General Information of the Compound
| Compound ID |
CP0883719
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| Compound Name |
N-[5-[[3-cyano-7-(oxetan-3-ylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-2-cyclopropyl-4-fluorophenyl]acetamide
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| Structure |
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| Formula |
C21H20FN7O2
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| Molecular Weight |
421.436
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| Canonical SMILES |
CC(=O)Nc1cc(Nc2cc(NC3COC3)n3ncc(C#N)c3n2)c(F)cc1C1CC1
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| InChI |
InChI=1S/C21H20FN7O2/c1-11(30)25-17-5-18(16(22)4-15(17)12-2-3-12)27-19-6-20(26-14-9-31-10-14)29-21(28-19)13(7-23)8-24-29/h4-6,8,12,14,26H,2-3,9-10H2,1H3,(H,25,30)(H,27,28)
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| InChIKey |
NZHHTGUIOVTGGZ-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