@MOLECULE (5-{2-[(2r,6s)-2,6-dimethyl-4-morpholinyl]-4-(4-morpholinyl)pyrido[2,3-d]pyrimidin-7-yl}-2-methoxyphenyl)methanol 65 69 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 C -3.2558 4.1490 -0.6651 C.3 1 UNL1 0.1232 2 C -5.1500 2.7327 -0.5556 C.3 1 UNL1 0.1257 3 C 0.3663 -2.4985 -0.3023 C.ar 1 UNL1 0.0200 4 C 1.7127 -2.2450 -0.3719 C.ar 1 UNL1 -0.3285 5 C 4.0824 0.4987 0.5273 C.ar 1 UNL1 -0.0388 6 C 4.4940 -1.3156 -1.0232 C.ar 1 UNL1 -0.0636 7 C 5.8507 -0.9975 -1.0471 C.ar 1 UNL1 -0.3070 8 C 5.9393 2.0336 1.2539 C.3 1 UNL1 0.0148 9 C -2.9173 5.6108 -0.4018 C.3 1 UNL1 -0.4728 10 C -6.6257 2.8368 -0.1903 C.3 1 UNL1 -0.4748 11 C 8.5642 -0.2074 -0.9600 C.3 1 UNL1 -0.1989 12 H 4.2716 3.0584 0.9069 H 1 UNL1 0.3216 13 C -2.1520 0.7710 0.1547 C.ar 1 UNL1 0.5509 14 C -1.9635 -1.5635 0.0802 C.ar 1 UNL1 0.4616 15 C 2.1720 -0.9015 -0.2069 C.ar 1 UNL1 0.2882 16 C 3.6092 -0.5818 -0.2334 C.ar 1 UNL1 -0.1170 17 C 5.4218 0.8536 0.4928 C.ar 1 UNL1 -0.1750 18 C 6.3034 0.0793 -0.2869 C.ar 1 UNL1 0.2526 19 C -2.4374 3.2141 0.2557 C.3 1 UNL1 -0.1261 20 C -4.4156 1.7365 0.3751 C.3 1 UNL1 -0.1249 21 C -4.0605 -2.7981 -0.2090 C.3 1 UNL1 -0.1226 22 C -2.2421 -3.7742 1.0860 C.3 1 UNL1 -0.1326 23 C -4.4835 -4.2249 -0.6021 C.3 1 UNL1 -0.0513 24 C -2.7090 -5.1666 0.6197 C.3 1 UNL1 -0.0422 25 O 4.9172 2.9308 1.6338 O.3 1 UNL1 -0.5434 26 O 7.5917 0.5010 -0.2041 O.3 1 UNL1 -0.3217 27 O -4.6375 4.0407 -0.3457 O.3 1 UNL1 -0.4231 28 O -4.1067 -5.1530 0.4002 O.3 1 UNL1 -0.3843 29 N -2.7500 -0.4867 0.1768 N.ar 1 UNL1 -0.6215 30 N -0.8079 0.9816 0.1404 N.ar 1 UNL1 -0.5564 31 N -2.9769 1.8542 0.1086 N.pl3 1 UNL1 -0.3693 32 N -2.5933 -2.8180 0.0086 N.pl3 1 UNL1 -0.4066 33 C -0.5371 -1.4454 -0.0511 C.ar 1 UNL1 -0.3740 34 C -0.0077 -0.1119 0.0241 C.ar 1 UNL1 0.4450 35 N 1.3472 0.1262 -0.0282 N.ar 1 UNL1 -0.4207 36 H -1.3549 3.2415 -0.0263 H 1 UNL1 0.1968 37 H -2.5062 3.5411 1.3163 H 1 UNL1 0.1502 38 H -4.6266 1.9704 1.4425 H 1 UNL1 0.1497 39 H -4.7732 0.6982 0.1880 H 1 UNL1 0.1779 40 H -3.1141 3.8758 -1.7346 H 1 UNL1 0.1285 41 H -5.0041 2.4561 -1.6234 H 1 UNL1 0.1277 42 H -3.1483 5.8954 0.6328 H 1 UNL1 0.1604 43 H -1.8579 5.8179 -0.5882 H 1 UNL1 0.1582 44 H -3.5125 6.2698 -1.0473 H 1 UNL1 0.1587 45 H -7.1353 3.5601 -0.8410 H 1 UNL1 0.1603 46 H -7.1350 1.8730 -0.2874 H 1 UNL1 0.1536 47 H -6.7591 3.1970 0.8379 H 1 UNL1 0.1610 48 H -4.3015 -2.0810 -1.0256 H 1 UNL1 0.1646 49 H -4.6098 -2.4554 0.6948 H 1 UNL1 0.1487 50 H -2.7476 -3.5046 2.0420 H 1 UNL1 0.1484 51 H -1.1516 -3.7662 1.2837 H 1 UNL1 0.1528 52 H -5.5818 -4.3316 -0.6357 H 1 UNL1 0.1389 53 H -4.0475 -4.5288 -1.5700 H 1 UNL1 0.1312 54 H -2.1877 -5.4867 -0.2994 H 1 UNL1 0.1313 55 H -2.5858 -5.9289 1.4085 H 1 UNL1 0.1410 56 H -0.0201 -3.5089 -0.4569 H 1 UNL1 0.1597 57 H 2.4297 -3.0398 -0.5418 H 1 UNL1 0.1712 58 H 3.3741 1.0669 1.1474 H 1 UNL1 0.1958 59 H 4.1292 -2.1394 -1.6379 H 1 UNL1 0.1542 60 H 6.5298 -1.5817 -1.6572 H 1 UNL1 0.1622 61 H 6.3844 1.7349 2.2262 H 1 UNL1 0.1525 62 H 6.6923 2.6051 0.6736 H 1 UNL1 0.1329 63 H 8.3558 -0.1340 -2.0318 H 1 UNL1 0.1356 64 H 9.4881 0.3325 -0.7090 H 1 UNL1 0.1546 65 H 8.6304 -1.2497 -0.6333 H 1 UNL1 0.1348 @BOND 1 63 11 1 2 40 1 1 3 60 7 1 4 59 6 1 5 41 2 1 6 53 23 1 7 44 9 1 8 7 6 ar 9 7 18 ar 10 48 21 1 11 6 16 ar 12 11 64 1 13 11 65 1 14 11 26 1 15 45 10 1 16 1 9 1 17 1 27 1 18 1 19 1 19 52 23 1 20 23 21 1 21 23 28 1 22 43 9 1 23 2 27 1 24 2 10 1 25 2 20 1 26 57 4 1 27 56 3 1 28 9 42 1 29 4 3 ar 30 4 15 ar 31 3 33 ar 32 54 24 1 33 46 10 1 34 18 26 1 35 18 17 ar 36 16 15 1 37 16 5 ar 38 21 32 1 39 21 49 1 40 15 35 ar 41 10 47 1 42 33 34 ar 43 33 14 ar 44 35 34 ar 45 36 19 1 46 32 14 1 47 32 22 1 48 34 30 ar 49 14 29 ar 50 31 13 1 51 31 19 1 52 31 20 1 53 30 13 ar 54 13 29 ar 55 39 20 1 56 19 37 1 57 20 38 1 58 28 24 1 59 17 5 ar 60 17 8 1 61 5 58 1 62 24 22 1 63 24 55 1 64 62 8 1 65 12 25 1 66 22 51 1 67 22 50 1 68 8 25 1 69 8 61 1