General Information of the Compound
| Compound ID |
CP0028728
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| Compound Name |
4-(4-hydroxy-3-methylphenyl)-6-phenylpyrimidin-2(1H)-one
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| Structure |
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| Formula |
C17H14N2O2
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| Molecular Weight |
278.311
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| Canonical SMILES |
Cc1cc(ccc1O)-c1cc(nc(=O)[nH]1)-c1ccccc1
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| InChI |
InChI=1S/C17H14N2O2/c1-11-9-13(7-8-16(11)20)15-10-14(18-17(21)19-15)12-5-3-2-4-6-12/h2-10,20H,1H3,(H,18,19,21)
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| InChIKey |
MHPMAOLCNNEBOA-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