General Information of the Compound
| Compound ID |
CP0535183
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| Compound Name |
N-methyl-N'-[1-[4-(3-nitrophenyl)phenoxy]-4-pyridin-4-ylbutan-2-yl]acetohydrazide
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| Structure |
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| Formula |
C24H26N4O4
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| Molecular Weight |
434.496
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| Canonical SMILES |
CN(NC(CCc1ccncc1)COc1ccc(cc1)-c1cccc(c1)[N+]([O-])=O)C(C)=O
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| InChI |
InChI=1S/C24H26N4O4/c1-18(29)27(2)26-22(9-6-19-12-14-25-15-13-19)17-32-24-10-7-20(8-11-24)21-4-3-5-23(16-21)28(30)31/h3-5,7-8,10-16,22,26H,6,9,17H2,1-2H3
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| InChIKey |
JIQGCSABFPLGNQ-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