General Information of the Compound
| Compound ID |
CP0396692
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| Compound Name |
4-[9-[[4-(4-methoxyphenyl)phenyl]methyl]-8-methylpurin-6-yl]morpholine
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| Structure |
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| Formula |
C24H25N5O2
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| Molecular Weight |
415.497
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| Canonical SMILES |
COc1ccc(cc1)-c1ccc(Cn2c(C)nc3c(ncnc23)N2CCOCC2)cc1
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| InChI |
InChI=1S/C24H25N5O2/c1-17-27-22-23(28-11-13-31-14-12-28)25-16-26-24(22)29(17)15-18-3-5-19(6-4-18)20-7-9-21(30-2)10-8-20/h3-10,16H,11-15H2,1-2H3
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| InChIKey |
REKJIJAPMQSCJI-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