General Information of the Compound
| Compound ID |
CP0123540
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| Compound Name |
5-ethyl-3-[4-(2-methyl-4-propoxyphenyl)piperazin-1-yl]-1,2,4-oxadiazole
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| Structure |
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| Formula |
C18H26N4O2
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| Molecular Weight |
330.432
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| Canonical SMILES |
CCCOc1ccc(N2CCN(CC2)c2noc(CC)n2)c(C)c1
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| InChI |
InChI=1S/C18H26N4O2/c1-4-12-23-15-6-7-16(14(3)13-15)21-8-10-22(11-9-21)18-19-17(5-2)24-20-18/h6-7,13H,4-5,8-12H2,1-3H3
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| InChIKey |
MHNDUMDXMGPBQB-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