62665 1 2 3 4 15 9 9 9 1 1 1 2 3 4 1 1 1 2 5 10 1 2 3 4 0 0.9872 0.2894 -1.2766 0 -0.9041 1.3069 -0.4029 0.6224 -0.2075 -0.2075 -0.2075 Conformer ID 11 2.1 PubChem ncbi.nlm.nih.gov 2009.12.11 0000F4C900000001 Energy MMFF94 NoEstat 7 1.6.0 Szybki openeye.com 2012.01.18 0 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 8358243856870280083 21015797 1 8502112711370534401 Shape Multipoles 8 1.8.1 OEShape openeye.com 2012.01.18 64.35 1.1 1.1 0.71 0.3 0.22 -0.17 -0.22 0.13 -0.3 0.13 0 0 0 Shape Self Overlap 7 2.1 PubChem ncbi.nlm.nih.gov 2012.01.18 99.7 Shape Volume 7 1.8.1 OEShape openeye.com 2012.01.18 47.1 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 0.52 2 -0.17 3 -0.17 4 -0.17 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