General Information of the Compound
| Compound ID |
CP0151693
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| Compound Name |
(S)-3-{4-[2-(5-Methyl-2-phenyl-oxazol-4-yl)-ethoxy]-phenyl}-2-piperidin-1-yl-propionic acid
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| Structure |
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| Formula |
C26H30N2O4
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| Molecular Weight |
434.536
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| Canonical SMILES |
Cc1oc(nc1CCOc1ccc(C[C@H](N2CCCCC2)C(O)=O)cc1)-c1ccccc1
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| InChI |
InChI=1S/C26H30N2O4/c1-19-23(27-25(32-19)21-8-4-2-5-9-21)14-17-31-22-12-10-20(11-13-22)18-24(26(29)30)28-15-6-3-7-16-28/h2,4-5,8-13,24H,3,6-7,14-18H2,1H3,(H,29,30)/t24-/m0/s1
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| InChIKey |
OOIAMNFVAVSNRP-DEOSSOPVSA-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