6373 1 2 3 4 5 9 9 9 6 1 1 2 3 4 4 4 4 5 1 1 1 1 2 5 10 1 2 3 4 5 1.043 0.0912 -1.1342 0 0 0.7075 -1.257 0.5495 0 0 0.121 0.121 0.121 -0.3629 -1.4558 Conformer ID 11 2.1 PubChem ncbi.nlm.nih.gov 2009.12.11 000018E500000001 Energy MMFF94 NoEstat 7 1.6.0 Szybki openeye.com 2012.01.18 0.7601 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 9650021594159010270 21015797 1 9653653276633333166 5943 1 11460115520571898405 Shape Multipoles 8 1.8.1 OEShape openeye.com 2012.01.18 60.5 1.04 1.04 0.57 0.32 0.07 -0.06 -0.07 0.07 -0.32 0.07 0 0 0 Shape Self Overlap 7 2.1 PubChem ncbi.nlm.nih.gov 2012.01.18 103.536 Shape Volume 7 1.8.1 OEShape openeye.com 2012.01.18 41 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 -0.34 2 -0.34 3 -0.34 4 1.02 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 0 1 1