General Information of the Compound
| Compound ID |
CP0436804
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| Compound Name |
[3-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]azetidin-1-yl]-(oxolan-3-yl)methanone
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| Structure |
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| Formula |
C17H19N3O3
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| Molecular Weight |
313.357
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| Canonical SMILES |
Cc1cccc(c1)-c1noc(n1)C1CN(C1)C(=O)C1CCOC1
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| InChI |
InChI=1S/C17H19N3O3/c1-11-3-2-4-12(7-11)15-18-16(23-19-15)14-8-20(9-14)17(21)13-5-6-22-10-13/h2-4,7,13-14H,5-6,8-10H2,1H3
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| InChIKey |
YMBLZUQMBYJKIA-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