24529 1 2 3 4 8 8 7 1 1 1 2 3 4 3 1 1 2 2 5 10 1 2 3 4 -1.1533 1.1149 0.0384 -1.8319 0.2461 0.2724 -0.5185 -0.4499 0 0 0 0 Conformer ID 11 2.1 PubChem ncbi.nlm.nih.gov 2009.12.11 00005FD100000001 Energy MMFF94 NoEstat 7 1.6.0 Szybki openeye.com 2012.01.18 -0.0089 Feature Self Overlap 7 2.1 PubChem ncbi.nlm.nih.gov 2012.01.18 10.208 Fingerprint Shape 2 2.1 PubChem ncbi.nlm.nih.gov 2012.11.26 139733 1 18410856568229847588 21015797 1 18047755080944435654 Shape Multipoles 8 1.8.1 OEShape openeye.com 2012.01.18 45.02 1.34 0.64 0.5 0.05 0.04 0 -0.22 0 -0.01 0 0 0 0 Shape Self Overlap 7 2.1 PubChem ncbi.nlm.nih.gov 2012.01.18 67.594 Shape Volume 7 1.8.1 OEShape openeye.com 2012.01.18 32.7 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 -0.3 3 0.12 4 0.4 Count Effective Rotor 7 1.7.6 OEChem ncbi.nlm.nih.gov 2012.01.18 0 Features Pharmacophore 2 ImplicitMillsDean merged 1.8.3 OEShape openeye.com 2012.11.26 2 1 1 acceptor 1 2 acceptor 3 0 0 0 0 0 0 0 1 1