General Information of the Compound
| Compound ID |
CP0074666
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| Compound Name |
2-[4-methoxy-3-[2-[[(4S,5R)-4-methyl-2-oxo-5-phenyl-1,3-oxazolidin-3-yl]methyl]-4-(trifluoromethyl)phenyl]phenyl]acetic acid
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| Structure |
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| Formula |
C27H24F3NO5
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| Molecular Weight |
499.485
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| Canonical SMILES |
COc1ccc(CC(O)=O)cc1-c1ccc(cc1CN1[C@@H](C)[C@H](OC1=O)c1ccccc1)C(F)(F)F
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| InChI |
InChI=1S/C27H24F3NO5/c1-16-25(18-6-4-3-5-7-18)36-26(34)31(16)15-19-14-20(27(28,29)30)9-10-21(19)22-12-17(13-24(32)33)8-11-23(22)35-2/h3-12,14,16,25H,13,15H2,1-2H3,(H,32,33)/t16-,25-/m0/s1
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| InChIKey |
ICMOGANJAUQPKT-LMKMVOKYSA-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