General Information of the Compound
| Compound ID |
CP0246712
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| Compound Name |
4-[3-[difluoro(quinolin-6-yl)methyl]-8-fluoro-[1,2,4]triazolo[4,3-a]pyridin-6-yl]-1,3-thiazole
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| Structure |
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| Formula |
C19H10F3N5S
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| Molecular Weight |
397.385
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| Canonical SMILES |
Fc1cc(cn2c(nnc12)C(F)(F)c1ccc2ncccc2c1)-c1cscn1
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| InChI |
InChI=1S/C19H10F3N5S/c20-14-7-12(16-9-28-10-24-16)8-27-17(14)25-26-18(27)19(21,22)13-3-4-15-11(6-13)2-1-5-23-15/h1-10H
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| InChIKey |
SSQPOXFZVULSCX-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