General Information of the Compound
| Compound ID |
CP0350485
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| Compound Name |
N-[3-[4-(6-aminopyridin-3-yl)triazol-1-yl]-2,4-difluorophenyl]-3-chlorobenzenesulfonamide
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| Structure |
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| Formula |
C19H13ClF2N6O2S
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| Molecular Weight |
462.869
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| Canonical SMILES |
Nc1ccc(cn1)-c1cn(nn1)-c1c(F)ccc(NS(=O)(=O)c2cccc(Cl)c2)c1F
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| InChI |
InChI=1S/C19H13ClF2N6O2S/c20-12-2-1-3-13(8-12)31(29,30)26-15-6-5-14(21)19(18(15)22)28-10-16(25-27-28)11-4-7-17(23)24-9-11/h1-10,26H,(H2,23,24)
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| InChIKey |
NGSHIRNMRKRWQI-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