General Information of the Compound
| Compound ID |
CP0494453
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| Compound Name |
(S)-(4-fluorophenyl)(3-(3-(thiophen-2-yl)-1,2,4-oxadiazol-5-yl)piperidin-1-yl)methanone
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| Structure |
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| Formula |
C18H16FN3O2S
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| Molecular Weight |
357.41
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| Canonical SMILES |
Fc1ccc(cc1)C(=O)N1CCC[C@@H](C1)c1nc(no1)-c1cccs1
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| InChI |
InChI=1S/C18H16FN3O2S/c19-14-7-5-12(6-8-14)18(23)22-9-1-3-13(11-22)17-20-16(21-24-17)15-4-2-10-25-15/h2,4-8,10,13H,1,3,9,11H2/t13-/m0/s1
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| InChIKey |
BDWLILFPLXVQLM-ZDUSSCGKSA-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