General Information of the Compound
| Compound ID |
CP0525739
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| Compound Name |
benzyl 2-[(3S,4R)-2-oxo-3-[(4S)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]-4-[(E)-2-phenylethenyl]azetidin-1-yl]acetate
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| Structure |
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| Formula |
C29H26N2O5
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| Molecular Weight |
482.536
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| Canonical SMILES |
O=C(CN1[C@H](\C=C\c2ccccc2)[C@H](N2[C@H](COC2=O)c2ccccc2)C1=O)OCc1ccccc1
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| InChI |
InChI=1S/C29H26N2O5/c32-26(35-19-22-12-6-2-7-13-22)18-30-24(17-16-21-10-4-1-5-11-21)27(28(30)33)31-25(20-36-29(31)34)23-14-8-3-9-15-23/h1-17,24-25,27H,18-20H2/b17-16+/t24-,25-,27+/m1/s1
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| InChIKey |
SARCAGJNWLKRTO-KMUTWGJZSA-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