General Information of the Compound
| Compound ID |
CP0426063
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| Compound Name |
4-[[2-benzyl-5-(4-chlorophenyl)-1,2,4-triazol-3-yl]methyl]-N-hydroxybenzamide
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| Structure |
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| Formula |
C23H19ClN4O2
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| Molecular Weight |
418.884
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| Canonical SMILES |
ONC(=O)c1ccc(Cc2nc(nn2Cc2ccccc2)-c2ccc(Cl)cc2)cc1
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| InChI |
InChI=1S/C23H19ClN4O2/c24-20-12-10-18(11-13-20)22-25-21(28(26-22)15-17-4-2-1-3-5-17)14-16-6-8-19(9-7-16)23(29)27-30/h1-13,30H,14-15H2,(H,27,29)
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| InChIKey |
YMVRSRJFUBUMLC-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