General Information of the Compound
| Compound ID |
CP0462077
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| Compound Name |
3-oxo-N-[1-[4-(trifluoromethoxy)phenyl]propyl]-2,4-dihydroquinoxaline-1-carboxamide
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| Structure |
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| Formula |
C19H18F3N3O3
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| Molecular Weight |
393.365
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| Canonical SMILES |
CCC(NC(=O)N1CC(=O)Nc2ccccc12)c1ccc(OC(F)(F)F)cc1
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| InChI |
InChI=1S/C19H18F3N3O3/c1-2-14(12-7-9-13(10-8-12)28-19(20,21)22)24-18(27)25-11-17(26)23-15-5-3-4-6-16(15)25/h3-10,14H,2,11H2,1H3,(H,23,26)(H,24,27)
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| InChIKey |
QDSHMSGVROYLGN-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