General Information of the Compound
| Compound ID |
CP0456462
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| Compound Name |
(S)-N-(3-(4-(5-benzyl-1,2,4-oxadiazol-3-yl)piperidin-1-yl)-1-phenylpropyl)cyclobutanecarboxamide
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| Structure |
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| Formula |
C28H34N4O2
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| Molecular Weight |
458.606
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| Canonical SMILES |
O=C(N[C@@H](CCN1CCC(CC1)c1noc(Cc2ccccc2)n1)c1ccccc1)C1CCC1
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| InChI |
InChI=1S/C28H34N4O2/c33-28(24-12-7-13-24)29-25(22-10-5-2-6-11-22)16-19-32-17-14-23(15-18-32)27-30-26(34-31-27)20-21-8-3-1-4-9-21/h1-6,8-11,23-25H,7,12-20H2,(H,29,33)/t25-/m0/s1
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| InChIKey |
WJRHWKLKYSTKDD-VWLOTQADSA-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