General Information of the Compound
| Compound ID |
CP0846721
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| Compound Name |
N-[5-[[3-cyano-7-(cyclopropylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-2-cyclopropylphenyl]acetamide
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| Structure |
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| Formula |
C21H21N7O
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| Molecular Weight |
387.447
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| Canonical SMILES |
CC(=O)Nc1cc(Nc2cc(NC3CC3)n3ncc(C#N)c3n2)ccc1C1CC1
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| InChI |
InChI=1S/C21H21N7O/c1-12(29)24-18-8-16(6-7-17(18)13-2-3-13)25-19-9-20(26-15-4-5-15)28-21(27-19)14(10-22)11-23-28/h6-9,11,13,15,26H,2-5H2,1H3,(H,24,29)(H,25,27)
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| InChIKey |
NZAVXDRNAUHQLF-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: PT01210, Casein kinase II subunit alpha
Protein ID: PT00897, Potassium voltage-gated channel subfamily H member 2