140430 1 2 3 16 9 7 1 1 2 3 1 3 2 5 10 1 2 3 0.1295 -1.1806 1.0511 0.6365 -0.2629 -0.3737 0 0 0 Conformer ID 11 2.1 PubChem ncbi.nlm.nih.gov 2009.12.11 0002248E00000001 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 17834396000699954948 21015797 1 18412265059862920108 Shape Multipoles 8 1.8.1 OEShape openeye.com 2012.01.18 53.33 1.25 0.81 0.58 0.14 0.16 0 -0.24 0 -0.04 0 -0.02 0.05 0 Shape Self Overlap 7 2.1 PubChem ncbi.nlm.nih.gov 2012.01.18 81.051 Shape Volume 7 1.8.1 OEShape openeye.com 2012.01.18 39.3 Conformer RMSD 7 2009.12.11 0.4 Diverse Conformer ID List 6 2010.05.05 1 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 3 0 0 0 0 0 0 0 1 1