24534 1 2 3 4 5 6 8 8 7 7 1 1 1 -1 3 1 1 2 3 4 4 3 3 4 5 6 1 2 1 1 1 2 5 10 1 2 3 4 5 6 1.1075 -1.11 -0.0002 0.0027 -0.8357 0.8425 0.6099 0.6054 0.0689 -1.2841 -1.6122 -1.6087 0 0 0 0 -0.4703 -0.4703 Conformer ID 11 2.1 PubChem ncbi.nlm.nih.gov 2009.12.11 00005FD600000001 Energy MMFF94 NoEstat 7 1.6.0 Szybki openeye.com 2012.01.18 3.8933 Feature Self Overlap 7 2.1 PubChem ncbi.nlm.nih.gov 2012.01.18 10.223 Fingerprint Shape 2 2.1 PubChem ncbi.nlm.nih.gov 2012.11.26 139733 1 18410856563934997221 21015797 1 18409724071290064130 Shape Multipoles 8 1.8.1 OEShape openeye.com 2012.01.18 60.62 1.11 1.1 0.5 0.42 0.01 0 -0.01 0 -0.37 0 0.01 0 0 Shape Self Overlap 7 2.1 PubChem ncbi.nlm.nih.gov 2012.01.18 104.803 Shape Volume 7 1.8.1 OEShape openeye.com 2012.01.18 40 Conformer RMSD 7 2009.12.11 0.4 Diverse Conformer ID List 6 2010.05.05 1 Charge MMFF94 Partial 2 1.9.0 OEChem openeye.com 2012.11.26 6 1 -0.52 2 -0.52 3 1.03 4 -0.71 5 0.36 6 0.36 Count Effective Rotor 7 1.7.6 OEChem ncbi.nlm.nih.gov 2012.01.18 0 Features Pharmacophore 2 ImplicitMillsDean merged 1.8.3 OEShape openeye.com 2012.11.26 2 1 1 acceptor 1 2 acceptor 4 0 0 0 0 0 0 0 1 1