basic_info |
|
| Product_Name： | BUTTPARK 132\40-72 |
| EnglishSynonyms： | BUTTPARK 132\40-72 |
| pro_mdlNumber： | MFCD03644043 |
| pro_acceptors： | 9 |
| pro_donors： | 2 |
| pro_smile： | c1cc(cnc1)/C=N/NC(=O)c2c(c3c(cc(nc3o2)c4ccco4)c5ccco5)N |
| InChi： | InChI=1S/C22H15N5O4/c23-19-18-14(16-5-2-8-29-16)10-15(17-6-3-9-30-17)26-22(18)31-20(19)21(28)27-25-12-13-4-1-7-24-11-13/h1-12H,23H2,(H,27,28)/b25-12+ |
| InChiKey： | InChIKey=WJLCXHLJYYHQBC-BRJLIKDPSA-N |
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