General Information of the Compound
| Compound ID |
CP0062297
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| Compound Name |
4-[2-(2-fluoro-5-phenylanilino)pyrimidin-4-yl]benzamide
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| Structure |
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| Formula |
C23H17FN4O
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| Molecular Weight |
384.414
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| Canonical SMILES |
NC(=O)c1ccc(cc1)-c1ccnc(Nc2cc(ccc2F)-c2ccccc2)n1
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| InChI |
InChI=1S/C23H17FN4O/c24-19-11-10-18(15-4-2-1-3-5-15)14-21(19)28-23-26-13-12-20(27-23)16-6-8-17(9-7-16)22(25)29/h1-14H,(H2,25,29)(H,26,27,28)
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| InChIKey |
QSRGGIJDLZOXCH-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