General Information of the Compound
| Compound ID |
CP0545097
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| Compound Name |
6-[[2-(4-hydroxypiperidin-1-yl)pyrimidin-4-yl]amino]-N-methyl-4-(propan-2-ylamino)pyridine-3-carboxamide
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| Structure |
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| Formula |
C19H27N7O2
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| Molecular Weight |
385.472
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| Canonical SMILES |
CNC(=O)c1cnc(Nc2ccnc(n2)N2CCC(O)CC2)cc1NC(C)C
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| InChI |
InChI=1S/C19H27N7O2/c1-12(2)23-15-10-17(22-11-14(15)18(28)20-3)24-16-4-7-21-19(25-16)26-8-5-13(27)6-9-26/h4,7,10-13,27H,5-6,8-9H2,1-3H3,(H,20,28)(H2,21,22,23,24,25)
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| InChIKey |
LRIWJFVDBQRHIK-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
Protein ID: PT00922, Epidermal growth factor receptor
Cell-based Assay