General Information of the Compound
| Compound ID |
CP0564729
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| Compound Name |
1-(2,4-dichlorophenyl)-3-[2-methyl-4-[6-(methylamino)pyrimidin-4-yl]oxyphenyl]urea
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| Structure |
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| Formula |
C19H17Cl2N5O2
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| Molecular Weight |
418.284
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| Canonical SMILES |
CNc1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)cc3Cl)c(C)c2)ncn1
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| InChI |
InChI=1S/C19H17Cl2N5O2/c1-11-7-13(28-18-9-17(22-2)23-10-24-18)4-6-15(11)25-19(27)26-16-5-3-12(20)8-14(16)21/h3-10H,1-2H3,(H,22,23,24)(H2,25,26,27)
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| InChIKey |
CTQWBODLLAHCOP-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