HMDB0015102 RDKit 3D Desloratadine 41 44 0 0 0 0 0 0 0 0999 V2000 -2.5133 5.1228 1.2752 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.8075 3.5495 0.9455 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6575 3.1591 1.6318 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1097 1.9462 1.3789 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 1.1302 0.4433 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8562 1.4703 -0.2652 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4010 2.6979 -0.0017 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6235 0.6335 -1.2372 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0154 -0.6783 -0.6495 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9848 -1.6338 -0.2818 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4454 -2.9705 -0.3852 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5607 -3.9554 -0.0492 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2592 -3.7098 0.3795 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1428 -2.4201 0.4647 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6885 -1.4430 0.1467 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0211 -0.1384 0.2929 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2968 -0.0522 0.1291 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0638 1.1933 0.0484 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8849 1.0015 -1.2927 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9690 0.1300 -0.9374 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6248 -0.7315 0.1615 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2049 -1.2522 0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1774 3.7920 2.3675 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7686 1.5082 1.8814 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2806 3.0206 -0.5116 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9364 0.4399 -2.0862 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4971 1.1691 -1.6331 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8123 -1.1278 -1.3073 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5838 -0.4406 0.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4525 -3.1067 -0.7191 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8980 -4.9809 -0.1232 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4089 -4.5160 0.6359 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4709 2.1231 -0.1485 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8366 1.3649 0.7881 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2118 0.5594 -2.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2270 2.0123 -1.5585 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7694 0.7563 -0.6362 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2759 -1.6693 0.1082 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8700 -0.2936 1.1662 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1190 -1.8687 1.0273 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1028 -1.7913 -0.8411 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 2 0 6 8 1 0 8 9 1 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 2 3 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 7 2 1 0 15 10 1 0 22 17 1 0 16 5 1 0 3 23 1 0 4 24 1 0 7 25 1 0 8 26 1 0 8 27 1 0 9 28 1 0 9 29 1 0 11 30 1 0 12 31 1 0 13 32 1 0 18 33 1 0 18 34 1 0 19 35 1 0 19 36 1 0 20 37 1 0 21 38 1 0 21 39 1 0 22 40 1 0 22 41 1 0 M END