@MOLECULE (2R)-2-[3-[(2,6-dimethylphenyl)sulfanylmethyl]-4-methoxy-phenyl]-3-(2-furylmethyl)-1,2-dihydroquinazolin-4-one 63 67 0 0 0 SMALL GASTEIGER @ATOM 1 S 0.3251 2.9568 -0.7712 S.3 1 UNL1111111111 0.0202 2 O 0.4241 -3.0709 -1.6340 O.2 1 UNL1111111111 -0.5421 3 O -3.6489 -1.2916 -0.9717 O.2 1 UNL1111111111 -0.2092 4 O -2.7977 3.1813 1.1368 O.3 1 UNL1111111111 -0.3058 5 N -0.8815 -2.8118 0.1866 N.am 1 UNL1111111111 -0.5328 6 N 0.1078 -2.2979 2.3428 N.pl3 1 UNL1111111111 -0.5467 7 C -1.1063 -2.1945 1.5022 C.3 1 UNL1111111111 0.2966 8 C -1.5690 -0.7485 1.3947 C.ar 1 UNL1111111111 -0.1899 9 C -2.0727 -3.0906 -0.6275 C.3 1 UNL1111111111 -0.0529 10 C 1.3584 -2.1592 1.7468 C.ar 1 UNL1111111111 0.2851 11 C 0.3563 -2.7714 -0.4567 C.2 1 UNL1111111111 0.6240 12 C 1.5180 -2.4364 0.3763 C.ar 1 UNL1111111111 -0.2718 13 C -0.6619 0.2945 1.1963 C.ar 1 UNL1111111111 -0.0960 14 C -2.9298 -0.4764 1.5087 C.ar 1 UNL1111111111 -0.0607 15 C -1.0960 1.6130 1.1350 C.ar 1 UNL1111111111 -0.0804 16 C -2.5012 -1.9232 -1.4317 C.ar 1 UNL1111111111 0.0635 17 C 2.4814 -1.8144 2.5244 C.ar 1 UNL1111111111 -0.3099 18 C 2.7893 -2.4132 -0.1975 C.ar 1 UNL1111111111 0.0044 19 C -2.4820 1.8637 1.2271 C.ar 1 UNL1111111111 0.2501 20 C -3.3986 0.8324 1.4200 C.ar 1 UNL1111111111 -0.3003 21 C -0.1342 2.7324 0.9982 C.3 1 UNL1111111111 -0.3147 22 C 3.7337 -1.7777 1.9284 C.ar 1 UNL1111111111 -0.0235 23 C 3.8971 -2.0841 0.5742 C.ar 1 UNL1111111111 -0.2574 24 C -2.0220 -1.2875 -2.5436 C.ar 1 UNL1111111111 -0.2022 25 C -2.9080 -0.1782 -2.7931 C.ar 1 UNL1111111111 -0.2274 26 C 1.8974 2.1338 -0.8692 C.ar 1 UNL1111111111 -0.1875 27 C -3.8709 -0.2286 -1.8233 C.ar 1 UNL1111111111 -0.0153 28 C 1.9886 0.9319 -1.5803 C.ar 1 UNL1111111111 0.1117 29 C 3.0415 2.7156 -0.3100 C.ar 1 UNL1111111111 0.0884 30 C -4.1771 3.5182 1.0941 C.3 1 UNL1111111111 -0.2017 31 C 3.2419 0.3338 -1.7554 C.ar 1 UNL1111111111 -0.2221 32 C 4.2790 2.0846 -0.4649 C.ar 1 UNL1111111111 -0.2371 33 C 0.8008 0.2552 -2.1674 C.3 1 UNL1111111111 -0.4730 34 C 3.0004 4.0005 0.4483 C.3 1 UNL1111111111 -0.4594 35 C 4.3783 0.9032 -1.1935 C.ar 1 UNL1111111111 -0.0940 36 H -1.8973 -2.8151 2.0318 H 1 UNL1111111111 0.1552 37 H -0.0104 -1.8992 3.2695 H 1 UNL1111111111 0.3083 38 H -2.8967 -3.4529 0.0322 H 1 UNL1111111111 0.1535 39 H -1.8179 -3.9437 -1.3182 H 1 UNL1111111111 0.1885 40 H 0.4049 0.0799 1.0851 H 1 UNL1111111111 0.1707 41 H -3.6440 -1.2868 1.6583 H 1 UNL1111111111 0.1505 42 H 2.3671 -1.5839 3.5780 H 1 UNL1111111111 0.1605 43 H 2.8963 -2.6575 -1.2591 H 1 UNL1111111111 0.1696 44 H -4.4615 1.0288 1.5025 H 1 UNL1111111111 0.1626 45 H -0.5629 3.6976 1.3423 H 1 UNL1111111111 0.1800 46 H 0.7711 2.5640 1.6136 H 1 UNL1111111111 0.1664 47 H 4.6051 -1.5025 2.5236 H 1 UNL1111111111 0.1437 48 H 4.8857 -2.0550 0.1267 H 1 UNL1111111111 0.1568 49 H -1.1590 -1.5500 -3.1252 H 1 UNL1111111111 0.1881 50 H -2.7985 0.5315 -3.5852 H 1 UNL1111111111 0.1713 51 H -4.7302 0.3424 -1.5698 H 1 UNL1111111111 0.1614 52 H -4.1419 4.6079 0.9559 H 1 UNL1111111111 0.1536 53 H -4.6698 3.2666 2.0375 H 1 UNL1111111111 0.1315 54 H -4.6710 3.0422 0.2415 H 1 UNL1111111111 0.1366 55 H 3.3242 -0.5853 -2.3322 H 1 UNL1111111111 0.1607 56 H 5.1702 2.5212 -0.0233 H 1 UNL1111111111 0.1503 57 H 1.0230 -0.7669 -2.5152 H 1 UNL1111111111 0.1716 58 H 0.3986 0.8101 -3.0288 H 1 UNL1111111111 0.1737 59 H -0.0279 0.1538 -1.4463 H 1 UNL1111111111 0.1770 60 H 4.0031 4.3709 0.7005 H 1 UNL1111111111 0.1502 61 H 2.4549 3.9001 1.3973 H 1 UNL1111111111 0.1597 62 H 2.5104 4.8009 -0.1293 H 1 UNL1111111111 0.1743 63 H 5.3481 0.4258 -1.3224 H 1 UNL1111111111 0.1434 @BOND 1 1 21 1 2 1 26 1 3 2 11 2 4 3 16 ar 5 3 27 ar 6 4 19 1 7 4 30 1 8 5 7 1 9 5 9 1 10 5 11 am 11 6 7 1 12 6 10 1 13 6 37 1 14 7 8 1 15 7 36 1 16 8 13 ar 17 8 14 ar 18 9 16 1 19 9 38 1 20 9 39 1 21 10 12 ar 22 10 17 ar 23 11 12 1 24 12 18 ar 25 13 15 ar 26 13 40 1 27 14 20 ar 28 14 41 1 29 15 19 ar 30 15 21 1 31 16 24 ar 32 17 22 ar 33 17 42 1 34 18 23 ar 35 18 43 1 36 19 20 ar 37 20 44 1 38 21 45 1 39 21 46 1 40 22 23 ar 41 22 47 1 42 23 48 1 43 24 25 ar 44 24 49 1 45 25 27 ar 46 25 50 1 47 26 28 ar 48 26 29 ar 49 27 51 1 50 28 31 ar 51 28 33 1 52 29 32 ar 53 29 34 1 54 30 52 1 55 30 53 1 56 30 54 1 57 31 35 ar 58 31 55 1 59 32 35 ar 60 32 56 1 61 33 57 1 62 33 58 1 63 33 59 1 64 34 60 1 65 34 61 1 66 34 62 1 67 35 63 1