basic_info |
|
| Product_Name: | 3-[2-(3-FLUORO-PHENYL)-6-PROPYL-PYRIMIDIN-4-YLAMINO]-BENZOIC ACID |
| EnglishSynonyms: | 3-[2-(3-FLUORO-PHENYL)-6-PROPYL-PYRIMIDIN-4-YLAMINO]-BENZOIC ACID |
| pro_mdlNumber: | MFCD16812012 |
| pro_acceptors: | 5 |
| pro_donors: | 2 |
| pro_smile: | CCCc1cc(nc(n1)c2cccc(c2)F)Nc3cccc(c3)C(=O)O |
| InChi: | InChI=1S/C20H18FN3O2/c1-2-5-16-12-18(22-17-9-4-7-14(11-17)20(25)26)24-19(23-16)13-6-3-8-15(21)10-13/h3-4,6-12H,2,5H2,1H3,(H,25,26)(H,22,23,24) |
| InChiKey: | InChIKey=IYWJXHCIEGRZJB-UHFFFAOYSA-N |
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