General Information of the Compound
| Compound ID |
CP0177300
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| Compound Name |
3-[3-[1-[4-(2-aminopyrimidin-5-yl)phenyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]-1H-pyridin-2-one
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| Structure |
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| Formula |
C21H18N6O2
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| Molecular Weight |
386.415
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| Canonical SMILES |
Nc1ncc(cn1)-c1ccc(cc1)C1(CCC1)c1noc(n1)-c1ccc[nH]c1=O
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| InChI |
InChI=1S/C21H18N6O2/c22-20-24-11-14(12-25-20)13-4-6-15(7-5-13)21(8-2-9-21)19-26-18(29-27-19)16-3-1-10-23-17(16)28/h1,3-7,10-12H,2,8-9H2,(H,23,28)(H2,22,24,25)
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| InChIKey |
DVNDYAKTKBBPCE-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