11 1 2 3 4 5 6 7 8 17 17 6 6 1 1 1 1 1 2 3 3 3 4 4 3 4 4 5 6 7 8 1 1 1 1 1 1 1 2 5 10 1 2 3 4 5 6 7 8 1.6464 -1.6463 0.6836 -0.6837 0.5957 1.2473 -1.2475 -0.5958 -0.711 -0.7111 0.7111 0.7111 0.7093 1.6007 1.6007 0.7094 0.1375 -0.1375 -0.331 0.331 -1.422 -0.0354 0.0354 1.4219 Conformer ID 11 2.1 PubChem ncbi.nlm.nih.gov 2009.12.11 0000000B00000001 Energy MMFF94 NoEstat 7 1.6.0 Szybki openeye.com 2012.01.18 0.3519 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 9295288347943553795 21015797 1 9150910329344194592 5943 1 12850678291505699392 Shape Multipoles 8 1.8.1 OEShape openeye.com 2012.01.18 86.06 2.27 1.14 0.7 0 0.01 0 0.81 0 0 0 0 -0.02 -0.16 Shape Self Overlap 7 2.1 PubChem ncbi.nlm.nih.gov 2012.01.18 126.056 Shape Volume 7 1.8.1 OEShape openeye.com 2012.01.18 65 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 4 1 -0.29 2 -0.29 3 0.29 4 0.29 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 4 0 0 0 0 0 0 0 1 1