General Information of the Compound
| Compound ID |
CP0857807
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| Compound Name |
N-[4-Chloro-2-(pyridine-4-carbonyl)-phenyl]-4-(1H-indol-2-yl)-benzenesulfonamide
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| Structure |
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| Formula |
C26H18ClN3O3S
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| Molecular Weight |
487.968
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| Canonical SMILES |
O=C(c1ccncc1)c1cc(Cl)ccc1NS(=O)(=O)c1ccc(-c2cc3ccccc3[nH]2)cc1
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| InChI |
InChI=1S/C26H18ClN3O3S/c27-20-7-10-24(22(16-20)26(31)18-11-13-28-14-12-18)30-34(32,33)21-8-5-17(6-9-21)25-15-19-3-1-2-4-23(19)29-25/h1-16,29-30H
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| InChIKey |
SHXYXXFAKIAEMR-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