General Information of the Compound
| Compound ID |
CP0538278
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| Compound Name |
(S)-N4-(3-(trifluoromethyl)benzyl)-N1-(3-(dimethylamino)propyl)-2-((3S,4R)-2-oxo-3-((S)-2-oxo-4-phenyloxazolidin-3-yl)-4-((E)-styryl)azetidin-1-yl)succinamide
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| Structure |
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| Formula |
C37H40F3N5O5
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| Molecular Weight |
691.751
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| Canonical SMILES |
CN(C)CCCNC(=O)[C@H](CC(=O)NCc1cccc(c1)C(F)(F)F)N1[C@H](\C=C\c2ccccc2)[C@H](N2[C@H](COC2=O)c2ccccc2)C1=O
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| InChI |
InChI=1S/C37H40F3N5O5/c1-43(2)20-10-19-41-34(47)30(22-32(46)42-23-26-13-9-16-28(21-26)37(38,39)40)44-29(18-17-25-11-5-3-6-12-25)33(35(44)48)45-31(24-50-36(45)49)27-14-7-4-8-15-27/h3-9,11-18,21,29-31,33H,10,19-20,22-24H2,1-2H3,(H,41,47)(H,42,46)/b18-17+/t29-,30+,31-,33+/m1/s1
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| InChIKey |
PUZABKUJTYNHFO-SUMLUTKGSA-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