General Information of the Compound
| Compound ID |
CP0423927
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| Compound Name |
2,6-difluoro-N-[2-(3-fluorophenyl)pyrazolo[1,5-a]pyrimidin-6-yl]-3-(propylsulfonylamino)benzamide
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| Structure |
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| Formula |
C22H18F3N5O3S
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| Molecular Weight |
489.479
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| Canonical SMILES |
CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3cc(nn3c2)-c2cccc(F)c2)c1F
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| InChI |
InChI=1S/C22H18F3N5O3S/c1-2-8-34(32,33)29-17-7-6-16(24)20(21(17)25)22(31)27-15-11-26-19-10-18(28-30(19)12-15)13-4-3-5-14(23)9-13/h3-7,9-12,29H,2,8H2,1H3,(H,27,31)
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| InChIKey |
UIJOJTVKVUWCIV-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