General Information of the Compound
| Compound ID |
CP0919706
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| Compound Name |
Disodium 1-amino-4-(8-sulfo-1-naphthylamino)-9,10-dioxo-9,10dihydroanthracene-2-sulfonate
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| Structure |
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| Formula |
C24H14N2Na2O8S2
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| Molecular Weight |
568.496
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| Canonical SMILES |
Nc1c(S(=O)(=O)[O-])cc(Nc2cccc3cccc(S(=O)(=O)[O-])c23)c2c1C(=O)c1ccccc1C2=O.[Na+].[Na+]
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| InChI |
InChI=1S/C24H16N2O8S2.2Na/c25-22-18(36(32,33)34)11-16(20-21(22)24(28)14-8-2-1-7-13(14)23(20)27)26-15-9-3-5-12-6-4-10-17(19(12)15)35(29,30)31;;/h1-11,26H,25H2,(H,29,30,31)(H,32,33,34);;/q;2*+1/p-2
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| InChIKey |
DBSLZMYWHQZCFB-UHFFFAOYSA-L
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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