General Information of the Compound
| Compound ID |
CP0494140
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| Compound Name |
1-[4-[7-(dimethylamino)quinazolin-4-yl]oxyphenyl]-3-[(2,3,4,5,6-pentafluorophenyl)methyl]urea
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| Structure |
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| Formula |
C24H18F5N5O2
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| Molecular Weight |
503.431
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| Canonical SMILES |
CN(C)c1ccc2c(Oc3ccc(NC(=O)NCc4c(F)c(F)c(F)c(F)c4F)cc3)ncnc2c1
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| InChI |
InChI=1S/C24H18F5N5O2/c1-34(2)13-5-8-15-17(9-13)31-11-32-23(15)36-14-6-3-12(4-7-14)33-24(35)30-10-16-18(25)20(27)22(29)21(28)19(16)26/h3-9,11H,10H2,1-2H3,(H2,30,33,35)
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| InChIKey |
LJODAFJCYVGVPU-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