General Information of the Compound
| Compound ID |
CP0302587
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| Compound Name |
3-[1-[4-(2-aminopyrimidin-5-yl)phenyl]cyclobutyl]-1,2,4-oxadiazol-5-amine
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| Structure |
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| Formula |
C16H16N6O
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| Molecular Weight |
308.345
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| Canonical SMILES |
Nc1nc(no1)C1(CCC1)c1ccc(cc1)-c1cnc(N)nc1
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| InChI |
InChI=1S/C16H16N6O/c17-14-19-8-11(9-20-14)10-2-4-12(5-3-10)16(6-1-7-16)13-21-15(18)23-22-13/h2-5,8-9H,1,6-7H2,(H2,17,19,20)(H2,18,21,22)
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| InChIKey |
SJFRRMIBCZQSMO-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