General Information of the Compound
| Compound ID |
CP0530047
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| Compound Name |
3,5-difluoro-N-hydroxy-4-[(5-pyridin-4-yl-1,3,4-thiadiazol-2-yl)methyl]benzamide
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| Structure |
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| Formula |
C15H10F2N4O2S
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| Molecular Weight |
348.334
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| Canonical SMILES |
ONC(=O)c1cc(F)c(Cc2nnc(s2)-c2ccncc2)c(F)c1
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| InChI |
InChI=1S/C15H10F2N4O2S/c16-11-5-9(14(22)21-23)6-12(17)10(11)7-13-19-20-15(24-13)8-1-3-18-4-2-8/h1-6,23H,7H2,(H,21,22)
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| InChIKey |
IVTRXZVFBYYIOA-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