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C 0 0 0 0 0 0 0 0 0 0 0 0 8.6279 0.3531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9758 1.4409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1279 -0.5129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.0129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.0129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8893 1.0342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8712 2.4354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1279 -0.5129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5443 0.2918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.4871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8550 -2.2682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.0129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.5129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6803 3.0232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.0129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6983 1.6219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.4871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5938 2.6165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.4871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1871 -3.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9074 -0.3671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6622 4.4245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1139 -2.5692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9797 -3.1406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3039 -3.8688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0398 -1.4796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2471 -1.3962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9388 -4.3300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7314 -4.4133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9988 -2.6689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6746 -1.9408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4483 -4.0941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9168 -3.4493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2753 -1.5583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5994 -2.2864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5717 -0.9056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2476 -0.1774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3179 0.8900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3048 2.6876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7369 0.8811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2375 -2.7561 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4019 -1.9762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.1329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -1.3229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2647 1.3698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3520 1.4871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.1071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 1.4871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 1.0240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.7971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -0.0499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6552 -0.9335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4738 -0.6193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1596 0.1993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9144 4.9909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0958 4.6766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4100 3.8581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0837 -4.4245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 38 1 0 0 0 0 2 19 1 0 0 0 0 2 21 1 0 0 0 0 3 26 1 0 0 0 0 3 41 1 0 0 0 0 4 28 2 0 0 0 0 5 34 1 0 0 0 0 5 42 1 0 0 0 0 6 40 1 0 0 0 0 6 78 1 0 0 0 0 7 40 2 0 0 0 0 8 20 1 0 0 0 0 8 21 2 0 0 0 0 9 21 1 0 0 0 0 9 28 1 0 0 0 0 9 58 1 0 0 0 0 10 23 1 0 0 0 0 10 24 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 17 1 0 0 0 0 11 43 1 0 0 0 0 12 14 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 15 1 0 0 0 0 13 46 1 0 0 0 0 13 47 1 0 0 0 0 14 16 1 0 0 0 0 14 48 1 0 0 0 0 14 49 1 0 0 0 0 15 16 1 0 0 0 0 15 50 1 0 0 0 0 15 51 1 0 0 0 0 16 52 1 0 0 0 0 16 53 1 0 0 0 0 17 18 1 0 0 0 0 17 54 1 0 0 0 0 17 55 1 0 0 0 0 18 19 1 0 0 0 0 18 56 1 0 0 0 0 18 57 1 0 0 0 0 19 20 2 0 0 0 0 20 22 1 0 0 0 0 22 26 1 0 0 0 0 22 27 2 0 0 0 0 23 28 1 0 0 0 0 23 29 2 0 0 0 0 24 25 2 0 0 0 0 24 33 1 0 0 0 0 25 29 1 0 0 0 0 25 30 1 0 0 0 0 26 36 2 0 0 0 0 27 34 1 0 0 0 0 27 59 1 0 0 0 0 29 60 1 0 0 0 0 30 32 2 0 0 0 0 30 37 1 0 0 0 0 31 40 1 0 0 0 0 31 61 1 0 0 0 0 31 62 1 0 0 0 0 32 35 1 0 0 0 0 32 39 1 0 0 0 0 33 35 2 0 0 0 0 33 63 1 0 0 0 0 34 38 2 0 0 0 0 35 64 1 0 0 0 0 36 38 1 0 0 0 0 36 65 1 0 0 0 0 37 66 1 0 0 0 0 37 67 1 0 0 0 0 37 68 1 0 0 0 0 39 69 1 0 0 0 0 39 70 1 0 0 0 0 39 71 1 0 0 0 0 41 72 1 0 0 0 0 41 73 1 0 0 0 0 41 74 1 0 0 0 0 42 75 1 0 0 0 0 42 76 1 0 0 0 0 42 77 1 0 0 0 0 M END > 9938798 > 1 > 925 > 7 > 2 > 10 > AAADcfB/OABEAAAAAAAAAAAAAAAAAWLAAAAwYMAAAAAAAFgB/AAAHgYQCAAADQ7B3iYz3/PMFgisAyXyfACC+KlnL3kJ2DW+b9iOZvPlv7uUMShuwRPY6af4yfCejQADQQAaCAAaAAaCADQQAAAAAAAAAA== > 2-[2-[[4-(4-chloro-2,5-dimethoxy-phenyl)-5-(2-cyclohexylethyl)thiazol-2-yl]carbamoyl]-4,5-dimethyl-indol-1-yl]acetic acid > 2-[2-[[[4-(4-chloro-2,5-dimethoxyphenyl)-5-(2-cyclohexylethyl)-2-thiazolyl]amino]-oxomethyl]-4,5-dimethyl-1-indolyl]acetic acid > 2-[2-[[4-(4-chloro-2,5-dimethoxyphenyl)-5-(2-cyclohexylethyl)-1,3-thiazol-2-yl]carbamoyl]-4,5-dimethylindol-1-yl]acetic acid > 2-[2-[[4-(4-chloro-2,5-dimethoxyphenyl)-5-(2-cyclohexylethyl)-1,3-thiazol-2-yl]carbamoyl]-4,5-dimethylindol-1-yl]acetic acid > 2-[2-[[4-(4-chloranyl-2,5-dimethoxy-phenyl)-5-(2-cyclohexylethyl)-1,3-thiazol-2-yl]carbamoyl]-4,5-dimethyl-indol-1-yl]ethanoic acid > 2-[2-[[4-(4-chloro-2,5-dimethoxy-phenyl)-5-(2-cyclohexylethyl)thiazol-2-yl]carbamoyl]-4,5-dimethyl-indol-1-yl]acetic acid > InChI=1S/C32H36ClN3O5S/c1-18-10-12-24-21(19(18)2)14-25(36(24)17-29(37)38)31(39)35-32-34-30(22-15-27(41-4)23(33)16-26(22)40-3)28(42-32)13-11-20-8-6-5-7-9-20/h10,12,14-16,20H,5-9,11,13,17H2,1-4H3,(H,37,38)(H,34,35,39) > AGOJEFQTAMTJHV-UHFFFAOYSA-N > 8.6 > 609.2064201 > C32H36ClN3O5S > 610.2 > CC1=C(C2=C(C=C1)N(C(=C2)C(=O)NC3=NC(=C(S3)CCC4CCCCC4)C5=CC(=C(C=C5OC)Cl)OC)CC(=O)O)C > CC1=C(C2=C(C=C1)N(C(=C2)C(=O)NC3=NC(=C(S3)CCC4CCCCC4)C5=CC(=C(C=C5OC)Cl)OC)CC(=O)O)C > 131 > 609.2064201 > 0 > 42 > 0 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 10 23 8 10 24 8 19 20 8 2 19 8 2 21 8 22 26 8 22 27 8 23 29 8 24 25 8 24 33 8 25 29 8 25 30 8 26 36 8 27 34 8 30 32 8 32 35 8 33 35 8 34 38 8 36 38 8 8 20 8 8 21 8 $$$$