0 B14R1.27331 CC(N)c1c(O)c(Br)c(C)c(Br)c1C Amb25062466 [0,0,0,0,0,0|3,0,1]=4 1 B14R1.27331 CC(O)C=1C(=O)C(C)=C(C)C(=O)C1C Amb25235671 [0,0,0,0,0,0|3,0,0]=3 2 B14R1.27331 CC=1C(=O)C(Br)=C(C(C)C)C(=O)C1Br Amb22264943 [0,0,0,0,0,0|0,0,0]=0 3 B14R1.27331 CC=1C(=O)C(C(C)C)=C(Br)C(=O)C1C Amb25206843 [0,0,0,0,0,0|1,0,0]=1 4 B14R1.27331 CC=1C(=O)C(N)=C(C(C)C)C(=O)C1O Amb25858077 [0,0,0,0,0,0|2,0,0]=2 5 B13R1.2811 CC(=O)C1=CC(=O)C(C)=C(C)C1=O Amb25322889 [1,0,0,0,0,0|2,0,1]=4 6 B13R1.2811 CC(C)C1=CC(=O)[C@H](C)[C@@H](O)C1=O Amb24735075 [1,0,0,0,0,0|1,0,2]=4 7 B13R1.2811 CC(C)c1cc(C)c(C)c(C)c1O Amb25319979 [1,0,0,0,0,0|2,0,1]=4 8 B13R1.2811 C[C@H](N)c1cc(Br)c(C)c(C)c1O Amb24394429 [1,0,0,0,0,0|3,0,0]=4 9 B13R1.2811 Cc1c(Br)cc(C(C)C)c(N)c1N Amb22755551 [1,0,0,0,0,0|2,0,0]=3 10 B13R1.2811 Cc1c(Br)cc(C(C)C)c(O)c1Br Amb25104246 [1,0,0,0,0,0|1,0,1]=3 11 B13R1.2811 Cc1c(Br)cc(C(C)N)c(O)c1Br Amb24490048 [1,0,0,0,0,0|2,0,1]=4 12 B13R1.2811 Cc1c(Br)cc([C@@H](C)N)c(O)c1Br Amb25751958 [1,0,0,0,0,0|2,0,1]=4 13 B13R1.2811 Cc1c(Cl)cc(C(C)C)c(N)c1N Amb22755499 [1,0,0,0,0,0|2,1,0]=4 14 B13R1.2811 Cc1c(Cl)cc(C(C)C)c(O)c1Cl Amb25761686 [1,0,0,0,0,0|1,1,1]=4 15 B13R1.2811 Cc1c(N)cc(C(C)C)c(Br)c1N Amb25107710 [1,0,0,0,0,0|2,0,0]=3 16 B13R1.2811 Cc1c(N)cc(C(C)C)c(O)c1Br Amb22011175 [1,0,0,0,0,0|1,0,1]=3 17 B13R1.2811 Cc1c(N)cc(C(C)C)c(O)c1Cl Amb22011173 [1,0,0,0,0,0|1,1,1]=4 18 B13R1.2811 Cc1c(O)cc(C(C)C)c(N)c1O Amb25258349 [1,0,0,0,0,0|2,0,1]=4 19 B13R1.2812 CC(c1c(Br)cc(c(c1Br)O)C)C Amb2432575 [1,0,0,0,0,0|1,0,1]=3 20 B13R1.2812 Cc1cc(C)c(Br)c(C)c1C(C)Br Amb25769527 [1,0,0,0,0,0|3,0,0]=4 21 B13R1.2812 Cc1cc(C)c(C(C)C)c(C)c1O Amb25807653 [1,0,0,0,0,0|2,0,1]=4 22 B13R1.2812 Cc1cc(C)c([C@@H](C)N)c(C)c1Br Amb25058104 [1,0,0,0,0,0|3,0,0]=4 23 B13R1.2812 Cc1cc(C)c([C@H](C)N)c(C)c1Br Amb25236224 [1,0,0,0,0,0|3,0,0]=4 24 B13R1.2812 Cc1cc(Cl)c(C(C)C)c(Cl)c1O Amb24090047 [1,0,0,0,0,0|1,1,1]=4 25 B13R1.2812 Cc1cc(N)c(C(C)C)c(Cl)c1O Amb24469996 [1,0,0,0,0,0|1,1,1]=4 26 B13R1.2812 Cc1cc(N)c(C(C)C)c(N)c1O Amb25667737 [1,0,0,0,0,0|2,0,1]=4 27 B13R1.2812 Cc1cc(O)c(C(C)C)c(C)c1Cl Amb25730263 [1,0,0,0,0,0|2,0,1]=4 28 B13R1.2812 Cc1cc(O)c(C(C)C)c(O)c1N Amb24650943 [1,0,0,0,0,0|2,0,1]=4 29 B13R1.2812 Cc1cc(O)c([C@@H](C)N)c(C)c1Br Amb24494316 [1,0,0,0,0,0|3,0,0]=4 30 B13R1.2812 Cc1cc(O)c([C@H](C)N)c(C)c1Br Amb25192713 [1,0,0,0,0,0|3,0,0]=4 31 B13R1.3251 CC1=C(CCl)C(=O)C(O)=C(C)C1=O Amb25858001 [1,0,0,0,0,0|3,0,0]=4 32 B13R1.3251 CC=1C(=O)C(C)=C(O)C(=O)C1CO Amb25700153 [1,0,0,0,0,0|3,0,0]=4 33 B13R1.3251 CC=1C(=O)C(CCl)=C(C)C(=O)C1C Amb25708435 [1,0,0,0,0,0|3,0,0]=4 34 B13R1.3251 CC=1C(=O)C(O)=C(OC)C(=O)C1O Amb25712136 [1,0,0,0,0,0|3,0,0]=4 35 B13R1.3251 CCC=1C(=O)C(C)=C(C)C(=O)C1C Amb24467105 [1,0,0,0,0,0|2,0,0]=3 36 B13R1.3251 CCc1c(Br)c(Br)c(Br)c(Br)c1Br Amb22336701 [1,0,0,0,0,0|3,0,0]=4 37 B13R1.3251 CNC=1C(=O)C(C)=C(C)C(=O)C1C Amb24488968 [1,0,0,0,0,0|3,0,0]=4 38 B13R1.3251 COC1=C(O)C(=O)C(C)=C(C)C1=O Amb25269822 [1,0,0,0,0,0|3,0,0]=4 39 B12R1.14 CC=1C(=O)C=C(CCl)C(=O)C1C Amb24365986 [2,0,0,0,0,0|2,0,0]=4 40 B12R1.14 CC=1C(=O)C=C(NC)C(=O)C1C Amb24680037 [2,0,0,0,0,0|2,0,0]=4 41 B12R1.14 CCC1=CC(=O)C(C)=C(C)C1=O Amb24449020 [2,0,0,0,0,0|1,0,0]=3 42 B12R1.232 CC(C)C1=CC(=O)C(O)=CC1=O Amb24450262 [2,0,0,0,0,0|1,0,0]=3 43 B12R1.232 CC(C)c1cc(Br)c(O)cc1O Amb25689591 [2,0,0,0,0,0|2,0,0]=4 44 B12R1.232 CC(c1cc(N)c(cc1O)C)C Amb1033073 [2,0,0,0,0,0|1,0,1]=4 45 B12R1.232 CC1=CC(=C)C(=CC1=O)C(C)C Amb24357155 [2,0,0,0,0,0|1,0,0]=3 46 B12R1.232 CC1=CC(=O)C(=CC1=O)C(C)=C Amb25318958 [2,0,0,0,0,0|0,0,2]=4 47 B12R1.232 CC1=CC(=O)C(=O)C=C1C(C)C Amb24706801 [2,0,0,0,0,0|2,0,0]=4 48 B12R1.232 Cc1cc(Br)c(cc1Br)C(C)Br Amb24375552 [2,0,0,0,0,0|1,0,0]=3 49 B12R1.232 Cc1cc(Br)c(cc1Br)C(C)Cl Amb25685731 [2,0,0,0,0,0|1,0,0]=3 50 B12R1.232 Cc1cc(Br)c(cc1Br)C(C)N Amb24724373 [2,0,0,0,0,0|1,0,0]=3 51 B12R1.232 Cc1cc(Br)c(cc1Br)[C@@H](C)N Amb25083214 [2,0,0,0,0,0|1,0,0]=3 52 B12R1.232 Cc1cc(Br)c(cc1Br)[C@@H](C)O Amb25156669 [2,0,0,0,0,0|1,0,0]=3 53 B12R1.232 Cc1cc(Br)c(cc1Br)[C@H](C)N Amb25270575 [2,0,0,0,0,0|1,0,0]=3 54 B12R1.232 Cc1cc(Br)c(cc1Cl)C(C)N Amb24401241 [2,0,0,0,0,0|1,1,0]=4 55 B12R1.232 Cc1cc(C(C)N)c(Br)cc1C Amb18943077 [2,0,0,0,0,0|2,0,0]=4 56 B12R1.232 Cc1cc(C)c(cc1N)C(C)C Amb24608884 [2,0,0,0,0,0|2,0,0]=4 57 B12R1.232 Cc1cc(C)c(cc1O)C(C)C Amb24646686 [2,0,0,0,0,0|1,0,1]=4 58 B12R1.232 Cc1cc(I)c(cc1O)C(C)C Amb25115506 [2,0,0,0,0,0|1,0,1]=4 59 B12R1.232 Cc1cc(N)c(cc1Br)C(C)C Amb25717627 [2,0,0,0,0,0|1,0,0]=3 60 B12R1.232 Cc1cc(N)c(cc1O)C(C)C Amb24091242 [2,0,0,0,0,0|1,0,1]=4 61 B12R1.232 Cc1cc(O)c(cc1Br)C(C)N Amb25327401 [2,0,0,0,0,0|2,0,0]=4 62 B12R1.232 Cc1cc(O)c(cc1Br)[C@@H](C)N Amb25141562 [2,0,0,0,0,0|2,0,0]=4 63 B12R1.232 Cc1cc(O)c(cc1I)C(C)C Amb25728492 [2,0,0,0,0,0|1,0,1]=4 64 B12R1.511 CC(C)c1cc(Br)cc(Br)c1Cl Amb19944069 [2,0,0,0,0,0|1,1,0]=4 65 B12R1.511 CC(C)c1cc(Br)cc(Br)c1I Amb19944070 [2,0,0,0,0,0|1,1,0]=4 66 B12R1.511 CC(C)c1cc(Br)cc(Br)c1N Amb19943964 [2,0,0,0,0,0|2,0,0]=4 67 B12R1.511 CC(C)c1cc(Br)cc(Cl)c1O Amb25778439 [2,0,0,0,0,0|2,0,0]=4 68 B12R1.511 CC(C)c1cc(Br)cc(I)c1O Amb24341959 [2,0,0,0,0,0|2,0,0]=4 69 B12R1.511 CC(C)c1cc(Br)cc(S)c1N Amb18270821 [2,0,0,0,0,0|1,1,0]=4 70 B12R1.511 CC(C)c1cc(N)cc(Br)c1O Amb23491318 [2,0,0,0,0,0|1,0,1]=4 71 B12R1.511 CC1=CC(=O)C=C(C1=O)N(C)C Amb24723899 [2,0,0,0,0,0|2,0,0]=4 72 B12R1.511 CC=1C=C(Br)C(=O)N(C1)C(C)C Amb19128321 [2,0,0,0,0,0|2,0,0]=4 73 B12R1.511 Cc1cc(Br)cc(C(C)C)c1Br Amb19888202 [2,0,0,0,0,0|1,0,0]=3 74 B12R1.511 Cc1cc(Br)cc(C(C)C)c1I Amb19888203 [2,0,0,0,0,0|1,1,0]=4 75 B12R1.511 Cc1cc(Br)cc(C(C)C)c1N Amb19888201 [2,0,0,0,0,0|2,0,0]=4 76 B12R1.893 CC1=CC=C(C(C)C)C(=O)C1=O Amb25046464 [2,0,0,0,0,0|1,0,0]=3 77 B12R1.893 Cc1c(Br)c(ccc1N)C(C)C Amb25099443 [2,0,0,0,0,0|2,0,0]=4 78 B12R1.893 Cc1ccc(C(C)C)c(Br)c1O Amb24759654 [2,0,0,0,0,0|0,0,1]=3 79 B12R1.893 Cc1ccc(C(C)C)c(C)c1N Amb24102281 [2,0,0,0,0,0|2,0,0]=4 80 B12R1.893 Cc1ccc(C(C)C)c(C)c1O Amb25282643 [2,0,0,0,0,0|1,0,1]=4 81 B12R1.893 Cc1ccc(C(C)C)c(Cl)c1O Amb24065477 [2,0,0,0,0,0|0,1,1]=4 82 B12R1.893 Cc1ccc(C(C)C)c(N)c1N Amb25725007 [2,0,0,0,0,0|2,0,0]=4 83 B12R1.893 Cc1ccc(C(C)C)c(N)c1O Amb24106081 [2,0,0,0,0,0|1,0,1]=4 84 B12R1.893 Cc1ccc(C(C)C)c(O)c1Cl Amb24065555 [2,0,0,0,0,0|0,1,1]=4 85 B12R1.893 Cc1ccc(C(C)C)c(O)c1N Amb24081100 [2,0,0,0,0,0|1,0,1]=4 86 B12R1.893 Cc1ccc(C(C)C)c(O)c1N Amb24106187 [2,0,0,0,0,0|1,0,1]=4 87 B12R1.1005 CC(C)c1cc(Br)c(Cl)c(Br)c1 Amb19944063 [2,0,0,0,0,0|2,0,0]=4 88 B12R1.1005 CC(C)c1cc(Br)c(I)c(Br)c1 Amb19944064 [2,0,0,0,0,0|2,0,0]=4 89 B12R1.1005 Cc1c(Br)cc(cc1Br)C(C)N Amb23400784 [2,0,0,0,0,0|2,0,0]=4 90 B12R1.1005 Cc1c(Br)cc(cc1Br)C(C)O Amb23400785 [2,0,0,0,0,0|2,0,0]=4 91 B12R1.1005 Cc1c(N)cc(cc1Br)C(C)C Amb24330834 [2,0,0,0,0,0|1,0,0]=3 92 B12R1.1005 Cc1c(N)cc(cc1N)C(C)C Amb25074672 [2,0,0,0,0,0|2,0,0]=4 93 B12R1.98 CC1=C(OC)C(=O)C=C(C)C1=O Amb24490383 [2,0,0,0,0,0|2,0,0]=4 94 B12R1.98 CC1=CC(=O)C(OC)=C(N)C1=O Amb25774493 [2,0,0,0,0,0|2,0,0]=4 95 B12R1.98 CC1=CC(=O)C(OC)=C(O)C1=O Amb25730130 [2,0,0,0,0,0|2,0,0]=4 96 B12R1.98 CCC=1C(=O)C=C(C)C(=O)C1C Amb24645437 [2,0,0,0,0,0|1,0,0]=3 97 B12R1.894 CC(N)c1c(O)c(Br)ccc1Br Amb24699370 [2,0,0,0,0,0|1,0,1]=4 98 B12R1.894 C[C@@H](N)c1c(O)c(Br)ccc1Br Amb25245396 [2,0,0,0,0,0|1,0,1]=4 99 B12R1.1000 CC=1C=C(O)N(C(C)C)C(=O)C1 Amb24704279 [2,0,0,0,0,0|2,0,0]=4 100 B12R1.1000 Cc1cc(C)c(C(C)C)c(C)c1 Amb24101650 [2,0,0,0,0,0|2,0,0]=4 101 B12R1.1000 Cc1cc(O)c(C(C)C)c(C)c1 Amb25768412 [2,0,0,0,0,0|1,0,1]=4 102 B12R1.705 CCc1c(Br)c(F)cc(Br)c1F Amb24616048 [2,0,0,0,0,0|2,0,0]=4 103 B12R1.3795 BrC1=C(Br)C(=O)C(=C(C1=O)Br)Br Amb1202613 [2,0,0,0,0,0|2,0,0]=4 104 B12R1.3795 CC=1C(=O)C(N)=C(C)C(=O)C1N Amb25279445 [2,0,0,0,0,0|2,0,0]=4 105 B12R1.3795 Cc1c(I)c(Br)c(C)c(I)c1Br Amb22345700 [2,0,0,0,0,0|2,0,0]=4 106 B14R1.569 Cc1c(Br)c(O)c(cc1N=O)C(C)C Amb20246220 [1,1,0,0,0,0|0,0,1]=3 107 B14R1.569 O=Nc1cc(C(C)C)c(c(c1C)I)O Amb10669832 [1,1,0,0,0,0|0,1,1]=4 108 B14R1.2876 CN[C@@H](C)c1cc(Br)c(C)c(C)c1O Amb24680067 [1,1,0,0,0,0|2,0,0]=4 109 B14R1.2876 CN[C@H](C)c1cc(C)c(C)c(Br)c1O Amb25786177 [1,1,0,0,0,0|1,0,1]=4 110 B14R1.2876 Cc1c(Br)cc([C@@H](C)NC)c(O)c1Br Amb25827039 [1,1,0,0,0,0|1,0,1]=4 111 B14R1.3940 Cc1c(O)cc(C(C)C)c(N=O)c1O Amb25718902 [1,1,0,0,0,0|1,0,1]=4 112 B14R1.12249 Cc1c(C=O)c(O)c(cc1Br)C(C)C Amb25311477 [1,1,0,0,0,0|1,0,0]=3 113 B14R1.12249 O=Cc1c(O)c(cc(c1C)Cl)C(C)C Amb17595759 [1,1,0,0,0,0|1,1,0]=4 114 B14R1.586 Cc1cc(N=O)c(C(C)C)c(Cl)c1O Amb25777473 [1,1,0,0,0,0|0,1,1]=4 115 B14R1.3920 Cc1cc(O)c(C(C)C)c(C=O)c1O Amb24441663 [1,1,0,0,0,0|2,0,0]=4 116 B14R1.4189 Cc1cc(O)c(C(C)C)c(O)c1N=O Amb25066354 [1,1,0,0,0,0|1,0,1]=4 117 B14R1.3930 COC1=C(Br)C(=O)C(OC)=C(Br)C1=O Amb25169681 [1,1,0,0,0,0|1,0,0]=3 118 B14R2.5746 CC1=CC(=O)C=2OCC(C)C2C1=O Amb25034482 [1,0,0,1,0,0|2,0,0]=4 119 B14R1.15614 CC(C)C1=CC(=O)C(O)=C(Br)C=C1N Amb24534865 [1,0,0,0,0,1|2,0,0]=4