@MOLECULE 4-[(2-isopropoxyethyl)amino]-7-(6-methoxy-3-pyridinyl)-1-(2-propoxyethyl)pyrido[4,3-d]pyrimidin-2(1h)-one 63 65 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 N 0.7108 1.4476 -0.9371 N.ar 1 UNL1 -0.4866 2 C 5.8117 -3.4766 2.2248 C.3 1 UNL1 -0.5023 3 N -1.4374 -2.1262 -0.5256 N.ar 1 UNL1 -0.4474 4 C -2.0730 -0.9199 -0.3776 C.ar 1 UNL1 0.3116 5 C -0.1379 -2.1341 -0.8031 C.ar 1 UNL1 0.1733 6 C 0.6372 -0.9647 -0.9500 C.ar 1 UNL1 -0.3856 7 C 0.0734 2.7634 -0.7777 C.3 1 UNL1 -0.1226 8 C -4.3621 0.0677 -0.4600 C.ar 1 UNL1 0.1340 9 C -5.4160 -2.1484 0.8203 C.ar 1 UNL1 -0.3320 10 C -1.3966 0.2892 -0.4852 C.ar 1 UNL1 -0.3942 11 N -5.6825 0.0504 -0.2070 N.ar 1 UNL1 -0.4886 12 C -3.5055 -0.9819 -0.0909 C.ar 1 UNL1 -0.2230 13 C 1.8134 6.1865 1.0593 C.3 1 UNL1 -0.2711 14 C -4.0609 -2.1081 0.5455 C.ar 1 UNL1 0.0257 15 O 4.3406 -3.2853 0.3191 O.3 1 UNL1 -0.4501 16 C 4.3769 -3.2652 1.7425 C.3 1 UNL1 0.1716 17 C 4.8598 -2.1214 -0.3037 C.3 1 UNL1 -0.0660 18 C 3.4635 -4.4305 2.1282 C.3 1 UNL1 -0.4732 19 C 4.1815 -2.1127 -1.6861 C.3 1 UNL1 -0.0868 20 N 2.7171 -2.1182 -1.5429 N.pl3 1 UNL1 -0.4556 21 C -0.0127 0.2908 -0.7904 C.ar 1 UNL1 0.3517 22 C 2.1407 1.4200 -1.2072 C.ar 1 UNL1 0.7155 23 N 2.7480 0.1907 -1.3309 N.ar 1 UNL1 -0.6206 24 C 2.0584 -0.9480 -1.2537 C.ar 1 UNL1 0.4777 25 O 2.7114 2.4796 -1.2966 O.2 1 UNL1 -0.4697 26 C -0.1223 3.1242 0.7123 C.3 1 UNL1 -0.0552 27 O 0.2523 4.4624 0.9324 O.3 1 UNL1 -0.4044 28 C 1.6587 4.6630 1.0716 C.3 1 UNL1 -0.0478 29 C 3.2915 6.5637 1.0535 C.3 1 UNL1 -0.4374 30 C -6.1862 -1.0333 0.4251 C.ar 1 UNL1 0.4146 31 O -7.4979 -1.0922 0.7100 O.3 1 UNL1 -0.2990 32 C -8.2984 0.0261 0.3142 C.3 1 UNL1 -0.1823 33 H 5.8495 -3.6718 3.3011 H 1 UNL1 0.1531 34 H 6.2705 -4.3332 1.7151 H 1 UNL1 0.1611 35 H 6.4394 -2.6027 2.0224 H 1 UNL1 0.1501 36 H 0.3084 -3.1327 -0.9175 H 1 UNL1 0.1668 37 H 0.7180 3.5445 -1.2618 H 1 UNL1 0.1956 38 H -0.8869 2.7938 -1.3349 H 1 UNL1 0.1522 39 H -3.9990 0.9599 -0.9889 H 1 UNL1 0.1782 40 H -5.8861 -2.9929 1.3127 H 1 UNL1 0.1873 41 H -1.9208 1.2254 -0.3221 H 1 UNL1 0.1859 42 H 1.2998 6.6037 0.1707 H 1 UNL1 0.1493 43 H 1.2965 6.6268 1.9324 H 1 UNL1 0.1424 44 H -3.4101 -2.9483 0.8148 H 1 UNL1 0.1845 45 H 3.9668 -2.2960 2.1054 H 1 UNL1 0.1159 46 H 4.6158 -1.2088 0.2697 H 1 UNL1 0.1433 47 H 5.9543 -2.2225 -0.3858 H 1 UNL1 0.1253 48 H 3.4423 -4.5764 3.2126 H 1 UNL1 0.1527 49 H 2.4366 -4.2575 1.7868 H 1 UNL1 0.1529 50 H 3.8049 -5.3658 1.6666 H 1 UNL1 0.1596 51 H 4.5094 -1.2155 -2.2672 H 1 UNL1 0.1870 52 H 4.4637 -3.0187 -2.2683 H 1 UNL1 0.1526 53 H 2.3429 -2.9851 -1.1690 H 1 UNL1 0.3126 54 H -1.1915 3.1303 0.9986 H 1 UNL1 0.1452 55 H 0.4223 2.4368 1.3817 H 1 UNL1 0.1318 56 H 2.2029 4.1865 0.2348 H 1 UNL1 0.1458 57 H 1.9855 4.2149 2.0240 H 1 UNL1 0.1148 58 H 3.4226 7.6517 1.0548 H 1 UNL1 0.1420 59 H 3.8133 6.1673 1.9318 H 1 UNL1 0.1422 60 H 3.8010 6.1726 0.1631 H 1 UNL1 0.1513 61 H -7.9516 0.9411 0.8061 H 1 UNL1 0.1479 62 H -8.2749 0.1478 -0.7739 H 1 UNL1 0.1485 63 H -9.2928 -0.2714 0.6674 H 1 UNL1 0.1481 @BOND 1 52 19 1 2 51 19 1 3 19 20 1 4 19 17 1 5 20 24 1 6 20 53 1 7 38 7 1 8 23 24 ar 9 23 22 ar 10 25 22 2 11 37 7 1 12 24 6 ar 13 22 1 ar 14 39 8 1 15 6 5 ar 16 6 21 ar 17 1 21 ar 18 1 7 1 19 36 5 1 20 5 3 ar 21 21 10 ar 22 7 26 1 23 62 32 1 24 3 4 ar 25 10 4 ar 26 10 41 1 27 8 11 ar 28 8 12 ar 29 47 17 1 30 4 12 1 31 17 46 1 32 17 15 1 33 11 30 ar 34 12 14 ar 35 60 29 1 36 42 13 1 37 56 28 1 38 32 63 1 39 32 31 1 40 32 61 1 41 15 16 1 42 30 31 1 43 30 9 ar 44 14 44 1 45 14 9 ar 46 26 27 1 47 26 54 1 48 26 55 1 49 9 40 1 50 27 28 1 51 29 58 1 52 29 13 1 53 29 59 1 54 13 28 1 55 13 43 1 56 28 57 1 57 50 18 1 58 34 2 1 59 16 45 1 60 16 18 1 61 16 2 1 62 49 18 1 63 35 2 1 64 18 48 1 65 2 33 1