General Information of the Compound
| Compound ID |
CP0535270
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| Compound Name |
3-[1-[4-(3-nitrophenyl)phenoxy]-4-pyridin-4-ylbutan-2-yl]-1,3-oxazolidin-2-one
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| Structure |
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| Formula |
C13H14I2N2O
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| Molecular Weight |
468.076
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| Canonical SMILES |
CN(C)Cc1cc(I)c(c(I)c1O)-n1cccc1
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| InChI |
InChI=1S/C24H23N3O5/c28-24-26(14-15-31-24)22(7-4-18-10-12-25-13-11-18)17-32-23-8-5-19(6-9-23)20-2-1-3-21(16-20)27(29)30/h1-3,5-6,8-13,16,22H,4,7,14-15,17H2
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| InChIKey |
DSGSKYFQLYDNTD-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