6347 1 2 3 4 8 7 6 1 1 2 2 3 3 4 2 2 1 2 5 10 1 2 3 4 -1.1746 1.1733 0.0013 1.5494 -0.0001 -0.0001 0.0001 0.8519 0 0 -0.0001 -0.4306 Conformer ID 11 2.1 PubChem ncbi.nlm.nih.gov 2009.12.11 000018CB00000001 Energy MMFF94 NoEstat 7 1.6.0 Szybki openeye.com 2012.01.18 -0.0106 Feature Self Overlap 7 2.1 PubChem ncbi.nlm.nih.gov 2012.01.18 10.148 Fingerprint Shape 2 2.1 PubChem ncbi.nlm.nih.gov 2012.11.26 139733 1 11239998957758391586 21015797 1 11238837903544133728 Shape Multipoles 8 1.8.1 OEShape openeye.com 2012.01.18 50.89 1.37 0.55 0.55 0.01 0 0 0 0 -0.01 0 -0.01 0 0 Shape Self Overlap 7 2.1 PubChem ncbi.nlm.nih.gov 2012.01.18 86.578 Shape Volume 7 1.8.1 OEShape openeye.com 2012.01.18 33.3 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 4 1 -0.49 2 -0.7 3 0.79 4 0.4 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 2 1 2 acceptor 1 2 donor 3 0 0 0 0 0 0 0 1 2