6344 1 2 3 4 5 17 17 6 1 1 1 2 3 3 3 3 4 5 1 1 1 1 2 5 10 1 2 3 4 5 -1.4577 1.4577 0 0 0 -0.333 -0.333 0.666 1.2951 1.2951 0 0 0 0.8935 -0.8935 Conformer ID 11 2.1 PubChem ncbi.nlm.nih.gov 2009.12.11 000018C800000001 Energy MMFF94 NoEstat 7 1.6.0 Szybki openeye.com 2012.01.18 0.0485 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 18410856563934821830 20096714 4 9223229650167726014 21015797 1 18052817232468212333 Shape Multipoles 8 1.8.1 OEShape openeye.com 2012.01.18 65.48 2.1 0.86 0.64 0 0.06 0 -0.47 0 0 0 0 -0.01 0 Shape Self Overlap 7 2.1 PubChem ncbi.nlm.nih.gov 2012.01.18 88.134 Shape Volume 7 1.8.1 OEShape openeye.com 2012.01.18 52.6 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 -0.29 2 -0.29 3 0.58 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