basic_info |
|
| Product_Name： | EMOLECULES 31660974 |
| EnglishSynonyms： | EMOLECULES 31660974 |
| pro_mdlNumber： | MFCD17430333 |
| pro_acceptors： | 4 |
| pro_donors： | 2 |
| pro_smile： | COc1ccc2c(c1)c(c[nH]2)CNCc3cccnc3.COc1ccc2c(c1)c(c[nH]2)CNCc3cccnc3.C(=O)(C(=O)O)O |
| InChi： | InChI=1S/2C16H17N3O.C2H2O4/c2*1-20-14-4-5-16-15(7-14)13(11-19-16)10-18-9-12-3-2-6-17-8-12;3-1(4)2(5)6/h2*2-8,11,18-19H,9-10H2,1H3;(H,3,4)(H,5,6) |
| InChiKey： | InChIKey=JJXXKBZNPQCDPG-UHFFFAOYSA-N |
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