General Information of the Compound
| Compound ID |
CP0489066
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| Compound Name |
3-[1-[1-(2,4-dichlorophenyl)cyclopropanecarbonyl]piperidin-4-yl]-5-phenyl-1,3,4-oxadiazol-2-one
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| Structure |
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| Formula |
C23H21Cl2N3O3
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| Molecular Weight |
458.345
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| Canonical SMILES |
Clc1ccc(c(Cl)c1)C1(CC1)C(=O)N1CCC(CC1)n1nc(oc1=O)-c1ccccc1
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| InChI |
InChI=1S/C23H21Cl2N3O3/c24-16-6-7-18(19(25)14-16)23(10-11-23)21(29)27-12-8-17(9-13-27)28-22(30)31-20(26-28)15-4-2-1-3-5-15/h1-7,14,17H,8-13H2
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| InChIKey |
QEVJFYAEBFQQRT-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