General Information of the Compound
| Compound ID |
CP0558320
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| Compound Name |
3-[(3,5-difluorophenoxy)methyl]-N,N-diethyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-5-sulfonamide
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| Structure |
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| Formula |
C18H24F2N4O3S
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| Molecular Weight |
414.478
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| Canonical SMILES |
CCN(CC)S(=O)(=O)N1CCc2c(C1)c(COc1cc(F)cc(F)c1)nn2C
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| InChI |
InChI=1S/C18H24F2N4O3S/c1-4-23(5-2)28(25,26)24-7-6-18-16(11-24)17(21-22(18)3)12-27-15-9-13(19)8-14(20)10-15/h8-10H,4-7,11-12H2,1-3H3
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| InChIKey |
ULKJRXZVUZQXCZ-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