General Information of the Compound
| Compound ID |
CP0412475
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| Compound Name |
Bis-(2-methoxy-ethyl)-[5-methyl-3-(2,4,6-trimethyl-phenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]-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)-c1c(C)cc(C)cc1C
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| InChI |
InChI=1S/C20H28N6O2/c1-13-11-14(2)18(15(3)12-13)26-20-17(23-24-26)19(21-16(4)22-20)25(7-9-27-5)8-10-28-6/h11-12H,7-10H2,1-6H3
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| InChIKey |
ZFLKEJBXJHZJSM-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