6375 1 2 3 4 5 6 7 8 8 7 6 1 1 1 1 -1 3 1 1 2 3 4 4 4 3 3 4 5 6 7 1 2 1 1 1 1 2 5 10 1 2 3 4 5 6 7 -0.67 -0.6471 -0.0737 1.3908 1.7487 1.7367 1.7158 -1.0954 1.1078 0 -0.0123 0.8472 -0.9399 0.0483 0.0017 0.0017 -0.0048 0.0014 -0.5696 -0.4602 1.0418 Conformer ID 11 2.1 PubChem ncbi.nlm.nih.gov 2009.12.11 000018E700000001 Energy MMFF94 NoEstat 7 1.6.0 Szybki openeye.com 2012.01.18 3.1888 Feature Self Overlap 7 2.1 PubChem ncbi.nlm.nih.gov 2012.01.18 15.302 Fingerprint Shape 2 2.1 PubChem ncbi.nlm.nih.gov 2012.11.26 139733 1 9294196528739510882 20096714 4 18121782733800605520 21015797 1 9727637215069537322 5943 1 16254411659971568228 Shape Multipoles 8 1.8.1 OEShape openeye.com 2012.01.18 65.6 1.32 1.08 0.54 0.57 0 0 -0.01 0 -0.38 0 0.05 0 0 Shape Self Overlap 7 2.1 PubChem ncbi.nlm.nih.gov 2012.01.18 110.557 Shape Volume 7 1.8.1 OEShape openeye.com 2012.01.18 45.6 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 -0.52 2 -0.52 3 0.8 4 0.24 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 3 1 1 acceptor 1 1 anion 1 2 acceptor 4 0 0 0 0 0 0 0 1 2