General Information of the Compound
| Compound ID |
CP0461041
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| Compound Name |
2-(4,6-Dimethoxy-pyrimidin-2-yloxy)-3-ethoxy-3,3-diphenyl-propionic acid
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| Structure |
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| Formula |
C23H24N2O6
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| Molecular Weight |
424.453
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| Canonical SMILES |
CCOC(C(Oc1nc(OC)cc(OC)n1)C(O)=O)(c1ccccc1)c1ccccc1
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| InChI |
InChI=1S/C23H24N2O6/c1-4-30-23(16-11-7-5-8-12-16,17-13-9-6-10-14-17)20(21(26)27)31-22-24-18(28-2)15-19(25-22)29-3/h5-15,20H,4H2,1-3H3,(H,26,27)
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| InChIKey |
TTZWTGSBTVOGHQ-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