General Information of the Compound
| Compound ID |
CP0534488
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| Compound Name |
N-butyl-N-ethyl-3,6-dimethyl-1-(2,4,6-trimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine
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| Structure |
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| Formula |
C22H31N5
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| Molecular Weight |
365.525
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| Canonical SMILES |
CCCCN(CC)c1nc(C)nc2n(nc(C)c12)-c1c(C)cc(C)cc1C
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| InChI |
InChI=1S/C22H31N5/c1-8-10-11-26(9-2)21-19-17(6)25-27(22(19)24-18(7)23-21)20-15(4)12-14(3)13-16(20)5/h12-13H,8-11H2,1-7H3
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| InChIKey |
GTRLIIKGGYKIAK-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