General Information of the Compound
| Compound ID |
CP0460180
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| Compound Name |
5-Dibenzofuran-2-yl-1-(2,6-difluoro-benzyl)-6-methyl-3-{2-[methyl-(2-pyridin-2-yl-ethyl)-amino]-ethyl}-1H-pyrimidine-2,4-dione
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| Structure |
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| Formula |
C34H30F2N4O3
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| Molecular Weight |
580.635
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| Canonical SMILES |
CN(CCc1ccccn1)CCn1c(=O)c(-c2ccc3oc4ccccc4c3c2)c(C)n(Cc2c(F)cccc2F)c1=O
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| InChI |
InChI=1S/C34H30F2N4O3/c1-22-32(23-13-14-31-26(20-23)25-9-3-4-12-30(25)43-31)33(41)39(19-18-38(2)17-15-24-8-5-6-16-37-24)34(42)40(22)21-27-28(35)10-7-11-29(27)36/h3-14,16,20H,15,17-19,21H2,1-2H3
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| InChIKey |
OMMOEEIMVKATBO-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