@MOLECULE 8-{[2-methoxy-5-(4-methyl-1-piperazinyl)phenyl]amino}-1-methyl-4,5-dihydro-1h-pyrazolo[4,3-h]quinazoline-3-carboxamide 61 65 0 0 0 SMALL GASTEIGER @ATOM 1 N -0.2389 0.7375 0.1162 N.ar 1 UNL1111111111 -0.4920 2 C 0.2580 -0.4986 -0.1804 C.ar 1 UNL1111111111 0.5166 3 N 1.6036 -0.7794 -0.3152 N.ar 1 UNL1111111111 -0.5507 4 C 0.6428 1.7399 0.2831 C.ar 1 UNL1111111111 0.1366 5 C 2.0231 1.5594 0.1618 C.ar 1 UNL1111111111 -0.2389 6 C 2.4548 0.2440 -0.1408 C.ar 1 UNL1111111111 0.2968 7 C 4.3773 2.2772 0.8175 C.3 1 UNL1111111111 -0.2592 8 C 2.9906 2.6919 0.2793 C.3 1 UNL1111111111 -0.2344 9 C 4.8040 1.0018 0.2223 C.ar 1 UNL1111111111 0.0148 10 C 3.8786 0.0287 -0.2193 C.ar 1 UNL1111111111 -0.1001 11 N 4.6157 -1.0475 -0.6802 N.ar 1 UNL1111111111 0.0300 12 N 5.9254 -0.8257 -0.5681 N.ar 1 UNL1111111111 -0.2385 13 C 6.0750 0.4296 -0.0139 C.ar 1 UNL1111111111 -0.1258 14 C 7.3757 1.0550 0.2633 C.2 1 UNL1111111111 0.6265 15 N 8.5052 0.3079 0.0038 N.am 1 UNL1111111111 -0.6715 16 O 7.4781 2.1847 0.7057 O.2 1 UNL1111111111 -0.5355 17 C 4.1043 -2.2957 -1.2167 C.3 1 UNL1111111111 -0.2354 18 N -0.5580 -1.5881 -0.3860 N.pl3 1 UNL1111111111 -0.4457 19 C -1.9445 -1.6591 -0.1463 C.ar 1 UNL1111111111 0.2039 20 C -2.8154 -0.5782 -0.1863 C.ar 1 UNL1111111111 -0.2825 21 C -4.2019 -0.7745 -0.0054 C.ar 1 UNL1111111111 0.2424 22 C -4.7002 -2.0709 0.2061 C.ar 1 UNL1111111111 -0.2972 23 C -3.8274 -3.1543 0.2669 C.ar 1 UNL1111111111 -0.1045 24 C -2.4684 -2.9537 0.0951 C.ar 1 UNL1111111111 0.0351 25 O -1.6067 -4.0279 0.0530 O.3 1 UNL1111111111 -0.3442 26 C -1.1422 -4.3990 1.3499 C.3 1 UNL1111111111 -0.2011 27 N -5.0194 0.3738 0.0571 N.pl3 1 UNL1111111111 -0.4171 28 C -6.4443 0.1740 0.3909 C.3 1 UNL1111111111 -0.1023 29 C -7.0604 1.5399 0.7845 C.3 1 UNL1111111111 -0.1318 30 N -6.9229 2.4777 -0.3560 N.3 1 UNL1111111111 -0.4001 31 C -5.4845 2.6859 -0.6525 C.3 1 UNL1111111111 -0.1332 32 C -4.8694 1.3284 -1.0655 C.3 1 UNL1111111111 -0.0887 33 C -7.5871 3.7631 -0.0549 C.3 1 UNL1111111111 -0.2843 34 H 0.1988 2.7159 0.5217 H 1 UNL1111111111 0.1792 35 H 5.1278 3.0794 0.6232 H 1 UNL1111111111 0.1890 36 H 4.3488 2.1807 1.9273 H 1 UNL1111111111 0.1705 37 H 3.1209 3.1514 -0.7279 H 1 UNL1111111111 0.1581 38 H 2.5803 3.4953 0.9247 H 1 UNL1111111111 0.1524 39 H 8.4519 -0.6167 -0.3681 H 1 UNL1111111111 0.3156 40 H 9.4106 0.6933 0.1735 H 1 UNL1111111111 0.3116 41 H 3.3679 -2.0902 -2.0211 H 1 UNL1111111111 0.1793 42 H 4.9202 -2.9227 -1.6218 H 1 UNL1111111111 0.1747 43 H 3.5747 -2.8606 -0.4211 H 1 UNL1111111111 0.1786 44 H -0.0880 -2.4903 -0.5379 H 1 UNL1111111111 0.3460 45 H -2.4286 0.4356 -0.3234 H 1 UNL1111111111 0.2105 46 H -5.7642 -2.2508 0.3138 H 1 UNL1111111111 0.1596 47 H -4.2058 -4.1612 0.4390 H 1 UNL1111111111 0.1610 48 H -0.4949 -5.2580 1.1393 H 1 UNL1111111111 0.1437 49 H -0.5751 -3.5825 1.8072 H 1 UNL1111111111 0.1328 50 H -1.9787 -4.6932 1.9901 H 1 UNL1111111111 0.1305 51 H -7.0158 -0.2649 -0.4563 H 1 UNL1111111111 0.1362 52 H -6.5251 -0.5139 1.2613 H 1 UNL1111111111 0.1437 53 H -8.1406 1.4035 1.0013 H 1 UNL1111111111 0.1376 54 H -6.5762 1.9138 1.7125 H 1 UNL1111111111 0.1290 55 H -5.3968 3.4012 -1.4969 H 1 UNL1111111111 0.1377 56 H -4.9203 3.1079 0.2068 H 1 UNL1111111111 0.1311 57 H -3.7930 1.4708 -1.3043 H 1 UNL1111111111 0.1528 58 H -5.3712 0.9526 -1.9854 H 1 UNL1111111111 0.1368 59 H -7.1807 4.2964 0.8169 H 1 UNL1111111111 0.1204 60 H -7.5087 4.4216 -0.9359 H 1 UNL1111111111 0.1469 61 H -8.6613 3.5798 0.1155 H 1 UNL1111111111 0.1468 @BOND 1 1 2 ar 2 1 4 ar 3 2 3 ar 4 2 18 1 5 3 6 ar 6 4 5 ar 7 4 34 1 8 5 6 ar 9 5 8 1 10 6 10 1 11 7 8 1 12 7 9 1 13 7 35 1 14 7 36 1 15 8 37 1 16 8 38 1 17 9 10 ar 18 9 13 ar 19 10 11 ar 20 11 12 ar 21 11 17 1 22 12 13 ar 23 13 14 1 24 14 15 am 25 14 16 2 26 15 39 1 27 15 40 1 28 17 41 1 29 17 42 1 30 17 43 1 31 18 19 1 32 18 44 1 33 19 20 ar 34 19 24 ar 35 20 21 ar 36 20 45 1 37 21 22 ar 38 21 27 1 39 22 23 ar 40 22 46 1 41 23 24 ar 42 23 47 1 43 24 25 1 44 25 26 1 45 26 48 1 46 26 49 1 47 26 50 1 48 27 28 1 49 27 32 1 50 28 29 1 51 28 51 1 52 28 52 1 53 29 30 1 54 29 53 1 55 29 54 1 56 30 31 1 57 30 33 1 58 31 32 1 59 31 55 1 60 31 56 1 61 32 57 1 62 32 58 1 63 33 59 1 64 33 60 1 65 33 61 1