General Information of the Compound
| Compound ID |
CP0487938
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| Compound Name |
4-(2,5-dichlorophenoxy)-N-[2-(dimethylamino)phenyl]-N-methylpyrimidine-5-carboxamide
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| Structure |
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| Formula |
C20H18Cl2N4O2
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| Molecular Weight |
417.296
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| Canonical SMILES |
CN(C)c1ccccc1N(C)C(=O)c1cncnc1Oc1cc(Cl)ccc1Cl
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| InChI |
InChI=1S/C20H18Cl2N4O2/c1-25(2)16-6-4-5-7-17(16)26(3)20(27)14-11-23-12-24-19(14)28-18-10-13(21)8-9-15(18)22/h4-12H,1-3H3
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| InChIKey |
IULFHMMKRLZFHZ-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