General Information of the Compound
| Compound ID |
CP0082984
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| Compound Name |
1-[3-[1-[4-(2-aminopyrimidin-5-yl)phenyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]piperidin-4-ol
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| Structure |
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| Formula |
C21H24N6O2
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| Molecular Weight |
392.463
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| Canonical SMILES |
Nc1ncc(cn1)-c1ccc(cc1)C1(CCC1)c1noc(n1)N1CCC(O)CC1
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| InChI |
InChI=1S/C21H24N6O2/c22-19-23-12-15(13-24-19)14-2-4-16(5-3-14)21(8-1-9-21)18-25-20(29-26-18)27-10-6-17(28)7-11-27/h2-5,12-13,17,28H,1,6-11H2,(H2,22,23,24)
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| InChIKey |
JJVKVATVGFBOAC-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