General Information of the Compound
| Compound ID |
CP0423071
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| Compound Name |
2-(4-(difluoromethyl)-2,6-dimethoxyphenyl)-4-methoxy-6-methyl-5-(pentan-3-yloxy)pyrimidine
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| Structure |
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| Formula |
C20H26F2N2O4
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| Molecular Weight |
396.434
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| Canonical SMILES |
CCC(CC)Oc1c(C)nc(nc1OC)-c1c(OC)cc(cc1OC)C(F)F
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| InChI |
InChI=1S/C20H26F2N2O4/c1-7-13(8-2)28-17-11(3)23-19(24-20(17)27-6)16-14(25-4)9-12(18(21)22)10-15(16)26-5/h9-10,13,18H,7-8H2,1-6H3
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| InChIKey |
JAMYKAOGUWWSHK-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