General Information of the Compound
| Compound ID |
CP0429745
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| Compound Name |
4,4'-(3-sulfobiphenyl-4,4'-diyl)bis(diazene-2,1-diyl)bis(3-aminonaphthalene-2,7-disulfonic acid)
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| Formula |
C32H24N6O15S5
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| Molecular Weight |
892.906
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| Canonical SMILES |
Nc1c(cc2cc(ccc2c1\N=N\c1ccc(cc1)-c1ccc(\N=N\c2c(N)c(cc3cc(ccc23)S(O)(=O)=O)S(O)(=O)=O)c(c1)S(O)(=O)=O)S(O)(=O)=O)S(O)(=O)=O
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| InChI |
InChI=1S/C32H24N6O15S5/c33-29-27(57(48,49)50)14-18-11-21(54(39,40)41)6-8-23(18)31(29)37-35-20-4-1-16(2-5-20)17-3-10-25(26(13-17)56(45,46)47)36-38-32-24-9-7-22(55(42,43)44)12-19(24)15-28(30(32)34)58(51,52)53/h1-15H,33-34H2,(H,39,40,41)(H,42,43,44)(H,45,46,47)(H,48,49,50)(H,51,52,53)/b37-35+,38-36+
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| InChIKey |
CWWJGMXENHLBBV-ATXIYDNESA-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