General Information of the Compound
| Compound ID |
CP0481493
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| Compound Name |
2-{7-[({7-[(2-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)c1ccccc1NS(=O)(=O)c1ccc2ccc(NC(=O)Nc3ccc4ccc(cc4c3)S(=O)(=O)Nc3ccccc3C(O)=O)cc2c1
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| InChI |
InChI=1S/C35H26N4O9S2/c40-33(41)29-5-1-3-7-31(29)38-49(45,46)27-15-11-21-9-13-25(17-23(21)19-27)36-35(44)37-26-14-10-22-12-16-28(20-24(22)18-26)50(47,48)39-32-8-4-2-6-30(32)34(42)43/h1-20,38-39H,(H,40,41)(H,42,43)(H2,36,37,44)
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| InChIKey |
RHGUJIIOUPOUOF-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