General Information of the Compound
| Compound ID |
CP0567958
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| Compound Name |
1-(2-oxo-1H-quinolin-5-yl)-3-[[2-(3-propan-2-ylphenyl)-6-(trifluoromethyl)pyridin-3-yl]methyl]urea
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| Formula |
C26H23F3N4O2
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| Molecular Weight |
480.49
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| Canonical SMILES |
CC(C)c1cccc(c1)-c1nc(ccc1CNC(=O)Nc1cccc2[nH]c(=O)ccc12)C(F)(F)F
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| InChI |
InChI=1S/C26H23F3N4O2/c1-15(2)16-5-3-6-17(13-16)24-18(9-11-22(33-24)26(27,28)29)14-30-25(35)32-21-8-4-7-20-19(21)10-12-23(34)31-20/h3-13,15H,14H2,1-2H3,(H,31,34)(H2,30,32,35)
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| InChIKey |
JXRUHXJZDCWLDX-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