10476 1 2 3 35 7 6 1 2 3 3 1 3 2 5 10 1 2 3 1.6537 -1.4068 -0.2468 0 0 0 0 0 0 Conformer ID 11 2.1 PubChem ncbi.nlm.nih.gov 2009.12.11 000028EC00000001 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 10.148 Fingerprint Shape 2 2.1 PubChem ncbi.nlm.nih.gov 2012.11.26 139733 1 18410856572762081286 20096714 4 9079105670541774038 21015797 1 18122344854545530029 5460574 1 18410856547002801030 Shape Multipoles 8 1.8.1 OEShape openeye.com 2012.01.18 62.7 2.24 0.64 0.64 0.24 0 0 0 0 0.11 0 0.11 0 0 Shape Self Overlap 7 2.1 PubChem ncbi.nlm.nih.gov 2012.01.18 91.049 Shape Volume 7 1.8.1 OEShape openeye.com 2012.01.18 47 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 -0.04 2 -0.56 3 0.6 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 hydrophobe 1 2 acceptor 3 0 0 0 0 0 0 0 1 1