General Information of the Compound
| Compound ID |
CP0454491
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| Compound Name |
4-[(8-methyl-6-morpholin-4-ylpurin-9-yl)methyl]-N-phenylbenzamide
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| Structure |
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| Formula |
C24H24N6O2
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| Molecular Weight |
428.496
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| Canonical SMILES |
Cc1nc2c(ncnc2n1Cc1ccc(cc1)C(=O)Nc1ccccc1)N1CCOCC1
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| InChI |
InChI=1S/C24H24N6O2/c1-17-27-21-22(29-11-13-32-14-12-29)25-16-26-23(21)30(17)15-18-7-9-19(10-8-18)24(31)28-20-5-3-2-4-6-20/h2-10,16H,11-15H2,1H3,(H,28,31)
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| InChIKey |
AZRYOEWXLQRGAP-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