basic_info |
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| Product_Name: | 8-AZEPAN-1-YL-3-METHYL-3,7-DIHYDRO-PURINE-2,6-DIONE |
| EnglishSynonyms: | 8-AZEPAN-1-YL-3-METHYL-3,7-DIHYDRO-PURINE-2,6-DIONE |
| pro_mdlNumber: | MFCD00805379 |
| pro_acceptors: | 7 |
| pro_donors: | 2 |
| pro_smile: | Cn1c2c(c(=O)[nH]c1=O)[nH]c(n2)N3CCCCCC3 |
| InChi: | InChI=1S/C12H17N5O2/c1-16-9-8(10(18)15-12(16)19)13-11(14-9)17-6-4-2-3-5-7-17/h2-7H2,1H3,(H,13,14)(H,15,18,19) |
| InChiKey: | InChIKey=XBEDZGNBDDXQLF-UHFFFAOYSA-N |
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