General Information of the Compound
| Compound ID |
CP0550017
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| Compound Name |
4-[[5-(1,5-dimethylpyrazol-3-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-3,5-difluoro-N-hydroxybenzamide
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| Structure |
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| Formula |
C15H14F2N6O2S
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| Molecular Weight |
380.38
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| Canonical SMILES |
Cc1cc(nn1C)-c1nnc(Sc2c(F)cc(cc2F)C(=O)NO)n1C
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| InChI |
InChI=1S/C15H14F2N6O2S/c1-7-4-11(20-23(7)3)13-18-19-15(22(13)2)26-12-9(16)5-8(6-10(12)17)14(24)21-25/h4-6,25H,1-3H3,(H,21,24)
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| InChIKey |
KZTPLUQBNXJBGQ-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