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Partial 2 2.3.0 OEChem OpenEye Scientific Software 2019.06.18 31 1 -0.2 11 0.37 13 0.1 14 0.1 17 0.1 18 0.1 19 -0.15 2 -0.57 20 0.3 21 -0.15 25 0.09 26 -0.15 27 -0.15 28 -0.15 29 0.54 3 -0.81 30 -0.15 31 -0.15 4 -0.57 48 0.15 5 -0.73 51 0.15 6 0.27 61 0.15 62 0.15 63 0.15 64 0.37 65 0.15 66 0.15 7 0.27 8 0.27 Count Effective Rotor 7 2.3.0 OEChem ncbi.nlm.nih.gov 2019.06.18 9.4 Features Pharmacophore 2 ImplicitMillsDean merged 2.0.4 Shape TK OpenEye Scientific Software 2019.06.18 9 1 2 acceptor 1 3 cation 1 4 cation 1 5 donor 4 15 22 23 24 hydrophobe 5 3 6 7 9 10 rings 6 1 4 13 14 17 18 rings 6 13 17 19 25 26 27 rings 6 14 18 21 28 30 31 rings 31 1 1 0 0 0 0 0 1 2