General Information of the Compound
| Compound ID |
CP0452353
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| Compound Name |
N-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(3-quinolin-2-yl-1,2,4-oxadiazol-5-yl)piperidine-1-carboxamide
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| Structure |
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| Formula |
C22H22N6O3
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| Molecular Weight |
418.457
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| Canonical SMILES |
Cc1noc(C)c1NC(=O)N1CCC(CC1)c1nc(no1)-c1ccc2ccccc2n1
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| InChI |
InChI=1S/C22H22N6O3/c1-13-19(14(2)30-26-13)24-22(29)28-11-9-16(10-12-28)21-25-20(27-31-21)18-8-7-15-5-3-4-6-17(15)23-18/h3-8,16H,9-12H2,1-2H3,(H,24,29)
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| InChIKey |
USEMHKXTQIXFLM-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