General Information of the Compound
| Compound ID |
CP0389885
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| Compound Name |
1-(6-oxo-4,5-dihydro-1H-pyrimidin-2-yl)-3-[3-(trifluoromethyl)phenyl]urea
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| Structure |
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| Formula |
C12H11F3N4O2
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| Molecular Weight |
300.24
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| Canonical SMILES |
FC(F)(F)c1cccc(NC(=O)NC2=NC(=O)CCN2)c1
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| InChI |
InChI=1S/C12H11F3N4O2/c13-12(14,15)7-2-1-3-8(6-7)17-11(21)19-10-16-5-4-9(20)18-10/h1-3,6H,4-5H2,(H3,16,17,18,19,20,21)
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| InChIKey |
HHWCFIJUESFSTC-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