2)14-23-13-10-18(19(21)20(23)24)22-11-8-17(9-12-22)16-6-4-3-5-7-16/h3-7,10,13,15,17H,8-9,11-12,14H2,1-2H3
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| InChIKey |
JDKWNHPOHQWVSN-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