General Information of the Compound
| Compound ID |
CP0538472
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| Compound Name |
benzyl 3-oxo-2-[(3S,4R)-2-oxo-3-[(4S)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]-4-[(E)-2-phenylethenyl]azetidin-1-yl]-3-phenylpropanoate
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| Structure |
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| Formula |
C36H30N2O6
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| Molecular Weight |
586.644
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| Canonical SMILES |
O=C(OCc1ccccc1)C(N1[C@H](\C=C\c2ccccc2)[C@H](N2[C@H](COC2=O)c2ccccc2)C1=O)C(=O)c1ccccc1
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| InChI |
InChI=1S/C36H30N2O6/c39-33(28-19-11-4-12-20-28)32(35(41)43-23-26-15-7-2-8-16-26)37-29(22-21-25-13-5-1-6-14-25)31(34(37)40)38-30(24-44-36(38)42)27-17-9-3-10-18-27/h1-22,29-32H,23-24H2/b22-21+/t29-,30-,31+,32?/m1/s1
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| InChIKey |
FTQVBGJEUGWYCN-KUBDNMKFSA-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