HMDB0249310 RDKit 3D 5-Fluoro-3-[3-[4-(5-methoxypyrimidin-4-yl)piperazin-1-yl]propyl]-1H-indole 51 54 0 0 0 0 0 0 0 0999 V2000 5.8197 -1.7662 -2.2764 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9701 -1.1254 -1.3584 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4279 -0.7468 -0.1213 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7590 -0.9926 0.2585 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1668 -0.6016 1.4770 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3374 0.0127 2.3344 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0721 0.2379 1.9571 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5782 -0.1215 0.7524 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2149 0.0933 0.3916 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5090 1.0145 1.2387 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1045 1.3335 0.8349 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6673 0.6765 -0.3283 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5128 1.1337 -0.9013 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8025 0.8905 -0.1464 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9671 1.4452 -0.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2773 1.2533 -0.3338 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0528 2.2447 0.2902 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1834 1.6817 0.7400 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2100 0.3706 0.4533 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1462 -0.6194 0.7074 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9205 -1.9116 0.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7494 -2.1940 -0.3692 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4956 -3.4582 -0.8006 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.8099 -1.1891 -0.6213 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0294 0.0998 -0.2132 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1049 -0.6447 -0.5185 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6327 -0.5866 -0.7165 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5771 -1.1039 -2.7387 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4012 -2.6017 -1.7931 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2131 -2.2939 -3.0729 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4134 -1.4861 -0.4478 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7082 0.3117 3.2983 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5060 0.5953 2.2628 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1514 1.9392 1.2888 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3851 1.1767 1.6927 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0557 2.4500 0.6608 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6920 0.7797 -1.9563 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4421 2.2559 -1.0334 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0319 -0.1503 0.0405 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8156 1.4402 0.8165 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7660 2.5174 -1.1741 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0057 0.8984 -1.9674 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7476 3.2866 0.3703 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9890 2.1429 1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0631 -0.4034 1.2289 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6020 -2.7179 0.4604 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8911 -1.4035 -1.1394 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6750 -1.0346 -1.4765 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9550 -1.3385 0.3119 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8952 -0.1158 -1.6632 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9022 -1.6746 -0.7533 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 22 23 1 0 22 24 1 0 24 25 2 0 12 26 1 0 26 27 1 0 8 3 1 0 27 9 1 0 25 16 1 0 25 19 1 0 1 28 1 0 1 29 1 0 1 30 1 0 4 31 1 0 6 32 1 0 10 33 1 0 10 34 1 0 11 35 1 0 11 36 1 0 13 37 1 0 13 38 1 0 14 39 1 0 14 40 1 0 15 41 1 0 15 42 1 0 17 43 1 0 18 44 1 0 20 45 1 0 21 46 1 0 24 47 1 0 26 48 1 0 26 49 1 0 27 50 1 0 27 51 1 0 M END