6370 1 2 3 4 5 17 17 9 6 1 1 2 3 4 4 4 4 5 1 1 1 1 2 5 10 1 2 3 4 5 1.4581 -1.4581 0.0001 0 -0.0001 -0.7426 -0.7424 1.3643 0.1206 0.2194 0.1143 0.1143 0.1586 -0.3872 -1.4758 Conformer ID 11 2.1 PubChem ncbi.nlm.nih.gov 2009.12.11 000018E200000001 Energy MMFF94 NoEstat 7 1.6.0 Szybki openeye.com 2012.01.18 0.0479 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 9799691501914289951 20096714 4 17623299676830256849 21015797 1 9655570781988875332 5943 1 11075653223866971148 Shape Multipoles 8 1.8.1 OEShape openeye.com 2012.01.18 78.78 1.82 1.22 0.66 0 0.32 -0.02 -0.76 0.11 0 0.1 0 -0.03 0 Shape Self Overlap 7 2.1 PubChem ncbi.nlm.nih.gov 2012.01.18 117.431 Shape Volume 7 1.8.1 OEShape openeye.com 2012.01.18 59.3 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 -0.29 2 -0.29 3 -0.34 4 0.92 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