basic_info |
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Product_Name: | 4-(2,5-DIETHYL-6-METHYL-PYRIMIDIN-4-YLAMINO)-BENZOIC ACID |
EnglishSynonyms: | 4-(2,5-DIETHYL-6-METHYL-PYRIMIDIN-4-YLAMINO)-BENZOIC ACID |
pro_mdlNumber: | MFCD16811981 |
pro_acceptors: | 5 |
pro_donors: | 2 |
pro_smile: | CCc1c(nc(nc1Nc2ccc(cc2)C(=O)O)CC)C |
InChi: | InChI=1S/C16H19N3O2/c1-4-13-10(3)17-14(5-2)19-15(13)18-12-8-6-11(7-9-12)16(20)21/h6-9H,4-5H2,1-3H3,(H,20,21)(H,17,18,19) |
InChiKey: | InChIKey=YHVILDFSZDNZPK-UHFFFAOYSA-N |
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