General Information of the Compound
| Compound ID |
CP0283785
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| Compound Name |
5-[4-[1-[5-(1H-1,2,4-triazol-5-yl)-1,2,4-oxadiazol-3-yl]cyclobutyl]phenyl]pyrimidin-2-amine
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| Structure |
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| Formula |
C18H16N8O
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| Molecular Weight |
360.381
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| Canonical SMILES |
Nc1ncc(cn1)-c1ccc(cc1)C1(CCC1)c1noc(n1)-c1nc[nH]n1
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| InChI |
InChI=1S/C18H16N8O/c19-17-20-8-12(9-21-17)11-2-4-13(5-3-11)18(6-1-7-18)16-24-15(27-26-16)14-22-10-23-25-14/h2-5,8-10H,1,6-7H2,(H2,19,20,21)(H,22,23,25)
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| InChIKey |
NVNGRFFXFVCOFR-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