General Information of the Compound
| Compound ID |
CP0871837
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| Compound Name |
(R)-5-((4-fluorophenyl)ethynyl)-N-(3-hydroxy-3-methylbutan-2-yl)picolinamide
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| Structure |
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| Formula |
C19H19FN2O2
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| Molecular Weight |
326.371
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| Canonical SMILES |
C[C@@H](NC(=O)c1ccc(C#Cc2ccc(F)cc2)cn1)C(C)(C)O
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| InChI |
InChI=1S/C19H19FN2O2/c1-13(19(2,3)24)22-18(23)17-11-8-15(12-21-17)5-4-14-6-9-16(20)10-7-14/h6-13,24H,1-3H3,(H,22,23)/t13-/m1/s1
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| InChIKey |
BXVZARMDGXMGNT-CYBMUJFWSA-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