General Information of the Compound
| Compound ID |
CP0555841
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| Compound Name |
N-hydroxy-4-[[2-(4-hydroxyphenyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]methylamino]benzamide
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| Formula |
C20H17N5O3S
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| Molecular Weight |
407.455
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| Canonical SMILES |
ONC(=O)c1ccc(NCc2nc(nn2-c2ccc(O)cc2)-c2cccs2)cc1
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| InChI |
InChI=1S/C20H17N5O3S/c26-16-9-7-15(8-10-16)25-18(22-19(23-25)17-2-1-11-29-17)12-21-14-5-3-13(4-6-14)20(27)24-28/h1-11,21,26,28H,12H2,(H,24,27)
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| InChIKey |
CGIIHSALQHQHQN-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