3609161 1 2 3 8 8 7 3 1 1 2 3 3 2 2 2 5 10 1 2 3 -1.3359 1.3359 0 0 0 -0.0001 -0.0001 -0.0001 0.0001 Conformer ID 11 2.1 PubChem ncbi.nlm.nih.gov 2009.12.11 0037124900000001 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 10.157 Fingerprint Shape 2 2.1 PubChem ncbi.nlm.nih.gov 2012.11.26 139733 1 14908181949452399363 21015797 1 14691135145788866281 Shape Multipoles 8 1.8.1 OEShape openeye.com 2012.01.18 45.02 1.67 0.5 0.5 0 0 0 0 0 0 0 0 0 0 Shape Self Overlap 7 2.1 PubChem ncbi.nlm.nih.gov 2012.01.18 67.519 Shape Volume 7 1.8.1 OEShape openeye.com 2012.01.18 32.7 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 3 1 -0.68 2 -0.68 3 1.37 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 3 0 0 0 0 0 0 0 1 1