basic_info |
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| Product_Name: | 3-[(4-ISOBUTYLPIPERAZIN-1-YL)CARBONYL]BENZOIC ACID |
| EnglishSynonyms: | 3-[(4-ISOBUTYLPIPERAZIN-1-YL)CARBONYL]BENZOIC ACID ; AKOS BB-3868 |
| pro_mdlNumber: | MFCD05862569 |
| pro_acceptors: | 5 |
| pro_donors: | 1 |
| pro_smile: | C(C(C)C)N1CCN(CC1)C(=O)C=1C=C(C(=O)O)C=CC1 |
| InChi: | InChI=1S/C16H22N2O3/c1-12(2)11-17-6-8-18(9-7-17)15(19)13-4-3-5-14(10-13)16(20)21/h3-5,10,12H,6-9,11H2,1-2H3,(H,20,21) |
| InChiKey: | InChIKey=XOKPOUSLSMWADC-UHFFFAOYSA-N |
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