83547 1 2 3 35 8 1 1 2 2 3 1 1 2 5 10 1 2 3 -0.9021 0.9021 1.2409 0 0 0.624 0 0 0.6639 Conformer ID 11 2.1 PubChem ncbi.nlm.nih.gov 2009.12.11 0001465B00000001 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 21015797 1 18122347053737577637 260 1 18410856564124647943 Shape Multipoles 8 1.8.1 OEShape openeye.com 2012.01.18 41.23 1.39 0.65 0.65 0.09 0 0 0 0 -0.1 0 -0.1 0 0 Shape Self Overlap 7 2.1 PubChem ncbi.nlm.nih.gov 2012.01.18 49.031 Shape Volume 7 1.8.1 OEShape openeye.com 2012.01.18 36.4 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 2 2 -0.41 3 0.4 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 2 0 0 0 0 0 0 0 1 1