General Information of the Compound
| Compound ID |
CP0566191
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| Compound Name |
4-[[4-amino-5-[3-(diethylsulfamoyl)phenyl]-1,2,4-triazol-3-yl]sulfanyl]-N-hydroxybenzamide
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| Structure |
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| Formula |
C19H22N6O4S2
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| Molecular Weight |
462.557
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| Canonical SMILES |
CCN(CC)S(=O)(=O)c1cccc(c1)-c1nnc(Sc2ccc(cc2)C(=O)NO)n1N
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| InChI |
InChI=1S/C19H22N6O4S2/c1-3-24(4-2)31(28,29)16-7-5-6-14(12-16)17-21-22-19(25(17)20)30-15-10-8-13(9-11-15)18(26)23-27/h5-12,27H,3-4,20H2,1-2H3,(H,23,26)
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| InChIKey |
SQFCRUKKOCFQTP-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