71583 1 2 3 4 5 17 17 17 6 1 5 2 1 2 3 4 4 4 4 5 1 1 1 1 2 5 10 1 2 3 4 5 -0.0962 -1.4059 1.5022 -0.0001 -0.0001 -1.6789 0.9228 0.7561 0 -0.0001 0.1394 0.1394 0.1393 -0.4181 -1.5111 Conformer ID 11 2.1 PubChem ncbi.nlm.nih.gov 2009.12.11 0001179F00000001 Energy MMFF94 NoEstat 7 1.6.0 Szybki openeye.com 2012.01.18 0.0021 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 9722213294276900503 20096714 4 18271525299443713648 21015797 1 8934996009819620991 5943 1 9212183664228565342 Shape Multipoles 8 1.8.1 OEShape openeye.com 2012.01.18 87.93 1.73 1.73 0.7 0.08 0.91 -0.01 -0.91 0.15 -0.08 0.14 0 0 0 Shape Self Overlap 7 2.1 PubChem ncbi.nlm.nih.gov 2012.01.18 124.677 Shape Volume 7 1.8.1 OEShape openeye.com 2012.01.18 67.6 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 -0.29 2 -0.29 3 -0.29 4 0.87 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 0 4 0 0 0 0 0 0 1 1 1