General Information of the Compound
| Compound ID |
CP0118818
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| Compound Name |
N-[4-[6-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]acetamide
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| Structure |
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| Formula |
C22H23N5O2
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| Molecular Weight |
389.459
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| Canonical SMILES |
CC(=O)Nc1ccc(cc1)-c1cc(Nc2ccc(cc2)N2CCOCC2)ncn1
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| InChI |
InChI=1S/C22H23N5O2/c1-16(28)25-18-4-2-17(3-5-18)21-14-22(24-15-23-21)26-19-6-8-20(9-7-19)27-10-12-29-13-11-27/h2-9,14-15H,10-13H2,1H3,(H,25,28)(H,23,24,26)
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| InChIKey |
IUTBWIDXUBWESB-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