General Information of the Compound
| Compound ID |
CP0512829
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| Compound Name |
benzyl 4-(3-quinolin-2-yl-1,2,4-oxadiazol-5-yl)piperidine-1-carboxylate
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| Structure |
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| Formula |
C24H22N4O3
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| Molecular Weight |
414.465
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| Canonical SMILES |
O=C(OCc1ccccc1)N1CCC(CC1)c1nc(no1)-c1ccc2ccccc2n1
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| InChI |
InChI=1S/C24H22N4O3/c29-24(30-16-17-6-2-1-3-7-17)28-14-12-19(13-15-28)23-26-22(27-31-23)21-11-10-18-8-4-5-9-20(18)25-21/h1-11,19H,12-16H2
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| InChIKey |
NFOSARGAZHQWJS-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