General Information of the Compound
| Compound ID |
CP0403596
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| Compound Name |
4-amino-3-hydroxy-7-nitronaphthalene-1-sulfonic acid
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| Structure |
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| Formula |
C10H8N2O6S
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| Molecular Weight |
284.249
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| Canonical SMILES |
Nc1c(O)cc(c2cc(ccc12)[N+]([O-])=O)S(O)(=O)=O
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| InChI |
InChI=1S/C10H8N2O6S/c11-10-6-2-1-5(12(14)15)3-7(6)9(4-8(10)13)19(16,17)18/h1-4,13H,11H2,(H,16,17,18)
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| InChIKey |
DHXPRBHRJQAXHK-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: PT04712, 5'-nucleotidase
Protein ID: PT03381, 5'-nucleotidase