General Information of the Compound
| Compound ID |
CP0159279
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| Compound Name |
3-(4-methoxy-2-nitroanilino)benzoic acid
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| Structure |
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| Formula |
C14H12N2O5
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| Molecular Weight |
288.259
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| Canonical SMILES |
COc1ccc(Nc2cccc(c2)C(O)=O)c(c1)[N+]([O-])=O
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| InChI |
InChI=1S/C14H12N2O5/c1-21-11-5-6-12(13(8-11)16(19)20)15-10-4-2-3-9(7-10)14(17)18/h2-8,15H,1H3,(H,17,18)
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| InChIKey |
ZUDZDQKQVGCTJF-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