General Information of the Compound
| Compound ID |
CP0548642
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| Compound Name |
N-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]-4-(propan-2-ylamino)-6-(pyrazolo[1,5-a]pyrimidin-5-ylamino)pyridine-3-carboxamide
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| Structure |
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| Formula |
C20H26FN7O2
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| Molecular Weight |
415.473
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| Canonical SMILES |
CC(C)Nc1cc(Nc2ccn3nccc3n2)ncc1C(=O)NC[C@@H](F)C(C)(C)O
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| InChI |
InChI=1S/C20H26FN7O2/c1-12(2)25-14-9-17(26-16-6-8-28-18(27-16)5-7-24-28)22-10-13(14)19(29)23-11-15(21)20(3,4)30/h5-10,12,15,30H,11H2,1-4H3,(H,23,29)(H2,22,25,26,27)/t15-/m1/s1
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| InChIKey |
OUCUNVKXSOPBBS-OAHLLOKOSA-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