General Information of the Compound
| Compound ID |
CP0506495
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| Compound Name |
2-Methoxy-4-nitro-N-(quinolin-3-yl)benzenesulfonamide
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| Structure |
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| Formula |
C16H13N3O5S
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| Molecular Weight |
359.363
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| Canonical SMILES |
COc1cc(ccc1S(=O)(=O)Nc1cnc2ccccc2c1)[N+]([O-])=O
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| InChI |
InChI=1S/C16H13N3O5S/c1-24-15-9-13(19(20)21)6-7-16(15)25(22,23)18-12-8-11-4-2-3-5-14(11)17-10-12/h2-10,18H,1H3
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| InChIKey |
OCRIBLZXJKEFEJ-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