General Information of the Compound
| Compound ID |
CP0513525
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| Compound Name |
4-[9-(naphthalen-2-ylmethyl)purin-6-yl]morpholine
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| Structure |
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| Formula |
C20H19N5O
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| Molecular Weight |
345.406
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| Canonical SMILES |
C(c1ccc2ccccc2c1)n1cnc2c(ncnc12)N1CCOCC1
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| InChI |
InChI=1S/C20H19N5O/c1-2-4-17-11-15(5-6-16(17)3-1)12-25-14-23-18-19(21-13-22-20(18)25)24-7-9-26-10-8-24/h1-6,11,13-14H,7-10,12H2
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| InChIKey |
GTFGFPRNMDUSAC-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