HMDB0256648 RDKit 3D N-(3-(5-Chloro-1H-pyrrolo[2,3-b]pyridine-3-carbonyl)-2,4-difluorophenyl)propa... 41 43 0 0 0 0 0 0 0 0999 V2000 6.3764 -0.8277 -0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4466 0.3230 -0.2223 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9057 0.1875 1.1714 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8064 1.5332 1.4858 S 0 0 0 0 0 6 0 0 0 0 0 0 3.2761 1.3136 2.9013 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5472 2.8435 1.5630 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4658 1.6277 0.4242 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4831 0.6192 0.3079 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7566 -0.6779 -0.0275 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7192 -1.6169 -0.1431 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5969 -1.2884 0.0697 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5625 -2.2323 -0.0540 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.8824 0.0197 0.4083 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2769 0.3477 0.6328 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6913 0.7940 1.7262 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2280 0.1521 -0.4453 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9198 0.0791 -1.7805 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0688 -0.1032 -2.4531 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0975 -0.1468 -1.5671 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4322 -0.3101 -1.7214 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3072 -0.3290 -0.7206 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8164 -0.1700 0.5717 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9453 -0.1929 1.8866 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -5.4698 -0.0005 0.7871 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6059 0.0106 -0.2926 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1307 0.9325 0.5203 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1358 2.2126 0.8506 F 0 0 0 0 0 0 0 0 0 0 0 0 7.4150 -0.4807 -0.4245 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1738 -1.1564 -1.5552 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1287 -1.6756 0.1885 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6052 0.3374 -0.9367 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9742 1.3073 -0.2863 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7685 0.2986 1.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4504 -0.7860 1.3294 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3871 2.5170 -0.1809 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7786 -0.9954 -0.2223 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9719 -2.6420 -0.4114 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9296 0.1556 -2.2025 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1567 -0.1961 -3.4841 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3868 -0.4652 -0.8932 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0572 0.1267 1.7948 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 2 0 4 6 2 0 4 7 1 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 11 13 1 0 13 14 1 0 14 15 2 0 14 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 13 26 2 0 26 27 1 0 26 8 1 0 25 16 1 0 25 19 1 0 1 28 1 0 1 29 1 0 1 30 1 0 2 31 1 0 2 32 1 0 3 33 1 0 3 34 1 0 7 35 1 0 9 36 1 0 10 37 1 0 17 38 1 0 18 39 1 0 21 40 1 0 24 41 1 0 M END