General Information of the Compound
| Compound ID |
CP0236912
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| Compound Name |
(S)-2-Acetylamino-3-{4-[2-(5-methyl-2-phenyl-oxazol-4-yl)-ethoxy]-phenyl}-propionic acid
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| Structure |
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| Formula |
C23H24N2O5
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| Molecular Weight |
408.454
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| Canonical SMILES |
CC(=O)N[C@@H](Cc1ccc(OCCc2nc(oc2C)-c2ccccc2)cc1)C(O)=O
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| InChI |
InChI=1S/C23H24N2O5/c1-15-20(25-22(30-15)18-6-4-3-5-7-18)12-13-29-19-10-8-17(9-11-19)14-21(23(27)28)24-16(2)26/h3-11,21H,12-14H2,1-2H3,(H,24,26)(H,27,28)/t21-/m0/s1
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| InChIKey |
ZFMJLCXLVNCIPH-NRFANRHFSA-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