General Information of the Compound
| Compound ID |
CP0467247
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| Compound Name |
(3S,5S)-N-benzyl-5-[(4-methoxyphenyl)methyl]-6-oxomorpholine-3-carboxamide
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| Structure |
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| Formula |
C20H22N2O4
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| Molecular Weight |
354.406
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| Canonical SMILES |
COc1ccc(C[C@@H]2N[C@@H](COC2=O)C(=O)NCc2ccccc2)cc1
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| InChI |
InChI=1S/C20H22N2O4/c1-25-16-9-7-14(8-10-16)11-17-20(24)26-13-18(22-17)19(23)21-12-15-5-3-2-4-6-15/h2-10,17-18,22H,11-13H2,1H3,(H,21,23)/t17-,18-/m0/s1
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| InChIKey |
DAIQEZHJQUQBBA-ROUUACIJSA-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