General Information of the Compound
| Compound ID |
CP0391047
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| Compound Name |
N-(5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-yl)-3-methyl-1,2-benzoxazol-5-amine
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| Structure |
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| Formula |
C14H10FN5O
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| Molecular Weight |
283.266
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| Canonical SMILES |
Cc1noc2ccc(Nc3n[nH]c4ncc(F)cc34)cc12
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| InChI |
InChI=1S/C14H10FN5O/c1-7-10-5-9(2-3-12(10)21-20-7)17-14-11-4-8(15)6-16-13(11)18-19-14/h2-6H,1H3,(H2,16,17,18,19)
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| InChIKey |
JRJYHSWBPDNZCM-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