General Information of the Compound
| Compound ID |
CP0402107
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| Compound Name |
N,N-bis(2-methoxyethyl)-5-methyl-3-(4-propan-2-ylphenyl)triazolo[4,5-d]pyrimidin-7-amine
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| Structure |
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| Formula |
C20H28N6O2
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| Molecular Weight |
384.484
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| Canonical SMILES |
COCCN(CCOC)c1nc(C)nc2n(nnc12)-c1ccc(cc1)C(C)C
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| InChI |
InChI=1S/C20H28N6O2/c1-14(2)16-6-8-17(9-7-16)26-20-18(23-24-26)19(21-15(3)22-20)25(10-12-27-4)11-13-28-5/h6-9,14H,10-13H2,1-5H3
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| InChIKey |
UVJQOYWVZURRCR-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