General Information of the Compound
| Compound ID |
CP0575008
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| Compound Name |
5-[[4-(4-aminopiperidin-1-yl)-5-(trifluoromethyl)pyrimidin-2-yl]amino]pyridine-2-carboxamide
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| Structure |
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| Formula |
C16H18F3N7O
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| Molecular Weight |
381.362
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| Canonical SMILES |
NC1CCN(CC1)c1nc(Nc2ccc(nc2)C(N)=O)ncc1C(F)(F)F
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| InChI |
InChI=1S/C16H18F3N7O/c17-16(18,19)11-8-23-15(24-10-1-2-12(13(21)27)22-7-10)25-14(11)26-5-3-9(20)4-6-26/h1-2,7-9H,3-6,20H2,(H2,21,27)(H,23,24,25)
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| InChIKey |
ZLHRBBMIUWSRQK-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: PT00888, Mast/stem cell growth factor receptor Kit
Protein ID: PT01204, Receptor-type tyrosine-protein kinase FLT3