@MOLECULE n-{(1s)-1-[7-fluoro-2-(2-pyridinyl)-3-quinolinyl]ethyl}-9h-purin-6-amine 45 49 0 0 0 SMALL GASTEIGER @ATOM 1 C 3.9049 -0.3451 -0.3714 C.ar 1 UNL1111 -0.2137 2 N 4.4170 -1.0527 -1.4554 N.ar 1 UNL1111 -0.3375 3 C 5.5781 -1.5647 -1.0532 C.ar 1 UNL1111 0.1193 4 N 5.8722 -1.2217 0.2917 N.ar 1 UNL1111 -0.4070 5 C 4.8119 -0.4463 0.7369 C.ar 1 UNL1111 0.2879 6 N 4.6086 0.1176 1.9539 N.ar 1 UNL1111 -0.5145 7 C 3.4485 0.8027 2.0486 C.ar 1 UNL1111 0.3031 8 N 2.5198 0.9711 1.0766 N.ar 1 UNL1111 -0.5515 9 C 2.7179 0.4117 -0.1534 C.ar 1 UNL1111 0.4626 10 N 1.8065 0.5909 -1.1428 N.pl3 1 UNL1111 -0.4865 11 C 0.5156 1.2597 -0.9152 C.3 1 UNL1111 0.1177 12 C 0.1383 1.9964 -2.2086 C.3 1 UNL1111 -0.4719 13 C -0.5723 0.2747 -0.5454 C.ar 1 UNL1111 -0.0986 14 C -0.3896 -1.0845 -0.6109 C.ar 1 UNL1111 -0.0930 15 C -1.4448 -1.9719 -0.2741 C.ar 1 UNL1111 -0.1018 16 C -1.3008 -3.3848 -0.3204 C.ar 1 UNL1111 -0.0920 17 C -2.3544 -4.2021 -0.0038 C.ar 1 UNL1111 -0.2172 18 C -3.5873 -3.6076 0.3721 C.ar 1 UNL1111 0.2074 19 F -4.5894 -4.4222 0.6652 F 1 UNL1111 -0.1667 20 C -3.7846 -2.2532 0.4451 C.ar 1 UNL1111 -0.2271 21 C -2.6856 -1.4091 0.1175 C.ar 1 UNL1111 0.1854 22 N -2.8616 -0.0499 0.1934 N.ar 1 UNL1111 -0.3827 23 C -1.8522 0.7540 -0.1058 C.ar 1 UNL1111 0.1921 24 C -2.1713 2.2005 0.0400 C.ar 1 UNL1111 0.1590 25 C -3.3145 2.7415 -0.5667 C.ar 1 UNL1111 -0.2048 26 C -3.5845 4.0956 -0.3790 C.ar 1 UNL1111 -0.0856 27 C -2.7230 4.8628 0.4017 C.ar 1 UNL1111 -0.2367 28 C -1.6064 4.2399 0.9770 C.ar 1 UNL1111 0.0571 29 N -1.3331 2.9369 0.7982 N.ar 1 UNL1111 -0.3599 30 H 6.2446 -2.1718 -1.6458 H 1 UNL1111 0.1961 31 H 3.2241 1.2786 3.0204 H 1 UNL1111 0.2038 32 H 1.9787 0.1665 -2.0472 H 1 UNL1111 0.3323 33 H 0.6452 1.9966 -0.0565 H 1 UNL1111 0.2224 34 H 0.9377 2.6818 -2.5197 H 1 UNL1111 0.1655 35 H -0.0579 1.3057 -3.0361 H 1 UNL1111 0.1547 36 H -0.7640 2.6029 -2.0667 H 1 UNL1111 0.1593 37 H 0.5654 -1.5179 -0.9160 H 1 UNL1111 0.1709 38 H -0.3360 -3.8046 -0.6104 H 1 UNL1111 0.1653 39 H -2.2621 -5.2872 -0.0334 H 1 UNL1111 0.1775 40 H -4.7311 -1.7995 0.7422 H 1 UNL1111 0.1979 41 H -3.9802 2.1061 -1.1487 H 1 UNL1111 0.1813 42 H -4.4657 4.5464 -0.8344 H 1 UNL1111 0.1567 43 H -2.9105 5.9189 0.5682 H 1 UNL1111 0.1626 44 H -0.8951 4.7890 1.6061 H 1 UNL1111 0.1753 45 H 6.6731 -1.4746 0.8287 H 1 UNL1111 0.3355 @BOND 1 1 2 ar 2 1 5 ar 3 2 3 ar 4 3 4 ar 5 3 30 1 6 4 45 1 7 5 6 ar 8 5 4 ar 9 7 6 ar 10 7 31 1 11 8 7 ar 12 9 8 ar 13 9 1 ar 14 10 9 1 15 10 32 1 16 11 10 1 17 11 33 1 18 12 11 1 19 12 34 1 20 12 35 1 21 12 36 1 22 13 11 1 23 14 13 ar 24 14 37 1 25 15 14 ar 26 16 15 ar 27 16 38 1 28 17 16 ar 29 17 39 1 30 18 17 ar 31 18 20 ar 32 19 18 1 33 20 21 ar 34 20 40 1 35 21 15 ar 36 21 22 ar 37 22 23 ar 38 23 13 ar 39 23 24 1 40 24 25 ar 41 24 29 ar 42 25 26 ar 43 25 41 1 44 26 27 ar 45 26 42 1 46 27 43 1 47 28 27 ar 48 28 44 1 49 29 28 ar