General Information of the Compound
| Compound ID |
CP0396748
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| Compound Name |
3-[3-(2,4-difluorophenyl)phenyl]-6-phenyl-6-prop-2-enyl-1,3-oxazinan-2-one
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| Structure |
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| Formula |
C25H21F2NO2
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| Molecular Weight |
405.444
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| Canonical SMILES |
Fc1ccc(c(F)c1)-c1cccc(c1)N1CCC(CC=C)(OC1=O)c1ccccc1
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| InChI |
InChI=1S/C25H21F2NO2/c1-2-13-25(19-8-4-3-5-9-19)14-15-28(24(29)30-25)21-10-6-7-18(16-21)22-12-11-20(26)17-23(22)27/h2-12,16-17H,1,13-15H2
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| InChIKey |
NAJQWCLNVIYERJ-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