General Information of the Compound
| Compound ID |
CP0185954
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| Compound Name |
2-[5-[3-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]-1-phenoxycarbonyl-3,6-dihydro-2H-pyridin-4-yl]acetic acid
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| Structure |
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| Formula |
C32H30N2O6
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| Molecular Weight |
538.6
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| Canonical SMILES |
Cc1oc(nc1CCOc1cccc(c1)C1=C(CC(O)=O)CCN(C1)C(=O)Oc1ccccc1)-c1ccccc1
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| InChI |
InChI=1S/C32H30N2O6/c1-22-29(33-31(39-22)23-9-4-2-5-10-23)16-18-38-27-14-8-11-24(19-27)28-21-34(17-15-25(28)20-30(35)36)32(37)40-26-12-6-3-7-13-26/h2-14,19H,15-18,20-21H2,1H3,(H,35,36)
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| InChIKey |
YWFYFXSFZPEXLO-UHFFFAOYSA-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