HMDB0247641 RDKit 3D 2-(3-(4-((1H-Indazol-5-yl)amino)quinazolin-2-yl)phenoxy)-N-isopropylacetamide 58 62 0 0 0 0 0 0 0 0999 V2000 6.2890 0.1227 -0.6681 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8868 -1.2814 -1.0648 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7449 -1.2938 -2.5794 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6108 -1.6204 -0.4648 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4017 -2.7318 0.3561 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4303 -3.4720 0.5606 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1733 -3.1653 1.0103 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0626 -2.3550 0.8889 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9001 -1.0578 1.3175 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9366 -0.4257 1.9659 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7716 0.8733 2.3943 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5847 1.5343 2.1779 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5211 0.9167 1.5244 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7368 1.6427 1.3022 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7864 1.0958 0.6969 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9671 1.7147 0.4596 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0259 1.0855 -0.2085 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0224 -0.2765 -0.6645 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1740 -1.2417 -0.1926 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1941 -2.5546 -0.6912 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0716 -2.9269 -1.6784 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3026 -4.0906 -2.3270 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2872 -3.8724 -3.2024 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6847 -2.5934 -3.1215 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9289 -1.9614 -2.1578 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9127 -0.6720 -1.6721 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1236 3.0430 0.8764 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2928 3.7328 0.6705 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3599 5.0545 1.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2847 5.6396 1.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1235 4.9222 1.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0305 3.6051 1.5043 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8822 2.9143 1.7030 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7099 -0.3753 1.1079 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4001 0.1940 -0.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8684 0.8175 -1.4037 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8809 0.3894 0.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6543 -2.0276 -0.7754 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7340 -0.9143 -2.8249 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8911 -2.3227 -2.9699 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -0.6606 -3.0422 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8223 -0.9794 -0.6859 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3974 -3.4424 2.0723 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9012 -4.1605 0.5437 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8961 -0.9317 2.1519 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6162 1.3544 2.9098 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4351 2.5522 2.5057 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9120 1.5979 -0.4175 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4755 -1.0304 0.5848 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5140 -3.3023 -0.3046 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8117 -5.0035 -2.1838 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4647 -2.1581 -3.7195 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5822 0.0908 -2.0445 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1459 3.2919 0.1818 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2588 5.5996 0.9678 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3072 6.6615 2.1098 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2592 5.3348 2.4278 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1056 -0.8796 0.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 2 0 5 7 1 0 7 8 1 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 21 22 1 0 22 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 16 27 2 0 27 28 1 0 28 29 2 0 29 30 1 0 30 31 2 0 31 32 1 0 32 33 2 0 13 34 2 0 34 9 1 0 33 14 1 0 26 18 1 0 32 27 1 0 25 21 1 0 1 35 1 0 1 36 1 0 1 37 1 0 2 38 1 0 3 39 1 0 3 40 1 0 3 41 1 0 4 42 1 0 7 43 1 0 7 44 1 0 10 45 1 0 11 46 1 0 12 47 1 0 17 48 1 0 19 49 1 0 20 50 1 0 22 51 1 0 24 52 1 0 26 53 1 0 28 54 1 0 29 55 1 0 30 56 1 0 31 57 1 0 34 58 1 0 M END