@MOLECULE 1-(2-(4-benzyl-4-hydroxypiperidin-1-yl)ethyl)-3-(2-methylquinolin-4-yl)urea 61 64 0 0 0 SMALL GASTEIGER @ATOM 1 O -4.7484 0.0455 1.9099 O.3 1 UNL1111111111 -0.5709 2 O 1.7981 0.4999 -0.5658 O.2 1 UNL1111111111 -0.5163 3 N -2.0453 -1.4707 0.3589 N.3 1 UNL1111111111 -0.4319 4 N 1.5058 -1.7580 -0.7876 N.am 1 UNL1111111111 -0.6146 5 N 3.6390 -0.8887 -0.3268 N.am 1 UNL1111111111 -0.5899 6 N 6.5556 2.0554 0.4957 N.ar 1 UNL1111111111 -0.4545 7 C -4.8508 -0.8711 0.8348 C.3 1 UNL1111111111 0.3323 8 C -4.2150 -2.2159 1.2360 C.3 1 UNL1111111111 -0.3505 9 C -4.0640 -0.2203 -0.3091 C.3 1 UNL1111111111 -0.3082 10 C -2.7235 -2.0190 1.5601 C.3 1 UNL1111111111 -0.0957 11 C -2.5739 -0.1159 0.0514 C.3 1 UNL1111111111 -0.0982 12 C -6.3461 -1.0764 0.4913 C.3 1 UNL1111111111 -0.3679 13 C -0.5766 -1.4350 0.5400 C.3 1 UNL1111111111 -0.1580 14 C -6.9519 0.1273 -0.1604 C.ar 1 UNL1111111111 0.0262 15 C 0.0509 -1.5866 -0.8717 C.3 1 UNL1111111111 -0.0558 16 C -7.4602 0.0373 -1.4581 C.ar 1 UNL1111111111 -0.1837 17 C -7.0183 1.3434 0.5247 C.ar 1 UNL1111111111 -0.1615 18 C -8.0304 1.1550 -2.0644 C.ar 1 UNL1111111111 -0.1405 19 C -7.5871 2.4584 -0.0842 C.ar 1 UNL1111111111 -0.1397 20 C -8.0953 2.3663 -1.3794 C.ar 1 UNL1111111111 -0.1647 21 C 2.2676 -0.6164 -0.5473 C.2 1 UNL1111111111 0.7197 22 C 4.5898 0.1136 -0.0749 C.ar 1 UNL1111111111 0.2870 23 C 5.9850 -0.2156 -0.2348 C.ar 1 UNL1111111111 -0.1806 24 C 4.2418 1.3752 0.3605 C.ar 1 UNL1111111111 -0.3568 25 C 6.9250 0.8018 0.0714 C.ar 1 UNL1111111111 0.2077 26 C 5.2650 2.3270 0.6317 C.ar 1 UNL1111111111 0.2886 27 C 6.4744 -1.4692 -0.6808 C.ar 1 UNL1111111111 -0.1187 28 C 8.3234 0.5482 -0.0596 C.ar 1 UNL1111111111 -0.1591 29 C 7.8224 -1.6954 -0.8025 C.ar 1 UNL1111111111 -0.1688 30 C 8.7569 -0.6782 -0.4869 C.ar 1 UNL1111111111 -0.1208 31 C 4.8907 3.6976 1.0910 C.3 1 UNL1111111111 -0.4516 32 H -4.3138 -2.9359 0.4001 H 1 UNL1111111111 0.1625 33 H -4.7341 -2.6600 2.1004 H 1 UNL1111111111 0.1362 34 H -4.4648 0.7921 -0.5164 H 1 UNL1111111111 0.1638 35 H -4.1962 -0.8126 -1.2334 H 1 UNL1111111111 0.1566 36 H -2.6140 -1.3602 2.4493 H 1 UNL1111111111 0.1252 37 H -2.2664 -2.9997 1.8104 H 1 UNL1111111111 0.1279 38 H -2.0088 0.2972 -0.8119 H 1 UNL1111111111 0.1398 39 H -2.4456 0.5936 0.8998 H 1 UNL1111111111 0.1349 40 H -6.9068 -1.3181 1.4176 H 1 UNL1111111111 0.1581 41 H -6.4513 -1.9702 -0.1557 H 1 UNL1111111111 0.1574 42 H -0.2097 -0.5011 1.0187 H 1 UNL1111111111 0.1433 43 H -0.2467 -2.2736 1.1859 H 1 UNL1111111111 0.1329 44 H -5.1226 -0.3227 2.7296 H 1 UNL1111111111 0.3112 45 H -0.1812 -0.6905 -1.4944 H 1 UNL1111111111 0.1689 46 H -0.3859 -2.4661 -1.3950 H 1 UNL1111111111 0.1549 47 H -7.4117 -0.9036 -2.0006 H 1 UNL1111111111 0.1484 48 H -6.6051 1.4213 1.5308 H 1 UNL1111111111 0.1682 49 H 1.8441 -2.6767 -0.5620 H 1 UNL1111111111 0.3057 50 H -8.4248 1.0805 -3.0754 H 1 UNL1111111111 0.1453 51 H -7.6323 3.4042 0.4519 H 1 UNL1111111111 0.1483 52 H -8.5393 3.2380 -1.8537 H 1 UNL1111111111 0.1475 53 H 3.9967 -1.8072 -0.5706 H 1 UNL1111111111 0.3137 54 H 3.2026 1.6768 0.4977 H 1 UNL1111111111 0.2132 55 H 5.7763 -2.2644 -0.9354 H 1 UNL1111111111 0.1366 56 H 9.0135 1.3561 0.1882 H 1 UNL1111111111 0.1774 57 H 8.1945 -2.6585 -1.1452 H 1 UNL1111111111 0.1529 58 H 9.8206 -0.8883 -0.5922 H 1 UNL1111111111 0.1539 59 H 4.3339 3.6602 2.0385 H 1 UNL1111111111 0.1659 60 H 5.7774 4.3326 1.2535 H 1 UNL1111111111 0.1774 61 H 4.2551 4.2029 0.3484 H 1 UNL1111111111 0.1693 @BOND 1 1 7 1 2 1 44 1 3 2 21 2 4 3 10 1 5 3 11 1 6 3 13 1 7 4 15 1 8 4 21 am 9 4 49 1 10 5 21 am 11 5 22 1 12 5 53 1 13 6 25 ar 14 6 26 ar 15 7 8 1 16 7 9 1 17 7 12 1 18 8 10 1 19 8 32 1 20 8 33 1 21 9 11 1 22 9 34 1 23 9 35 1 24 10 36 1 25 10 37 1 26 11 38 1 27 11 39 1 28 12 14 1 29 12 40 1 30 12 41 1 31 13 15 1 32 13 42 1 33 13 43 1 34 14 16 ar 35 14 17 ar 36 15 45 1 37 15 46 1 38 16 18 ar 39 16 47 1 40 17 19 ar 41 17 48 1 42 18 20 ar 43 18 50 1 44 19 20 ar 45 19 51 1 46 20 52 1 47 22 23 ar 48 22 24 ar 49 23 25 ar 50 23 27 ar 51 24 26 ar 52 24 54 1 53 25 28 ar 54 26 31 1 55 27 29 ar 56 27 55 1 57 28 30 ar 58 28 56 1 59 29 30 ar 60 29 57 1 61 30 58 1 62 31 59 1 63 31 60 1 64 31 61 1