General Information of the Compound
| Compound ID |
CP0424756
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| Compound Name |
(R)-3-isobutyl-4-(2,2,2-trifluoroethyl)-10-(trifluoromethyl)-3,4-dihydro-2H-[1,4]oxazino[2,3-f]quinolin-8(7H)-one
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| Structure |
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| Formula |
C18H18F6N2O2
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| Molecular Weight |
408.342
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| Canonical SMILES |
CC(C)C[C@@H]1COc2c(ccc3[nH]c(=O)cc(c23)C(F)(F)F)N1CC(F)(F)F
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| InChI |
InChI=1S/C18H18F6N2O2/c1-9(2)5-10-7-28-16-13(26(10)8-17(19,20)21)4-3-12-15(16)11(18(22,23)24)6-14(27)25-12/h3-4,6,9-10H,5,7-8H2,1-2H3,(H,25,27)/t10-/m1/s1
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| InChIKey |
AVUDHCAEOCNSSR-SNVBAGLBSA-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