123332 1 2 3 4 8 1 1 1 1 1 1 1 1 2 3 4 1 1 1 10 5 2 1 2 3 4 0 -0.8619 -0.1274 0.4819 0 -0.3262 0.8014 -0.7164 0 0.3643 -0.5688 -0.4864 Conformer ID 11 2.1 PubChem ncbi.nlm.nih.gov 2009.12.11 0001E1C400000001 Energy MMFF94 NoEstat 7 1.6.0 Szybki openeye.com 2012.01.18 0 Feature Self Overlap 7 2.1 PubChem ncbi.nlm.nih.gov 2012.01.18 5.074 Fingerprint Shape 2 2.1 PubChem ncbi.nlm.nih.gov 2012.01.18 260 1 18410856563934756871 Shape Multipoles 8 1.8.1 OEShape openeye.com 2012.01.18 14.71 0.49 0.49 0.49 0 0 0 0 0 0 0 0 0 0 Shape Self Overlap 7 2.1 PubChem ncbi.nlm.nih.gov 2012.01.18 14.042 Shape Volume 7 1.8.1 OEShape openeye.com 2012.01.18 14.7 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 2012.01.18 4 1 -0.7 2 0.57 3 0.57 4 0.57 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 2012.01.18 1 1 1 donor 1 0 0 0 0 0 0 0 1 1