24386 1 2 3 4 17 17 16 8 1 2 3 3 3 4 1 1 2 2 5 10 1 2 3 4 1.5329 -1.532 0.0001 -0.001 0.8101 0.8116 -0.2174 -1.4042 -0.1679 -0.1678 0.6265 -0.2908 Conformer ID 11 2.1 PubChem ncbi.nlm.nih.gov 2009.12.11 00005F4200000001 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 18335420166369952881 16714656 1 18122351434535673733 20096714 4 18333448742100530248 21015797 1 9726539936787877618 5943 1 17105593342432968466 Shape Multipoles 8 1.8.1 OEShape openeye.com 2012.01.18 84.04 1.89 1.33 0.77 0 0.31 -0.09 -0.92 0.17 0 0.18 0 0.04 0 Shape Self Overlap 7 2.1 PubChem ncbi.nlm.nih.gov 2012.01.18 117.866 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 -0.11 2 -0.11 3 0.73 4 -0.5 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