General Information of the Compound
| Compound ID |
CP0431962
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| Compound Name |
1-benzyl-9-(trifluoromethyl)-1H,2H,3H,6H,7H-quinolino[7,6-b][1,4]oxazin-7-one
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| Structure |
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| Formula |
C19H15F3N2O2
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| Molecular Weight |
360.335
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| Canonical SMILES |
FC(F)(F)c1cc(=O)[nH]c2cc3OCCN(Cc4ccccc4)c3cc12
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| InChI |
InChI=1S/C19H15F3N2O2/c20-19(21,22)14-9-18(25)23-15-10-17-16(8-13(14)15)24(6-7-26-17)11-12-4-2-1-3-5-12/h1-5,8-10H,6-7,11H2,(H,23,25)
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| InChIKey |
MOROQHBVBKVSID-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