General Information of the Compound
Compound ID |
CP0473938
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Compound Name |
8-[1-(6,8-difluoro-2,3-dihydro-1,4-benzoxazin-4-yl)ethyl]-N,N-dimethyl-2-morpholin-4-yl-4-oxochromene-6-carboxamide
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Structure |
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Formula |
C26H27F2N3O5
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Molecular Weight |
499.514
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Canonical SMILES |
CC(N1CCOc2c(F)cc(F)cc12)c1cc(cc2c1oc(cc2=O)N1CCOCC1)C(=O)N(C)C
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InChI |
InChI=1S/C26H27F2N3O5/c1-15(31-6-9-35-25-20(28)12-17(27)13-21(25)31)18-10-16(26(33)29(2)3)11-19-22(32)14-23(36-24(18)19)30-4-7-34-8-5-30/h10-15H,4-9H2,1-3H3
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InChIKey |
VOJWUCSPYMNKKM-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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