General Information of the Compound
| Compound ID |
CP0500268
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| Compound Name |
N-[4-[2-(4-bromophenyl)-5-methylpyrazol-3-yl]phenyl]methanesulfonamide
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| Structure |
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| Formula |
C17H16BrN3O2S
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| Molecular Weight |
406.305
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| Canonical SMILES |
Cc1cc(-c2ccc(NS(C)(=O)=O)cc2)n(n1)-c1ccc(Br)cc1
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| InChI |
InChI=1S/C17H16BrN3O2S/c1-12-11-17(21(19-12)16-9-5-14(18)6-10-16)13-3-7-15(8-4-13)20-24(2,22)23/h3-11,20H,1-2H3
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| InChIKey |
FJXCJWRRLVTBSO-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