General Information of the Compound
| Compound ID |
CP0508910
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| Compound Name |
1-[4-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]-4,4,4-trifluorobutan-1-one
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| Structure |
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| Formula |
C17H17ClF3N3O2
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| Molecular Weight |
387.789
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| Canonical SMILES |
FC(F)(F)CCC(=O)N1CCC(CC1)c1nc(no1)-c1cccc(Cl)c1
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| InChI |
InChI=1S/C17H17ClF3N3O2/c18-13-3-1-2-12(10-13)15-22-16(26-23-15)11-5-8-24(9-6-11)14(25)4-7-17(19,20)21/h1-3,10-11H,4-9H2
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| InChIKey |
NHNFKXXQAZNZFZ-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