General Information of the Compound
| Compound ID |
CP0456439
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| Compound Name |
(3S,5S)-N-benzyl-5-butan-2-yl-6-oxomorpholine-3-carboxamide
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| Structure |
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| Formula |
C16H22N2O3
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| Molecular Weight |
290.363
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| Canonical SMILES |
CCC(C)[C@@H]1N[C@@H](COC1=O)C(=O)NCc1ccccc1
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| InChI |
InChI=1S/C16H22N2O3/c1-3-11(2)14-16(20)21-10-13(18-14)15(19)17-9-12-7-5-4-6-8-12/h4-8,11,13-14,18H,3,9-10H2,1-2H3,(H,17,19)/t11?,13-,14-/m0/s1
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| InChIKey |
XCVAPGUOULEGBH-VNXPTHQBSA-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