General Information of the Compound
| Compound ID |
CP0267102
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| Compound Name |
N-hydroxy-4-[[5-(3-methylthiophen-2-yl)-2-phenyl-1,2,4-triazol-3-yl]methylamino]benzamide
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| Formula |
C21H19N5O2S
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| Molecular Weight |
405.483
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| Canonical SMILES |
Cc1ccsc1-c1nc(CNc2ccc(cc2)C(=O)NO)n(n1)-c1ccccc1
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| InChI |
InChI=1S/C21H19N5O2S/c1-14-11-12-29-19(14)20-23-18(26(24-20)17-5-3-2-4-6-17)13-22-16-9-7-15(8-10-16)21(27)25-28/h2-12,22,28H,13H2,1H3,(H,25,27)
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| InChIKey |
KTTQJBWGVWPYMZ-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