General Information of the Compound
| Compound ID |
CP0473572
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| Compound Name |
3-[3-(2,4-difluorophenyl)phenyl]-6-(3-hydroxypropyl)-6-phenyl-1,3-oxazinan-2-one
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| Structure |
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| Formula |
C25H23F2NO3
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| Molecular Weight |
423.459
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| Canonical SMILES |
OCCCC1(CCN(C(=O)O1)c1cccc(c1)-c1ccc(F)cc1F)c1ccccc1
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| InChI |
InChI=1S/C25H23F2NO3/c26-20-10-11-22(23(27)17-20)18-6-4-9-21(16-18)28-14-13-25(12-5-15-29,31-24(28)30)19-7-2-1-3-8-19/h1-4,6-11,16-17,29H,5,12-15H2
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| InChIKey |
TYQJYQYIJIVXSP-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