314937 1 2 3 4 8 8 6 6 1 2 3 3 4 4 2 2 2 2 5 10 1 2 3 4 1.776 -1.776 0.6 -0.6 0 0.0001 0 -0.0001 0 -0.0001 0 0.0001 Conformer ID 11 2.1 PubChem ncbi.nlm.nih.gov 2009.12.11 0004CE3900000001 Energy MMFF94 NoEstat 7 1.6.0 Szybki openeye.com 2012.01.18 -0.0752 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 18410575084663091910 20096714 4 9078820896866708194 21015797 1 18122343755028627502 5460574 1 18410855447243259910 Shape Multipoles 8 1.8.1 OEShape openeye.com 2012.01.18 70.58 2.09 0.56 0.56 0 0 0 0 0 0 0 0 0 0 Shape Self Overlap 7 2.1 PubChem ncbi.nlm.nih.gov 2012.01.18 129.766 Shape Volume 7 1.8.1 OEShape openeye.com 2012.01.18 43.3 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 -0.49 2 -0.49 3 0.49 4 0.49 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