General Information of the Compound
| Compound ID |
CP0537138
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| Compound Name |
N-[(1S)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]ethyl]-2-methyl-5-(trifluoromethyl)pyrazole-3-sulfonamide
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| Formula |
C15H13F4N5O3S
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| Molecular Weight |
419.36
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| Canonical SMILES |
C[C@H](NS(=O)(=O)c1cc(nn1C)C(F)(F)F)c1nc(no1)-c1cccc(F)c1
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| InChI |
InChI=1S/C15H13F4N5O3S/c1-8(14-20-13(22-27-14)9-4-3-5-10(16)6-9)23-28(25,26)12-7-11(15(17,18)19)21-24(12)2/h3-8,23H,1-2H3/t8-/m0/s1
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| InChIKey |
QFMJLCVTQLDOAE-QMMMGPOBSA-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