General Information of the Compound
| Compound ID |
CP0400776
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| Compound Name |
N-(4-bromo-2-nitrophenyl)-3,4-dihydroxy-5-methoxybenzamide
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| Structure |
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| Formula |
C14H11BrN2O6
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| Molecular Weight |
383.154
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| Canonical SMILES |
COc1cc(cc(O)c1O)C(=O)Nc1ccc(Br)cc1[N+]([O-])=O
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| InChI |
InChI=1S/C14H11BrN2O6/c1-23-12-5-7(4-11(18)13(12)19)14(20)16-9-3-2-8(15)6-10(9)17(21)22/h2-6,18-19H,1H3,(H,16,20)
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| InChIKey |
UTDYISBJQQHLHF-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
Protein ID: PT01546, ATP-dependent translocase ABCB1
Protein ID: PT02516, Multidrug resistance-associated protein 1