General Information of the Compound
| Compound ID |
CP0162630
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| Compound Name |
N-[2-(methylamino)quinolin-6-yl]-3-[4-(trifluoromethyl)phenyl]propanamide
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| Structure |
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| Formula |
C20H18F3N3O
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| Molecular Weight |
373.378
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| Canonical SMILES |
CNc1ccc2cc(NC(=O)CCc3ccc(cc3)C(F)(F)F)ccc2n1
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| InChI |
InChI=1S/C20H18F3N3O/c1-24-18-10-5-14-12-16(8-9-17(14)26-18)25-19(27)11-4-13-2-6-15(7-3-13)20(21,22)23/h2-3,5-10,12H,4,11H2,1H3,(H,24,26)(H,25,27)
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| InChIKey |
VXMXEDWIHDHRKH-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