General Information of the Compound
| Compound ID |
CP0916449
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| Compound Name |
4-(2,7-Dihydroxy-naphthalen-1-ylazo)-3-hydroxy-naphthalene-1-sulfonic acid
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| Formula |
C20H14N2O6S
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| Molecular Weight |
410.407
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| Canonical SMILES |
O=S(=O)(O)c1cc(O)c(/N=N/c2c(O)ccc3ccc(O)cc23)c2ccccc12
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| InChI |
InChI=1S/C20H14N2O6S/c23-12-7-5-11-6-8-16(24)20(15(11)9-12)22-21-19-14-4-2-1-3-13(14)18(10-17(19)25)29(26,27)28/h1-10,23-25H,(H,26,27,28)/b22-21+
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| InChIKey |
RRKDZMJUDHKNII-QURGRASLSA-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