General Information of the Compound
| Compound ID |
CP0350126
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| Compound Name |
5-[4-[3,3-dimethyl-1-[5-(1-methylpyrazol-4-yl)-1,2,4-oxadiazol-3-yl]cyclobutyl]phenyl]pyrimidin-2-amine
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| Structure |
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| Formula |
C22H23N7O
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| Molecular Weight |
401.474
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| Canonical SMILES |
Cn1cc(cn1)-c1nc(no1)C1(CC(C)(C)C1)c1ccc(cc1)-c1cnc(N)nc1
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| InChI |
InChI=1S/C22H23N7O/c1-21(2)12-22(13-21,19-27-18(30-28-19)16-10-26-29(3)11-16)17-6-4-14(5-7-17)15-8-24-20(23)25-9-15/h4-11H,12-13H2,1-3H3,(H2,23,24,25)
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| InChIKey |
OMQPVVGBQSPADM-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