General Information of the Compound
| Compound ID |
CP0409644
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| Compound Name |
1-methyl-3-[1-[4-(3-nitrophenyl)phenoxy]-4-pyridin-4-ylbutan-2-yl]imidazolidine-2,4-dione
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| Structure |
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| Formula |
C25H24N4O5
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| Molecular Weight |
460.49
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| Canonical SMILES |
CN1CC(=O)N(C(CCc2ccncc2)COc2ccc(cc2)-c2cccc(c2)[N+]([O-])=O)C1=O
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| InChI |
InChI=1S/C25H24N4O5/c1-27-16-24(30)28(25(27)31)22(8-5-18-11-13-26-14-12-18)17-34-23-9-6-19(7-10-23)20-3-2-4-21(15-20)29(32)33/h2-4,6-7,9-15,22H,5,8,16-17H2,1H3
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| InChIKey |
LCZJRNQREDWPOJ-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