24387 1 2 3 4 17 17 17 15 1 2 3 4 4 4 1 1 1 2 5 10 1 2 3 4 -0.9467 -0.8841 1.8312 -0.0004 1.5677 -1.6037 0.0361 -0.0002 0.257 0.2571 0.2568 -0.7709 Conformer ID 11 2.1 PubChem ncbi.nlm.nih.gov 2009.12.11 00005F4300000001 Energy MMFF94 NoEstat 7 1.6.0 Szybki openeye.com 2012.01.18 0.0001 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 11638827585187785222 16714656 1 8916826554453741646 20096714 4 9988412897608486396 5943 1 16049831514254344565 Shape Multipoles 8 1.8.1 OEShape openeye.com 2012.01.18 91.78 1.89 1.89 0.87 0.19 1.11 0.12 -1.11 -0.33 -0.19 -0.33 0 0 0 Shape Self Overlap 7 2.1 PubChem ncbi.nlm.nih.gov 2012.01.18 116.33 Shape Volume 7 1.8.1 OEShape openeye.com 2012.01.18 77.2 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 -0.21 2 -0.21 3 -0.21 4 0.63 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