24845 1 2 3 4 5 6 9 9 9 9 7 7 1 2 3 4 5 5 5 6 6 6 1 1 1 1 1 2 5 10 1 2 3 4 5 6 -0.8087 -1.6254 0.8086 1.6255 -0.6442 0.6442 1.0865 -0.6594 -1.0863 0.6594 0.3001 -0.3002 -0.7621 0.4103 -0.7623 0.4103 0.3519 0.3519 Conformer ID 11 2.1 PubChem ncbi.nlm.nih.gov 2009.12.11 0000610D00000001 Energy MMFF94 NoEstat 7 1.6.0 Szybki openeye.com 2012.01.18 -0.1416 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 11455904537330213355 20096714 4 14907903811691697322 21015797 1 9295282841795428497 5943 1 16033891559179026487 Shape Multipoles 8 1.8.1 OEShape openeye.com 2012.01.18 84.42 1.67 1.02 0.76 0 0 -0.1 0 0.21 0 -0.21 0 0 0.33 Shape Self Overlap 7 2.1 PubChem ncbi.nlm.nih.gov 2012.01.18 145.207 Shape Volume 7 1.8.1 OEShape openeye.com 2012.01.18 53.9 Conformer RMSD 7 2009.12.11 0.4 Diverse Conformer ID List 6 2010.05.05 1 2 3 Charge MMFF94 Partial 2 1.9.0 OEChem openeye.com 2012.11.26 6 1 -0.06 2 -0.06 3 -0.06 4 -0.06 5 0.13 6 0.13 Count Effective Rotor 7 1.7.6 OEChem ncbi.nlm.nih.gov 2012.01.18 1 Features Pharmacophore 2 ImplicitMillsDean merged 1.8.3 OEShape openeye.com 2012.11.26 0 6 0 0 0 0 0 0 0 1 1