General Information of the Compound
| Compound ID |
CP0572188
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| Compound Name |
1-methyl-N-(3,4,5-trifluorophenyl)-3-[[(2R)-1,1,1-trifluoropropan-2-yl]sulfamoyl]-4,6-dihydropyrrolo[3,4-c]pyrazole-5-carboxamide
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| Structure |
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| Formula |
C16H15F6N5O3S
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| Molecular Weight |
471.383
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| Canonical SMILES |
C[C@@H](NS(=O)(=O)c1nn(C)c2CN(Cc12)C(=O)Nc1cc(F)c(F)c(F)c1)C(F)(F)F
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| InChI |
InChI=1S/C16H15F6N5O3S/c1-7(16(20,21)22)25-31(29,30)14-9-5-27(6-12(9)26(2)24-14)15(28)23-8-3-10(17)13(19)11(18)4-8/h3-4,7,25H,5-6H2,1-2H3,(H,23,28)/t7-/m1/s1
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| InChIKey |
GMLKCVQRMZVADM-SSDOTTSWSA-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