General Information of the Compound
| Compound ID |
CP0426634
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| Compound Name |
N-(2-morpholin-4-yl-2-pyridin-3-ylethyl)-4-(3-quinolin-2-yl-1,2,4-oxadiazol-5-yl)piperidine-1-carboxamide
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| Structure |
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| Formula |
C28H31N7O3
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| Molecular Weight |
513.602
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| Canonical SMILES |
O=C(NCC(N1CCOCC1)c1cccnc1)N1CCC(CC1)c1nc(no1)-c1ccc2ccccc2n1
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| InChI |
InChI=1S/C28H31N7O3/c36-28(30-19-25(22-5-3-11-29-18-22)34-14-16-37-17-15-34)35-12-9-21(10-13-35)27-32-26(33-38-27)24-8-7-20-4-1-2-6-23(20)31-24/h1-8,11,18,21,25H,9-10,12-17,19H2,(H,30,36)
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| InChIKey |
TZKCFHAQUHKJPN-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