General Information of the Compound
| Compound ID |
CP0498985
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| Compound Name |
(S)-(2,4-difluorophenyl)(3-(3-(pyridin-2-yl)-1,2,4-oxadiazol-5-yl)piperidin-1-yl)methanone
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| Structure |
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| Formula |
C19H16F2N4O2
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| Molecular Weight |
370.359
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| Canonical SMILES |
Fc1ccc(C(=O)N2CCC[C@@H](C2)c2nc(no2)-c2ccccn2)c(F)c1
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| InChI |
InChI=1S/C19H16F2N4O2/c20-13-6-7-14(15(21)10-13)19(26)25-9-3-4-12(11-25)18-23-17(24-27-18)16-5-1-2-8-22-16/h1-2,5-8,10,12H,3-4,9,11H2/t12-/m0/s1
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| InChIKey |
MLTBZEPGVPQYGS-LBPRGKRZSA-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