6337 1 2 3 4 5 6 7 8 17 6 6 1 1 1 1 1 1 2 2 2 3 3 3 2 3 4 5 6 7 8 1 1 1 1 1 1 1 2 5 10 1 2 3 4 5 6 7 8 1.4165 -0.126 -1.2905 -0.1506 -0.1506 -2.2374 -1.2732 -1.2732 0.2652 -0.6165 0.3513 -1.2536 -1.2536 -0.198 0.9925 0.9925 0 0 0 -0.8886 0.8885 0 0.8874 -0.8874 Conformer ID 11 2.1 PubChem ncbi.nlm.nih.gov 2009.12.11 000018C100000001 Energy MMFF94 NoEstat 7 1.6.0 Szybki openeye.com 2012.01.18 -2.1527 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 18410856551060462948 21015797 1 18047757279994090959 Shape Multipoles 8 1.8.1 OEShape openeye.com 2012.01.18 63.61 1.88 0.82 0.63 0.22 0.05 0 -0.36 0 -0.03 0 0.02 0 0 Shape Self Overlap 7 2.1 PubChem ncbi.nlm.nih.gov 2012.01.18 90.326 Shape Volume 7 1.8.1 OEShape openeye.com 2012.01.18 49.7 Conformer RMSD 7 2009.12.11 0.4 Diverse Conformer ID List 6 2010.05.05 1 Charge MMFF94 Partial 2 1.7.6 OEChem openeye.com 2012.05.21 2 1 -0.29 2 0.29 Count Effective Rotor 7 1.7.6 OEChem ncbi.nlm.nih.gov 2012.01.18 0 Features Pharmacophore 2 ImplicitMillsDean merged 1.8.1 OEShape openeye.com 2012.05.21 0 3 0 0 0 0 0 0 0 1 1