@MOLECULE 4-(2-amino-4-methyl-1,3-thiazol-5-yl)-n-[4-(4-morpholinyl)phenyl]-2-pyrimidinamine 46 49 0 0 0 SMALL GASTEIGER @ATOM 1 S -4.9826 1.0099 0.6134 S.2 1 UNL1111111111 0.1413 2 O 6.8328 1.9298 -0.0983 O.3 1 UNL1111111111 -0.3855 3 N 4.4974 0.4035 0.2923 N.pl3 1 UNL1111111111 -0.4226 4 N -0.0745 -2.8814 0.0426 N.pl3 1 UNL1111111111 -0.4662 5 N -1.7706 -1.2005 -0.0381 N.ar 1 UNL1111111111 -0.5452 6 N -2.2808 -3.5779 0.0175 N.ar 1 UNL1111111111 -0.5323 7 N -3.3992 2.7825 -0.5158 N.ar 1 UNL1111111111 -0.5390 8 N -5.3667 3.7619 0.3477 N.pl3 1 UNL1111111111 -0.5738 9 C 4.4679 1.6258 -0.5472 C.3 1 UNL1111111111 -0.1417 10 C 5.8120 -0.2630 0.1713 C.3 1 UNL1111111111 -0.1486 11 C 5.5707 2.5666 -0.0269 C.3 1 UNL1111111111 -0.0476 12 C 6.8764 0.7391 0.6653 C.3 1 UNL1111111111 -0.0437 13 C 3.3474 -0.4240 0.1218 C.ar 1 UNL1111111111 0.1425 14 C 2.1379 0.0562 0.6581 C.ar 1 UNL1111111111 -0.1656 15 C 3.3819 -1.6958 -0.4622 C.ar 1 UNL1111111111 -0.2093 16 C 1.0351 -2.0014 0.0518 C.ar 1 UNL1111111111 0.1754 17 C 0.9921 -0.7234 0.6272 C.ar 1 UNL1111111111 -0.1531 18 C 2.2347 -2.4807 -0.4979 C.ar 1 UNL1111111111 -0.1932 19 C -1.4010 -2.5140 0.0072 C.ar 1 UNL1111111111 0.5288 20 C -3.0971 -0.9215 -0.0850 C.ar 1 UNL1111111111 0.3704 21 C -3.4741 0.4687 -0.1090 C.ar 1 UNL1111111111 -0.4030 22 C -2.7788 1.5444 -0.6372 C.ar 1 UNL1111111111 0.3450 23 C -4.0492 -1.9601 -0.1025 C.ar 1 UNL1111111111 -0.4399 24 C -3.5849 -3.2784 -0.0405 C.ar 1 UNL1111111111 0.1760 25 C -1.4729 1.4990 -1.3241 C.3 1 UNL1111111111 -0.4417 26 C -4.5749 2.6888 0.1129 C.ar 1 UNL1111111111 0.3181 27 H 3.4759 2.1144 -0.4585 H 1 UNL1111111111 0.1494 28 H 4.6322 1.3979 -1.6224 H 1 UNL1111111111 0.1329 29 H 6.0490 -0.5810 -0.8664 H 1 UNL1111111111 0.1302 30 H 5.8187 -1.1661 0.8173 H 1 UNL1111111111 0.1494 31 H 5.7034 3.4509 -0.6734 H 1 UNL1111111111 0.1380 32 H 5.3734 2.8854 1.0114 H 1 UNL1111111111 0.1317 33 H 6.7405 0.9780 1.7346 H 1 UNL1111111111 0.1323 34 H 7.9005 0.3679 0.4843 H 1 UNL1111111111 0.1379 35 H 2.1119 1.0403 1.1262 H 1 UNL1111111111 0.1659 36 H 4.2996 -2.0777 -0.9004 H 1 UNL1111111111 0.1539 37 H 0.0627 -0.3410 1.0595 H 1 UNL1111111111 0.1934 38 H 2.2739 -3.4645 -0.9611 H 1 UNL1111111111 0.1581 39 H 0.1178 -3.8811 -0.0075 H 1 UNL1111111111 0.3340 40 H -5.1092 -1.7628 -0.1789 H 1 UNL1111111111 0.1847 41 H -4.2732 -4.1346 -0.0384 H 1 UNL1111111111 0.1725 42 H -1.2672 2.4143 -1.9018 H 1 UNL1111111111 0.1757 43 H -0.6546 1.3688 -0.5908 H 1 UNL1111111111 0.1918 44 H -1.3985 0.6306 -2.0011 H 1 UNL1111111111 0.1819 45 H -5.0677 4.6747 0.0554 H 1 UNL1111111111 0.3229 46 H -6.2413 3.6875 0.8190 H 1 UNL1111111111 0.3177 @BOND 1 1 21 ar 2 1 26 ar 3 2 11 1 4 2 12 1 5 3 9 1 6 3 10 1 7 3 13 1 8 4 16 1 9 4 19 1 10 4 39 1 11 5 19 ar 12 5 20 ar 13 6 19 ar 14 6 24 ar 15 7 22 ar 16 7 26 ar 17 8 26 1 18 8 45 1 19 8 46 1 20 9 11 1 21 9 27 1 22 9 28 1 23 10 12 1 24 10 29 1 25 10 30 1 26 11 31 1 27 11 32 1 28 12 33 1 29 12 34 1 30 13 14 ar 31 13 15 ar 32 14 17 ar 33 14 35 1 34 15 18 ar 35 15 36 1 36 16 17 ar 37 16 18 ar 38 17 37 1 39 18 38 1 40 20 21 1 41 20 23 ar 42 21 22 ar 43 22 25 1 44 23 24 ar 45 23 40 1 46 24 41 1 47 25 42 1 48 25 43 1 49 25 44 1