6343 1 2 3 4 5 6 7 8 9 16 6 6 1 1 1 1 1 1 1 1 2 2 2 3 3 3 2 9 3 4 5 6 7 8 1 1 1 1 1 1 1 1 2 5 10 1 2 3 4 5 6 7 8 9 1.4415 -0.142 -1.2995 -0.1882 -0.1882 -1.2851 -1.2851 -2.2492 2.2236 -0.2624 0.6214 -0.359 1.2622 1.2622 -0.9984 -0.9984 0.1861 0.8269 0 0 0 0.8857 -0.8857 -0.8892 0.8893 0 0 Conformer ID 11 2.1 PubChem ncbi.nlm.nih.gov 2009.12.11 000018C700000001 Energy MMFF94 NoEstat 7 1.6.0 Szybki openeye.com 2012.01.18 -0.2523 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 18050568439210963397 20096714 4 9439402436650349622 21015797 1 18052818340596128973 Shape Multipoles 8 1.8.1 OEShape openeye.com 2012.01.18 65.59 1.95 0.83 0.64 0.23 0.04 0 -0.37 0 -0.03 0 0.04 -0.01 0 Shape Self Overlap 7 2.1 PubChem ncbi.nlm.nih.gov 2012.01.18 92.594 Shape Volume 7 1.8.1 OEShape openeye.com 2012.01.18 51.5 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 -0.41 2 0.23 9 0.18 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