62407 1 2 3 4 5 35 9 9 6 1 1 2 3 4 4 4 4 5 1 1 1 1 2 5 10 1 2 3 4 5 -1.7149 0.7779 0.778 0.159 0.2565 0 1.0899 -1.0899 0 0 0.0926 0.1402 0.1402 -0.3731 -1.4611 Conformer ID 11 2.1 PubChem ncbi.nlm.nih.gov 2009.12.11 0000F3C700000001 Energy MMFF94 NoEstat 7 1.6.0 Szybki openeye.com 2012.01.18 0.3429 Feature Self Overlap 7 2.1 PubChem ncbi.nlm.nih.gov 2012.01.18 5.074 Fingerprint Shape 2 2.1 PubChem ncbi.nlm.nih.gov 2012.11.26 139733 1 9726759787705784855 20096714 4 18200880698333272569 21015797 1 8645955280723898927 5943 1 17269234624378297346 Shape Multipoles 8 1.8.1 OEShape openeye.com 2012.01.18 73.71 1.8 1.03 0.65 0.94 0 0.03 0 -0.1 -0.34 -0.08 0.09 0 0 Shape Self Overlap 7 2.1 PubChem ncbi.nlm.nih.gov 2012.01.18 113.024 Shape Volume 7 1.8.1 OEShape openeye.com 2012.01.18 55 Conformer RMSD 7 2009.12.11 0.4 Diverse Conformer ID List 6 2010.05.05 1 Charge MMFF94 Partial 2 1.9.0 OEChem openeye.com 2012.11.26 4 1 -0.23 2 -0.34 3 -0.34 4 0.91 Count Effective Rotor 7 1.7.6 OEChem ncbi.nlm.nih.gov 2012.01.18 0 Features Pharmacophore 2 ImplicitMillsDean merged 1.8.3 OEShape openeye.com 2012.11.26 1 1 1 hydrophobe 4 0 0 0 0 0 0 0 1 1