General Information of the Compound
| Compound ID |
CP0548555
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| Compound Name |
N-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]-3-(1-methylpyrazol-3-yl)triazolo[4,5-d]pyrimidin-5-amine
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| Structure |
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| Formula |
C17H21N11
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| Molecular Weight |
379.432
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| Canonical SMILES |
CN1CCC(CC1)n1cc(Nc2ncc3nnn(-c4ccn(C)n4)c3n2)cn1
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| InChI |
InChI=1S/C17H21N11/c1-25-6-3-13(4-7-25)27-11-12(9-19-27)20-17-18-10-14-16(21-17)28(24-22-14)15-5-8-26(2)23-15/h5,8-11,13H,3-4,6-7H2,1-2H3,(H,18,20,21)
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| InChIKey |
QLMUKECAWOUFRJ-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: PT02162, Mitogen-activated protein kinase 6