123323 1 2 3 4 16 16 9 9 1 1 2 2 3 4 1 1 1 2 5 10 1 2 3 4 -0.8695 0.8697 -1.6437 1.6435 0.5567 0.5565 -0.5565 -0.5566 -0.5422 0.5423 0.2868 -0.2869 Conformer ID 11 2.1 PubChem ncbi.nlm.nih.gov 2009.12.11 0001E1BB00000002 Energy MMFF94 NoEstat 7 1.6.0 Szybki openeye.com 2012.01.18 -8.5591 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 9223230753905677825 20096714 4 14476679783689513129 21015797 1 8639085553495864205 5943 1 14926999979293006113 Shape Multipoles 8 1.8.1 OEShape openeye.com 2012.01.18 75.47 2.07 0.89 0.81 0 0.08 0 -0.38 0 0 0 0 0.05 0.29 Shape Self Overlap 7 2.1 PubChem ncbi.nlm.nih.gov 2012.01.18 107.062 Shape Volume 7 1.8.1 OEShape openeye.com 2012.01.18 58.9 Conformer RMSD 7 2009.12.11 0.4 Diverse Conformer ID List 6 2010.05.05 2 1 3 5 4 Charge MMFF94 Partial 2 1.9.0 OEChem openeye.com 2012.11.26 4 1 0.08 2 0.08 3 -0.08 4 -0.08 Count Effective Rotor 7 1.7.6 OEChem ncbi.nlm.nih.gov 2012.01.18 1 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