General Information of the Compound
| Compound ID |
CP0570090
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| Compound Name |
1-(2-oxo-1H-quinolin-5-yl)-3-[[2-(3-propan-2-ylphenyl)-5-(trifluoromethyl)pyrazol-3-yl]methyl]urea
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| Formula |
C24H22F3N5O2
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| Molecular Weight |
469.467
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| Canonical SMILES |
CC(C)c1cccc(c1)-n1nc(cc1CNC(=O)Nc1cccc2[nH]c(=O)ccc12)C(F)(F)F
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| InChI |
InChI=1S/C24H22F3N5O2/c1-14(2)15-5-3-6-16(11-15)32-17(12-21(31-32)24(25,26)27)13-28-23(34)30-20-8-4-7-19-18(20)9-10-22(33)29-19/h3-12,14H,13H2,1-2H3,(H,29,33)(H2,28,30,34)
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| InChIKey |
FZDLIOQXLTYMPH-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