General Information of the Compound
| Compound ID |
CP0526805
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| Compound Name |
3-{7-[({7-[(3-carboxyphenyl)sulfamoyl]naphthalen-2-yl}carbamoyl)amino]naphthalene-2-sulfonamido}benzoic acid
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| Structure |
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| Formula |
C35H26N4O9S2
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| Molecular Weight |
710.746
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| Canonical SMILES |
OC(=O)c1cccc(NS(=O)(=O)c2ccc3ccc(NC(=O)Nc4ccc5ccc(cc5c4)S(=O)(=O)Nc4cccc(c4)C(O)=O)cc3c2)c1
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| InChI |
InChI=1S/C35H26N4O9S2/c40-33(41)23-3-1-5-29(15-23)38-49(45,46)31-13-9-21-7-11-27(17-25(21)19-31)36-35(44)37-28-12-8-22-10-14-32(20-26(22)18-28)50(47,48)39-30-6-2-4-24(16-30)34(42)43/h1-20,38-39H,(H,40,41)(H,42,43)(H2,36,37,44)
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| InChIKey |
HAPZARYPJGAYFL-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