61437 1 2 3 4 17 17 17 7 1 2 3 4 4 4 1 1 1 2 5 10 1 2 3 4 0.7581 0.9093 -1.6674 0 -1.4874 1.4001 0.0872 0.0001 0.1399 0.1399 0.1399 -0.4196 Conformer ID 11 2.1 PubChem ncbi.nlm.nih.gov 2009.12.11 0000EFFD00000001 Energy MMFF94 NoEstat 7 1.6.0 Szybki openeye.com 2012.01.18 0.0001 Feature Self Overlap 7 2.1 PubChem ncbi.nlm.nih.gov 2012.01.18 0 Fingerprint Shape 2 2.1 PubChem ncbi.nlm.nih.gov 2012.11.26 139733 1 9797963056882373483 20096714 4 18199472245270600641 21015797 1 8646499517510099293 5943 1 15005555485187250866 Shape Multipoles 8 1.8.1 OEShape openeye.com 2012.01.18 82.95 1.76 1.76 0.67 0.88 0.35 0.02 -0.35 0.13 -0.88 0.13 0 0 0 Shape Self Overlap 7 2.1 PubChem ncbi.nlm.nih.gov 2012.01.18 112.457 Shape Volume 7 1.8.1 OEShape openeye.com 2012.01.18 66.3 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 4 1 -0.05 2 -0.05 3 -0.05 4 0.15 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 0 4 0 0 0 0 0 0 0 1 1