0 B15R2.18922 CC1(c2ccc(Br)cc2)CC(=O)CO1 Amb35721852 [0,0,0,0,0,0|4,0,0]=4 1 B15R2.18922 CC1(c2ccc(Br)cc2)CC(N)CO1 Amb35593796 [0,0,0,0,0,0|3,0,1]=4 2 B15R2.18922 CC1(c2ccc(Br)cc2)CCC(=O)C1 Amb30021781 [0,0,0,0,0,0|3,0,0]=3 3 B15R2.18922 CC1(c2ccc(Br)cc2)CCC(=O)O1 Amb17355016 [0,0,0,0,0,0|3,0,0]=3 4 B15R2.18922 CC1(c2ccc(Br)cc2)CCC(Br)C1 Amb35656681 [0,0,0,0,0,0|3,0,1]=4 5 B15R2.18922 CC1(c2ccc(Br)cc2)CCC(Cl)C1 Amb35656678 [0,0,0,0,0,0|3,0,1]=4 6 B15R2.18922 CC1(c2ccc(Br)cc2)CCC(N)C1 Amb30028235 [0,0,0,0,0,0|2,0,1]=3 7 B15R2.18922 CC1(c2ccc(Br)cc2)CCC(O)C1 Amb35626027 [0,0,0,0,0,0|3,0,1]=4 8 B15R2.18922 CC1(c2ccc(Br)cc2)CNC(=O)O1 Amb17196811 [0,0,0,0,0,0|3,0,0]=3 9 B15R2.18922 CC1(c2ccc(Br)cc2)COC(=O)N1 Amb27483738 [0,0,0,0,0,0|1,0,1]=2 10 B15R2.18922 CC1(c2ccc(Br)cc2)NC(=O)CS1 Amb2223227 [0,0,0,0,0,0|3,0,1]=4 11 B15R2.18922 CC1(c2ccc(Br)cn2)CCC(=O)O1 Amb35669595 [0,0,0,0,0,0|4,0,0]=4 12 B15R2.18922 CC1(c2ccc(Br)cn2)CN=C(N)N1 Amb35669728 [0,0,0,0,0,0|2,0,1]=3 13 B15R2.18922 CC1(c2ccc(Br)cn2)CNC(=O)C1 Amb30020927 [0,0,0,0,0,0|4,0,0]=4 14 B15R2.18922 CC1(c2ccc(Br)cn2)COC(=O)N1 Amb35676769 [0,0,0,0,0,0|2,0,1]=3 15 B15R2.18922 CC1(c2ccc(Br)cn2)COC(N)=N1 Amb35669615 [0,0,0,0,0,0|1,0,0]=1 16 B15R2.18922 CC1(c2ccc(Cl)cc2)CCC(=O)O1 Amb17339568 [0,0,0,0,0,0|3,1,0]=4 17 B15R2.18922 CC1(c2ccc(Cl)cc2)CNC(=O)C1 Amb26615300 [0,0,0,0,0,0|3,1,0]=4 18 B15R2.18922 CC1(c2ccc(Cl)cc2)CNC(=O)O1 Amb17195127 [0,0,0,0,0,0|3,1,0]=4 19 B15R2.18922 CC1(c2ccc(Cl)cc2)CSC(N)=N1 Amb27603300 [0,0,0,0,0,0|0,2,0]=2 20 B15R2.18922 CC1(c2ccc(Cl)cn2)CN=C(N)N1 Amb35669672 [0,0,0,0,0,0|2,1,1]=4 21 B15R2.18922 CC1(c2ccc(Cl)cn2)COC(=O)N1 Amb35676768 [0,0,0,0,0,0|2,1,1]=4 22 B15R2.18922 CC1(c2ccc(Cl)cn2)COC(N)=N1 Amb35669614 [0,0,0,0,0,0|1,1,0]=2 23 B15R2.18922 CC1(c2ccc(F)cc2)CCC(=O)O1 Amb17336795 [0,0,0,0,0,0|3,1,0]=4 24 B15R2.18922 CC1(c2ccc(F)cc2)CNC(=O)C1 Amb27466931 [0,0,0,0,0,0|3,1,0]=4 25 B15R2.18922 CC1(c2ccc(F)cc2)CNC(=O)O1 Amb17194739 [0,0,0,0,0,0|3,1,0]=4 26 B15R2.18922 CC1(c2ccc(I)cc2)CN=C(N)N1 Amb27783601 [0,0,0,0,0,0|1,1,1]=3 27 B15R2.18922 CC1(c2ccc(I)cc2)COC(N)=N1 Amb27949340 [0,0,0,0,0,0|0,1,0]=1 28 B15R2.18922 CC1(c2ccc(N)cc2)COC(=O)N1 Amb32679783 [0,0,0,0,0,0|2,0,1]=3 29 B15R2.18922 CC1(c2ccc(O)cc2)CN=C(N)N1 Amb27800668 [0,0,0,0,0,0|2,0,1]=3 30 B15R2.18922 CC1=CCC(N)(c2ccc(Br)cc2)C1 Amb26009805 [0,0,0,0,0,0|4,0,0]=4 31 B15R2.18922 CC1CC(O)(c2ccc(Br)cc2)CO1 Amb35614303 [0,0,0,0,0,0|3,0,1]=4 32 B15R2.18922 C[C@@]1(c2ccc(O)cc2)COC(=O)N1 Amb27387976 [0,0,0,0,0,0|2,0,1]=3 33 B15R2.18922 C[C@]1(c2ccc(Cl)cc2)COC(N)=N1 Amb27234726 [0,0,0,0,0,0|0,1,0]=1 34 B15R2.18922 Cc1ccc(C2(C)CCC(=O)O2)cc1 Amb17336239 [0,0,0,0,0,0|4,0,0]=4 35 B15R2.18922 Cc1ccc(C2(C)CNC(=O)C2)cc1 Amb27478993 [0,0,0,0,0,0|4,0,0]=4 36 B15R2.18922 Cc1ccc(C2(C)CNC(=O)O2)cc1 Amb17194629 [0,0,0,0,0,0|4,0,0]=4 37 B15R2.18922 Cc1ccc([C@@]2(C)COC(N)=N2)cc1 Amb28060152 [0,0,0,0,0,0|1,0,0]=1 38 B15R2.18922 NC1CCC(F)(c2ccc(Br)cc2)C1 Amb35591791 [0,0,0,0,0,0|3,0,1]=4 39 B15R2.18922 NC1CCC(O)(c2ccc(Br)cc2)C1 Amb35614530 [0,0,0,0,0,0|3,0,1]=4 40 B14R2.20 Brc1ccc(-c2coc(Br)n2)cc1 Amb27840984 [1,0,0,0,0,0|1,0,2]=4 41 B14R2.20 Brc1ccc(-c2coc(I)n2)cc1 Amb27841044 [1,0,0,0,0,0|1,0,2]=4 42 B14R2.20 Cc1ccc(-c2coc(N)n2)cc1 Amb17400434 [1,0,0,0,0,0|1,0,2]=4 43 B14R2.20 Cc1ccc(-c2noc(N)n2)cc1 Amb17233067 [1,0,0,0,0,0|2,0,1]=4 44 B14R2.20 Cc1ccc(C2CN=C(N)N2)cc1 Amb27817260 [1,0,0,0,0,0|2,0,1]=4 45 B14R2.20 Cc1ccc(C2COC(=O)C2)cc1 Amb33353522 [1,0,0,0,0,0|3,0,0]=4 46 B14R2.20 Cc1ccc(C2COC(=O)N2)cc1 Amb25082390 [1,0,0,0,0,0|2,0,1]=4 47 B14R2.20 Cc1ccc(C2COC(N)=N2)cn1 Amb27451455 [1,0,0,0,0,0|2,0,0]=3 48 B14R2.20 Cc1ccc([C@H]2COC(=O)N2)cc1 Amb28205134 [1,0,0,0,0,0|2,0,1]=4 49 B14R2.20 Cc1nc(-c2ccc(Br)cc2)co1 Amb16230929 [1,0,0,0,0,0|1,0,2]=4 50 B14R2.20 Cc1nc(-c2ccc(Br)cc2)no1 Amb2625918 [1,0,0,0,0,0|2,0,1]=4 51 B14R2.20 Clc1nc(-c2ccc(Br)cc2)no1 Amb25895487 [1,0,0,0,0,0|2,0,1]=4 52 B14R2.20 NC1=NC(c2ccc(F)cc2)CO1 Amb27415658 [1,0,0,0,0,0|0,1,0]=2 53 B14R2.20 NC1=NC(c2ccc(O)cc2)CO1 Amb27181018 [1,0,0,0,0,0|1,0,0]=2 54 B14R2.20 NC1=NCC(c2ccc(Br)cc2)O1 Amb19894994 [1,0,0,0,0,0|2,0,0]=3 55 B14R2.20 NC1=NCC(c2ccc(I)cc2)N1 Amb28187171 [1,0,0,0,0,0|1,1,1]=4 56 B14R2.20 NC1=NN(c2ccc(Br)cn2)CC1 Amb28136205 [1,0,0,0,0,0|3,0,0]=4 57 B14R2.20 NC1=NN(c2ccc(Cl)cc2)CC1 Amb4451089 [1,0,0,0,0,0|2,1,0]=4 58 B14R2.20 NC1=NN(c2ccc(F)cc2)CC1 Amb24330512 [1,0,0,0,0,0|2,1,0]=4 59 B14R2.20 NN1CCC(c2ccc(Br)cc2)C1 Amb28077837 [1,0,0,0,0,0|3,0,0]=4 60 B14R2.20 N[C@@H]1CC[C@H](c2ccc(Br)cc2)C1 Amb26029696 [1,0,0,0,0,0|2,0,1]=4 61 B14R2.20 N[C@H]1CC[C@@H](c2ccc(Br)cc2)C1 Amb26531443 [1,0,0,0,0,0|2,0,1]=4 62 B14R2.20 Nc1cc(-c2ccc(Br)cc2)co1 Amb18732753 [1,0,0,0,0,0|1,0,2]=4 63 B14R2.20 Nc1cc(-c2ccc(Br)cc2)no1 Amb1353201 [1,0,0,0,0,0|2,0,1]=4 64 B14R2.20 Nc1ccn(-c2ccc(Br)cc2)n1 Amb17090843 [1,0,0,0,0,0|2,0,1]=4 65 B14R2.20 Nc1ccn(-c2ccc(Br)cc2)n1 Amb28555894 [1,0,0,0,0,0|2,0,1]=4 66 B14R2.20 Nc1cnn(-c2ccc(Br)cc2)n1 Amb18157259 [1,0,0,0,0,0|3,0,0]=4 67 B14R2.20 Nc1csc(-c2ccc(Br)cc2)n1 Amb26000614 [1,0,0,0,0,0|2,0,1]=4 68 B14R2.20 Nc1nc(-c2ccc(Br)cc2)co1 Amb17409981 [1,0,0,0,0,0|0,0,2]=3 69 B14R2.20 Nc1nc(-c2ccc(Br)cc2)cs1 Amb17659076 [1,0,0,0,0,0|0,1,2]=4 70 B14R2.20 Nc1nc(-c2ccc(Br)cc2)cs1 Amb2606330 [1,0,0,0,0,0|0,1,2]=4 71 B14R2.20 Nc1nc(-c2ccc(Br)cc2)no1 Amb17255061 [1,0,0,0,0,0|1,0,1]=3 72 B14R2.20 Nc1nc(-c2ccc(Br)cc2)ns1 Amb33531821 [1,0,0,0,0,0|1,1,1]=4 73 B14R2.20 Nc1nc(-c2ccc(Cl)cc2)co1 Amb17401988 [1,0,0,0,0,0|0,1,2]=4 74 B14R2.20 Nc1nc(-c2ccc(Cl)cc2)no1 Amb5846618 [1,0,0,0,0,0|1,1,1]=4 75 B14R2.20 Nc1nc(-c2ccc(F)cc2)co1 Amb17400645 [1,0,0,0,0,0|0,1,2]=4 76 B14R2.20 Nc1nc(-c2ccc(F)cc2)no1 Amb13777433 [1,0,0,0,0,0|1,1,1]=4 77 B14R2.20 Nc1noc(-c2ccc(Br)cc2)n1 Amb18156995 [1,0,0,0,0,0|2,0,1]=4 78 B14R2.20 Nc1nsc(-c2ccc(Br)cc2)n1 Amb18692853 [1,0,0,0,0,0|2,0,1]=4 79 B14R2.20 O=C1C=C(c2ccc(Br)cc2)CO1 Amb33353508 [1,0,0,0,0,0|2,0,1]=4 80 B14R2.20 O=C1CC(c2ccc(Br)cc2)CN1 Amb13783610 [1,0,0,0,0,0|3,0,0]=4 81 B14R2.20 O=C1CC(c2ccc(Br)cc2)CO1 Amb33353520 [1,0,0,0,0,0|2,0,0]=3 82 B14R2.20 O=C1CC(c2ccc(Cl)cc2)CO1 Amb24097675 [1,0,0,0,0,0|2,1,0]=4 83 B14R2.20 O=C1CC(c2ccc(F)cc2)CO1 Amb32419031 [1,0,0,0,0,0|2,1,0]=4 84 B14R2.20 O=C1CCC(c2ccc(Br)cc2)C1 Amb17158701 [1,0,0,0,0,0|3,0,0]=4 85 B14R2.20 O=C1CCC(c2ccc(Br)cc2)N1 Amb17472798 [1,0,0,0,0,0|2,0,1]=4 86 B14R2.20 O=C1CCC(c2ccc(Br)cc2)O1 Amb1041779 [1,0,0,0,0,0|3,0,0]=4 87 B14R2.20 O=C1CC[C@@H](c2ccc(Br)cc2)O1 Amb27412329 [1,0,0,0,0,0|3,0,0]=4 88 B14R2.20 O=C1CC[C@H](c2ccc(Br)cc2)C1 Amb28256738 [1,0,0,0,0,0|3,0,0]=4 89 B14R2.20 O=C1C[C@@H](c2ccc(Br)cc2)CN1 Amb26546563 [1,0,0,0,0,0|3,0,0]=4 90 B14R2.20 O=C1C[C@H](c2ccc(Br)cc2)CN1 Amb25693140 [1,0,0,0,0,0|3,0,0]=4 91 B14R2.20 O=C1NC(c2ccc(Br)cc2)CO1 Amb33532359 [1,0,0,0,0,0|1,0,1]=3 92 B14R2.20 O=C1NC(c2ccc(Br)cn2)CO1 Amb25896222 [1,0,0,0,0,0|2,0,1]=4 93 B14R2.20 O=C1NC(c2ccc(Br)nc2)CO1 Amb27206069 [1,0,0,0,0,0|2,0,1]=4 94 B14R2.20 O=C1NC(c2ccc(Cl)cc2)CO1 Amb27585382 [1,0,0,0,0,0|1,1,1]=4 95 B14R2.20 O=C1NC(c2ccc(F)cc2)CO1 Amb26854637 [1,0,0,0,0,0|1,1,1]=4 96 B14R2.20 O=C1NC(c2ccc(O)cc2)CO1 Amb24709902 [1,0,0,0,0,0|2,0,1]=4 97 B14R2.20 O=C1NCC(c2ccc(Br)cc2)N1 Amb27840973 [1,0,0,0,0,0|2,0,1]=4 98 B14R2.20 O=C1NCC(c2ccc(Br)cc2)O1 Amb17255947 [1,0,0,0,0,0|3,0,0]=4 99 B14R2.20 O=C1NC[C@H](c2ccc(Br)cc2)N1 Amb27879855 [1,0,0,0,0,0|2,0,1]=4 100 B14R2.20 O=C1N[C@@H](c2ccc(Br)nc2)CO1 Amb27172130 [1,0,0,0,0,0|2,0,1]=4 101 B14R2.20 O=C1N[C@H](c2ccc(Br)cc2)CO1 Amb27600878 [1,0,0,0,0,0|1,0,1]=3 102 B14R2.20 O=C1N[C@H](c2ccc(Br)cn2)CO1 Amb27617896 [1,0,0,0,0,0|2,0,1]=4 103 B14R2.20 O=C1N[C@H](c2ccc(Cl)cc2)CO1 Amb28397440 [1,0,0,0,0,0|1,1,1]=4 104 B14R2.20 OC1=NN(c2ccc(Br)cc2)CC1 Amb6308038 [1,0,0,0,0,0|3,0,0]=4 105 B14R2.20 S=C1NCC(c2ccc(Br)cc2)N1 Amb24685233 [1,0,0,0,0,0|2,0,1]=4 106 B14R2.20 Sc1nc(-c2ccc(Br)cc2)no1 Amb20667836 [1,0,0,0,0,0|2,0,1]=4 107 B14R2.2950 CC1(c2ccccc2)CCC(=O)C1 Amb26474150 [1,0,0,0,0,0|3,0,0]=4 108 B14R2.2950 CC1(c2ccccc2)CCC(=O)N1 Amb25876839 [1,0,0,0,0,0|2,0,1]=4 109 B14R2.2950 CC1(c2ccccc2)CCC(=O)O1 Amb3361281 [1,0,0,0,0,0|3,0,0]=4 110 B14R2.2950 CC1(c2ccccc2)CNC(=O)C1 Amb6406912 [1,0,0,0,0,0|3,0,0]=4 111 B14R2.2950 CC1(c2ccccc2)CNC(=O)N1 Amb26375160 [1,0,0,0,0,0|2,0,1]=4 112 B14R2.2950 CC1(c2ccccc2)CNC(=O)O1 Amb17194507 [1,0,0,0,0,0|3,0,0]=4 113 B14R2.2950 CC1(c2ccccc2)CNC(=S)N1 Amb4032826 [1,0,0,0,0,0|2,0,1]=4 114 B14R2.2950 CC1(c2ccccc2)CNC(=S)S1 Amb27618343 [1,0,0,0,0,0|3,0,0]=4 115 B14R2.2950 CC1(c2ccccc2)COC(=S)N1 Amb27488177 [1,0,0,0,0,0|1,0,1]=3 116 B14R2.2950 CC1(c2ccccc2)COC(N)=N1 Amb28138820 [1,0,0,0,0,0|0,0,0]=1 117 B14R2.2950 CC1(c2ccccc2)CSC(=O)N1 Amb27797246 [1,0,0,0,0,0|1,1,1]=4 118 B14R2.2950 CC1(c2ccccc2)CSC(=S)N1 Amb27201650 [1,0,0,0,0,0|1,1,1]=4 119 B14R2.2950 CC1(c2ccccn2)CN=C(N)N1 Amb27172734 [1,0,0,0,0,0|2,0,1]=4 120 B14R2.2950 CC1(c2ccccn2)COC(=O)N1 Amb27623103 [1,0,0,0,0,0|2,0,1]=4 121 B14R2.2950 CC1(c2ccccn2)COC(N)=N1 Amb27754829 [1,0,0,0,0,0|1,0,0]=2 122 B14R2.2950 CC1(c2ccncc2)CN=C(N)N1 Amb28281153 [1,0,0,0,0,0|2,0,1]=4 123 B14R2.2950 CC1(c2ccncc2)COC(N)=N1 Amb28341993 [1,0,0,0,0,0|1,0,0]=2 124 B14R2.2950 CC1(c2ccncn2)COC(N)=N1 Amb28146099 [1,0,0,0,0,0|2,0,0]=3 125 B14R2.2950 C[C@@]1(c2ccccc2)COC(=O)N1 Amb27390178 [1,0,0,0,0,0|1,0,1]=3 126 B14R2.2950 C[C@]1(c2ccccc2)CCC(=O)C1 Amb27409522 [1,0,0,0,0,0|3,0,0]=4 127 B14R2.2950 C[C@]1(c2ccccc2)COC(N)=N1 Amb28118479 [1,0,0,0,0,0|0,0,0]=1 128 B14R2.2950 C[N+]1(c2ccccc2)CCC(N)=N1 Amb4004670 [1,0,0,0,0,0|2,0,0]=3 129 B14R2.2950 O=C1CC(O)(c2ccccc2)CO1 Amb2613714 [1,0,0,0,0,0|3,0,0]=4 130 B14R2.4398 CC1(c2ccc(Br)cc2)CCCC1 Amb27186517 [1,0,0,0,0,0|2,0,1]=4 131 B14R2.4398 CC1(c2ccc(Br)cc2)CCCN1 Amb35591577 [1,0,0,0,0,0|1,0,2]=4 132 B14R2.4398 Cc1ccc(C2(C)CC=CC2)cc1 Amb24562238 [1,0,0,0,0,0|3,0,0]=4 133 B14R2.4398 Cc1ccc(C2(C)COCN2)cc1 Amb27412385 [1,0,0,0,0,0|1,0,2]=4 134 B14R2.4398 NC1(c2ccc(Br)cc2)CC=CC1 Amb27648513 [1,0,0,0,0,0|3,0,0]=4 135 B14R2.4398 NC1(c2ccc(Br)cc2)CCOC1 Amb21963038 [1,0,0,0,0,0|2,0,1]=4 136 B14R2.4398 OC1(c2ccc(Br)cc2)CCOC1 Amb32656044 [1,0,0,0,0,0|2,0,1]=4 137 B16R2.6058 NCC1(c2ccc(Br)cc2)CNC(=O)C1 Amb31159416 [0,1,0,0,0,0|3,0,0]=4 138 B16R2.6058 NCC1(c2ccc(Br)cc2)CNC(=O)O1 Amb18594099 [0,1,0,0,0,0|3,0,0]=4 139 B16R2.167681 CC1(c2ccc(Br)cc2)CC(=O)OC1=O Amb8827432 [0,1,0,0,0,0|2,0,1]=4 140 B16R2.167681 CC1(c2ccc(Br)cc2)N=C(S)NC1=O Amb33538073 [0,1,0,0,0,0|2,0,1]=4 141 B16R2.167686 CN1CC(C)(c2ccc(Br)cc2)OC1=O Amb17274517 [0,1,0,0,0,0|3,0,0]=4 142 B14R1.10 CCC(=N)NC(C)c1ccc(Br)cc1 Amb28350676 [0,0,1,0,0,0|1,0,2]=4 143 B14R1.10 CCC(=O)NC(C)c1ccc(Br)cc1 Amb8561717 [0,0,1,0,0,0|2,0,1]=4 144 B14R1.10 CNC(=O)CC(C)c1ccc(Br)cc1 Amb17264933 [0,0,1,0,0,0|3,0,0]=4 145 B14R1.10 CNC(=O)N[C@H](C)c1ccc(Br)cc1 Amb27806604 [0,0,1,0,0,0|2,0,1]=4 146 B14R1.10 COC(=O)CC(C)c1ccc(Br)cc1 Amb17265526 [0,0,1,0,0,0|2,0,0]=3 147 B14R1.10 COC(=O)CC(C)c1ccc(C)cc1 Amb17235400 [0,0,1,0,0,0|3,0,0]=4 148 B14R1.10 COC(=O)CC(C)c1ccc(Cl)cc1 Amb17241254 [0,0,1,0,0,0|2,1,0]=4 149 B14R1.10 COC(=O)CC(C)c1ccc(F)cc1 Amb17236380 [0,0,1,0,0,0|2,1,0]=4 150 B14R1.10 COC(=O)CC(C)c1ccc(N)cc1 Amb26304332 [0,0,1,0,0,0|3,0,0]=4 151 B14R1.10 COC(=O)CC(N)c1ccc(Br)cc1 Amb10619468 [0,0,1,0,0,0|3,0,0]=4 152 B14R1.10 COC(=O)CC(N)c1ccc(Br)cc1 Amb2371490 [0,0,1,0,0,0|3,0,0]=4 153 B14R1.10 COC(=O)CC(O)c1ccc(Br)cc1 Amb33451492 [0,0,1,0,0,0|3,0,0]=4 154 B14R1.10 COC(=O)C[C@@H](N)c1ccc(Br)cc1 Amb23440353 [0,0,1,0,0,0|3,0,0]=4 155 B14R1.10 COC(=O)C[C@@H](O)c1ccc(Br)cc1 Amb33451487 [0,0,1,0,0,0|3,0,0]=4 156 B14R1.10 COC(=O)C[C@H](N)c1ccc(Br)cc1 Amb32645738 [0,0,1,0,0,0|3,0,0]=4 157 B14R1.10 COC(=O)C[C@H](N)c1ccc(Br)cc1 Amb33801988 [0,0,1,0,0,0|3,0,0]=4 158 B14R1.10 COC(=O)C[C@H](O)c1ccc(Br)cc1 Amb33451489 [0,0,1,0,0,0|3,0,0]=4 159 B14R1.10 COC(=O)N[C@@H](C)c1ccc(Br)cc1 Amb27755358 [0,0,1,0,0,0|1,0,1]=3 160 B14R1.10 COC(=O)\C=C(\C)c1ccc(Br)cc1 Amb25717231 [0,0,1,0,0,0|2,0,1]=4 161 B14R1.10 C[C@@H](N\C(N)=N\N)c1ccc(Br)cc1 Amb27832848 [0,0,1,0,0,0|2,0,1]=4 162 B14R1.10 C[C@H](N\C(N)=N\N)c1ccc(Br)cc1 Amb27951382 [0,0,1,0,0,0|2,0,1]=4 163 B14R1.125 CC(C)(CCCN)c1ccc(Br)cc1 Amb17078764 [0,0,1,0,0,0|2,0,1]=4 164 B14R1.678 CC(CCC(=O)O)c1ccc(Br)cc1 Amb5739888 [0,0,1,0,0,0|3,0,0]=4 165 B14R1.678 N=C(N)NCC(O)c1ccc(Cl)cc1 Amb24694204 [0,0,1,0,0,0|2,1,0]=4 166 B14R1.678 NC(=O)CCC(O)c1ccc(Br)cc1 Amb17356401 [0,0,1,0,0,0|3,0,0]=4 167 B14R1.678 NC(=S)NCC(O)c1ccc(Br)cc1 Amb27612302 [0,0,1,0,0,0|3,0,0]=4 168 B14R1.694 CC(=O)CC(C)(C)c1ccc(Br)cc1 Amb5740095 [0,0,1,0,0,0|2,0,1]=4 169 B14R1.694 CC(=O)NC(C)(C)c1ccc(Br)cc1 Amb26863623 [0,0,1,0,0,0|1,0,2]=4 170 B14R1.694 CC(C)(CC(=O)O)c1ccc(Br)cc1 Amb17162562 [0,0,1,0,0,0|2,0,0]=3 171 B14R1.694 CC(C)(CC(=O)O)c1ccc(Br)cn1 Amb33227823 [0,0,1,0,0,0|3,0,0]=4 172 B14R1.694 CC(C)(CC(=O)O)c1ccc(Br)nc1 Amb33387762 [0,0,1,0,0,0|3,0,0]=4 173 B14R1.694 CC(C)(CC(=O)O)c1ccc(Cl)cc1 Amb17138357 [0,0,1,0,0,0|2,1,0]=4 174 B14R1.694 CC(C)(CC(=O)O)c1ccc(F)cc1 Amb17139590 [0,0,1,0,0,0|2,1,0]=4 175 B14R1.694 CC(C)(CC(=O)O)c1ccc(I)cc1 Amb22371932 [0,0,1,0,0,0|2,1,0]=4 176 B14R1.694 CC(C)(CC(=O)O)c1ccc(N)cc1 Amb22372049 [0,0,1,0,0,0|3,0,0]=4 177 B14R1.694 CC(C)(CC(=O)O)c1ccc(O)cc1 Amb23440688 [0,0,1,0,0,0|3,0,0]=4 178 B14R1.694 CC(N)(CC(=O)O)c1ccc(Br)cc1 Amb17473603 [0,0,1,0,0,0|3,0,0]=4 179 B14R1.694 CC(N)(CC(=O)O)c1ccc(Br)cc1 Amb32992844 [0,0,1,0,0,0|3,0,0]=4 180 B14R1.694 CC(N)CC(C)(C)c1ccc(Br)cc1 Amb5740132 [0,0,1,0,0,0|2,0,1]=4 181 B14R1.694 CC(O)(CC(=O)O)c1ccc(Br)cc1 Amb17163101 [0,0,1,0,0,0|3,0,0]=4 182 B14R1.694 CC(O)CC(C)(C)c1ccc(Br)cc1 Amb35626028 [0,0,1,0,0,0|2,0,1]=4 183 B14R1.694 Cc1ccc(C(C)(C)CC(=O)O)cc1 Amb415918 [0,0,1,0,0,0|3,0,0]=4 184 B14R2.10593 CC1(c2ccc(Br)cc2)CCC1=O Amb27450787 [0,0,0,0,1,0|2,0,0]=3 185 B14R2.10593 CC1(c2ccc(Cl)cc2)CCC1=O Amb27242671 [0,0,0,0,1,0|2,1,0]=4 186 B14R2.10593 CC1(c2ccc(F)cc2)CCC1N Amb27792217 [0,0,0,0,1,0|1,1,1]=4 187 B14R2.10593 Cc1ccc(C2(C)CCC2=O)cc1 Amb27164524 [0,0,0,0,1,0|3,0,0]=4 188 B14R2.20655 CC1(c2ccc(Br)o2)COC(N)=N1 Amb28435922 [0,0,0,0,1,0|1,0,0]=2 189 B14R2.20678 CC1(c2ccc(Br)cn2)CC(=O)N1 Amb30020924 [0,0,0,0,1,0|2,0,1]=4 190 B14R2.20678 CC1(c2ccc(F)cc2)CC(=O)C1 Amb25923474 [0,0,0,0,1,0|2,1,0]=4 191 B14R2.20678 NC1CC(F)(c2ccc(Br)cc2)C1 Amb35591787 [0,0,0,0,1,0|2,0,1]=4 192 B16R2.79332 CC1(c2ccc(Br)cc2)CC(=O)CCN1 Amb31159396 [0,0,0,0,0,1|3,0,0]=4 193 B13R1.11 COC(=O)CC(C)c1ccccc1 Amb17843427 [1,0,1,0,0,0|2,0,0]=4 194 B13R1.14 COC(=N)CCc1ccc(Br)cc1 Amb18071193 [1,0,1,0,0,0|1,0,1]=4 195 B13R1.14 COC(=O)CCc1ccc(Br)cc1 Amb15692693 [1,0,1,0,0,0|2,0,0]=4 196 B13R1.14 COC(=O)NCc1ccc(Br)cc1 Amb25101223 [1,0,1,0,0,0|1,0,1]=4 197 B13R1.14 CS\C(N)=N\Cc1ccc(C)cc1 Amb26881241 [1,0,1,0,0,0|1,1,0]=4 198 B13R1.17 CC(CCCN)c1ccc(Br)cc1 Amb18071389 [1,0,1,0,0,0|1,0,1]=4 199 B13R1.132 CC(=O)CC(C)c1ccc(Br)cc1 Amb5740077 [1,0,1,0,0,0|2,0,0]=4 200 B13R1.132 CC(=O)NC(C)c1ccc(Br)cc1 Amb8561898 [1,0,1,0,0,0|1,0,1]=4 201 B13R1.132 CC(=O)N[C@@H](C)c1ccc(Br)cc1 Amb27772051 [1,0,1,0,0,0|1,0,1]=4 202 B13R1.132 CC(=O)N[C@H](C)c1ccc(Br)cc1 Amb27594632 [1,0,1,0,0,0|1,0,1]=4 203 B13R1.132 CC(CC(=O)O)c1ccc(Br)cc1 Amb6382816 [1,0,1,0,0,0|2,0,0]=4 204 B13R1.132 CC(CC(N)=O)c1ccc(Br)cc1 Amb17255957 [1,0,1,0,0,0|1,0,1]=4 205 B13R1.132 CC(N)CC(C)c1ccc(Br)cc1 Amb30028232 [1,0,1,0,0,0|1,0,1]=4 206 B13R1.132 CC(NC(N)=O)c1ccc(Br)cc1 Amb1077826 [1,0,1,0,0,0|0,0,2]=4 207 B13R1.132 CC(NC(N)=S)c1ccc(Br)cc1 Amb28042607 [1,0,1,0,0,0|0,1,1]=4 208 B13R1.29 C=CCC(C)(N)c1ccc(Br)cc1 Amb27436617 [1,0,1,0,0,0|1,0,1]=4 209 B13R1.29 CC(C)(CCN)c1ccc(Br)cc1 Amb17255978 [1,0,1,0,0,0|1,0,1]=4 210 B13R1.29 CC(C)(CON)c1ccc(Br)cc1 Amb33451502 [1,0,1,0,0,0|1,0,0]=3 211 B13R1.29 CC(C)(CON)c1ccc(Br)cn1 Amb33477126 [1,0,1,0,0,0|2,0,0]=4 212 B13R1.29 CC(C)(CON)c1ccc(Br)nc1 Amb33388060 [1,0,1,0,0,0|2,0,0]=4 213 B13R1.29 CC(C)(CON)c1ccc(Cl)cc1 Amb33052807 [1,0,1,0,0,0|1,1,0]=4 214 B13R1.29 CC(C)(CON)c1ccc(F)cc1 Amb33376581 [1,0,1,0,0,0|1,1,0]=4 215 B13R1.29 CC(C)(CON)c1ccc(O)cc1 Amb33269538 [1,0,1,0,0,0|2,0,0]=4 216 B13R1.29 CC(C)(N=C=O)c1ccc(Br)cc1 Amb17255066 [1,0,1,0,0,0|0,0,2]=4 217 B13R1.29 CC(O)(CC=O)c1ccc(Br)cc1 Amb28061517 [1,0,1,0,0,0|2,0,0]=4 218 B13R1.29 CC(O)(CCN)c1ccc(Br)cc1 Amb18155765 [1,0,1,0,0,0|1,0,1]=4 219 B13R1.29 CC(O)(CNN)c1ccc(Br)cc1 Amb17257508 [1,0,1,0,0,0|2,0,0]=4 220 B13R1.29 COCC(C)(N)c1ccc(Br)cc1 Amb25128146 [1,0,1,0,0,0|0,0,2]=4 221 B13R1.29 Cc1ccc(C(C)(C)CON)cc1 Amb33373960 [1,0,1,0,0,0|2,0,0]=4 222 B13R1.1 [N-]=[N+]=NC(CO)c1ccc(Br)cc1 Amb32753528 [1,0,1,0,0,0|1,0,1]=4 223 B13R1.1 [N-]=[N+]=N[C@@H](CO)c1ccc(Br)cc1 Amb32675544 [1,0,1,0,0,0|1,0,1]=4 224 B13R1.402 CC(CO)(NC=O)c1ccccc1 Amb28387623 [1,0,1,0,0,0|1,0,1]=4 225 B13R1.402 C[C@@](CO)(N=[N+]=[N-])c1ccccc1 Amb28285523 [1,0,1,0,0,0|1,0,1]=4 226 B13R1.710 C=CC(C)(CO)c1ccc(F)cc1 Amb27397026 [1,0,1,0,0,0|1,1,0]=4 227 B13R1.710 CC(CN)(CO)c1ccc(Br)cc1 Amb18071606 [1,0,1,0,0,0|0,0,1]=3 228 B13R1.710 CC(CN)(CO)c1ccc(Br)cn1 Amb33477473 [1,0,1,0,0,0|1,0,1]=4 229 B13R1.710 CC(CN)(CO)c1ccc(Br)nc1 Amb33388029 [1,0,1,0,0,0|1,0,1]=4 230 B13R1.710 CC(CN)(CO)c1ccc(Cl)cc1 Amb18066515 [1,0,1,0,0,0|0,1,1]=4 231 B13R1.710 CC(CN)(CO)c1ccc(F)cc1 Amb18066110 [1,0,1,0,0,0|0,1,1]=4 232 B13R1.710 CC(CO)(CO)c1ccc(Br)cc1 Amb27594171 [1,0,1,0,0,0|1,0,1]=4 233 B13R1.710 CCC(C)(CN)c1ccc(Br)cc1 Amb27217901 [1,0,1,0,0,0|1,0,1]=4 234 B13R1.710 Cc1ccc(C(C)(CN)CO)cc1 Amb18065859 [1,0,1,0,0,0|1,0,1]=4 235 B13R1.710 NCC(O)(CO)c1ccc(Br)cc1 Amb23515130 [1,0,1,0,0,0|1,0,1]=4 236 B13R1.45 CC(=O)OCC(C)c1ccccc1 Amb4020115 [1,0,1,0,0,0|2,0,0]=4 237 B13R1.45 CC(CNC(=N)N)c1ccccn1 Amb30010309 [1,0,1,0,0,0|2,0,0]=4 238 B13R1.45 CC(CNC(N)=O)c1ccccc1 Amb25156032 [1,0,1,0,0,0|2,0,0]=4 239 B13R1.45 CC(CNC(N)=S)c1ccccc1 Amb27605852 [1,0,1,0,0,0|2,0,0]=4 240 B13R1.45 CC(COC(=O)Cl)c1ccccc1 Amb33297204 [1,0,1,0,0,0|2,0,0]=4 241 B13R1.45 CC(CSC(=N)N)c1ccccc1 Amb20676022 [1,0,1,0,0,0|0,1,0]=3 242 B13R1.45 CN(CCC(=N)N)c1ccccc1 Amb6271903 [1,0,1,0,0,0|2,0,0]=4 243 B13R1.45 C[C@H](CNC(N)=S)c1ccccc1 Amb28121696 [1,0,1,0,0,0|2,0,0]=4 244 B13R1.45 N=C(N)NCC(O)c1ccccc1 Amb18804880 [1,0,1,0,0,0|2,0,0]=4 245 B13R1.45 NC(=O)OCC(O)c1ccccc1 Amb17594650 [1,0,1,0,0,0|2,0,0]=4 246 B13R1.513 CC(=N)NCCc1ccc(Br)cc1 Amb27826811 [1,0,1,0,0,0|2,0,0]=4 247 B13R1.513 Cc1ccc(CCNC(=N)N)cc1 Amb18065725 [1,0,1,0,0,0|2,0,0]=4 248 B13R1.513 N=C(N)CCCc1ccc(Br)cc1 Amb33334095 [1,0,1,0,0,0|1,0,0]=3 249 B13R1.513 N=C(N)CCCc1ccc(F)cc1 Amb33319179 [1,0,1,0,0,0|1,1,0]=4 250 B13R1.513 N=C(N)NCCc1ccc(Br)cc1 Amb18071311 [1,0,1,0,0,0|1,0,0]=3 251 B13R1.513 N=C(N)NCCc1ccc(Cl)cc1 Amb838722 [1,0,1,0,0,0|1,1,0]=4 252 B13R1.513 N=C(N)NCCc1ccc(F)cc1 Amb838723 [1,0,1,0,0,0|1,1,0]=4 253 B13R1.513 N=C(N)NCCc1ccc(O)cc1 Amb18184507 [1,0,1,0,0,0|2,0,0]=4 254 B13R1.513 N=C(N)NNCc1ccc(Br)cc1 Amb18071458 [1,0,1,0,0,0|2,0,0]=4 255 B13R1.513 N=C(N)SCCc1ccc(Cl)cc1 Amb28556074 [1,0,1,0,0,0|0,2,0]=4 256 B13R1.513 N=C(N)SCCc1ccc(Cl)cc1 Amb32663183 [1,0,1,0,0,0|0,2,0]=4 257 B13R1.513 NC(=O)CCCc1ccc(Br)cc1 Amb4005054 [1,0,1,0,0,0|2,0,0]=4 258 B13R1.513 NC(=O)NCCc1ccc(Br)cc1 Amb28242686 [1,0,1,0,0,0|2,0,0]=4 259 B13R1.513 NC(=S)CCCc1ccc(Br)cc1 Amb33334089 [1,0,1,0,0,0|2,0,0]=4 260 B13R1.347 CC(C)(CC(=N)N)c1ccccc1 Amb33176133 [1,0,1,0,0,0|2,0,0]=4 261 B13R1.347 CC(C)(CC(=O)O)c1ccccc1 Amb2796286 [1,0,1,0,0,0|2,0,0]=4 262 B13R1.347 CC(C)(CC(N)=O)c1ccccc1 Amb27415506 [1,0,1,0,0,0|1,0,1]=4 263 B13R1.347 CC(C)(CC(N)=S)c1ccccc1 Amb33176135 [1,0,1,0,0,0|1,1,0]=4 264 B13R1.347 CC(C)(NC(N)=S)c1ccccc1 Amb27434814 [1,0,1,0,0,0|0,1,1]=4 265 B13R2.10 CC1=NC(c2ccccc2)CN1 Amb28071281 [2,0,0,0,0,0|2,0,0]=4 266 B13R2.10 N=C1N[C@@H](c2ccccc2)CO1 Amb25326051 [2,0,0,0,0,0|0,0,2]=4 267 B13R2.10 NC1=NC(c2ccccc2)CO1 Amb33548336 [2,0,0,0,0,0|0,0,0]=2 268 B13R2.10 NC1=NC(c2ccccc2)CS1 Amb5539536 [2,0,0,0,0,0|0,1,0]=3 269 B13R2.10 NC1=NC(c2ccccc2)N=C1 Amb33718551 [2,0,0,0,0,0|2,0,0]=4 270 B13R2.10 NC1=NC(c2cccnc2)CO1 Amb28249320 [2,0,0,0,0,0|1,0,0]=3 271 B13R2.10 NC1=NCC(c2ccccc2)N1 Amb27644507 [2,0,0,0,0,0|1,0,1]=4 272 B13R2.10 NC1=NCC(c2ccccc2)O1 Amb17608294 [2,0,0,0,0,0|2,0,0]=4 273 B13R2.10 NC1=NN(c2ccccc2)CC1 Amb6317925 [2,0,0,0,0,0|2,0,0]=4 274 B13R2.10 NC1=N[C@H](c2ccccc2)CO1 Amb26946059 [2,0,0,0,0,0|0,0,0]=2 275 B13R2.10 NC1=N[C@H](c2ccccc2)CS1 Amb27389470 [2,0,0,0,0,0|0,1,0]=3 276 B13R2.10 Nc1nc(-c2ccccc2)co1 Amb33529509 [2,0,0,0,0,0|0,0,2]=4 277 B13R2.10 Nc1nc(-c2ccccc2)no1 Amb6439807 [2,0,0,0,0,0|1,0,1]=4 278 B13R2.10 O=C1CC(c2ccccc2)CO1 Amb28280068 [2,0,0,0,0,0|2,0,0]=4 279 B13R2.10 O=C1C[C@@H](c2ccccc2)CO1 Amb27451585 [2,0,0,0,0,0|2,0,0]=4 280 B13R2.10 O=C1NC(c2ccccc2)CO1 Amb6346517 [2,0,0,0,0,0|1,0,1]=4 281 B13R2.10 O=C1N[C@@H](c2ccccc2)CO1 Amb6295901 [2,0,0,0,0,0|1,0,1]=4 282 B13R2.10 O=C1N[C@H](c2ccccc2)CO1 Amb6295900 [2,0,0,0,0,0|1,0,1]=4 283 B13R2.10 O=C1OCC(c2ccccc2)O1 Amb27790954 [2,0,0,0,0,0|2,0,0]=4 284 B13R2.10 S=C1NC(c2ccccc2)CO1 Amb26880718 [2,0,0,0,0,0|1,0,1]=4 285 B13R2.12 Brc1ccc(-c2cocn2)cc1 Amb17406513 [2,0,0,0,0,0|0,0,2]=4 286 B13R2.12 Brc1ccc(-c2ncon2)cc1 Amb8471841 [2,0,0,0,0,0|1,0,1]=4 287 B13R2.12 Brc1ccc(C2CCOC2)cc1 Amb20617111 [2,0,0,0,0,0|1,0,1]=4 288 B13R2.12 Clc1ccc(C2CNC=N2)cc1 Amb27228814 [2,0,0,0,0,0|1,1,0]=4 289 B15R1.23 COCC(=O)N[C@@H](C)c1ccc(Br)cc1 Amb22756144 [0,1,1,0,0,0|1,0,1]=4 290 B15R1.75 COC(=O)C(=O)C(C)c1ccc(Br)cc1 Amb17166959 [0,1,1,0,0,0|2,0,0]=4 291 B15R1.979 COC(=O)CC(C)(N)c1ccc(Br)cc1 Amb32729377 [0,1,1,0,0,0|2,0,0]=4 292 B15R1.979 COC(=O)CC(C)(N)c1ccc(Br)cc1 Amb33330095 [0,1,1,0,0,0|2,0,0]=4 293 B15R1.3826 COC(=O)CC(CN)c1ccc(Br)cc1 Amb17420092 [0,1,1,0,0,0|2,0,0]=4 294 B15R1.912 CC(C)(CC(=O)O)c1ccc(Br)c(F)c1 Amb33005912 [0,1,1,0,0,0|2,0,0]=4 295 B15R1.912 Cc1cc(C(C)(C)CC(=O)O)ccc1Br Amb33332366 [0,1,1,0,0,0|2,0,0]=4 296 B15R1.5828 CC(C)(CC(=O)O)c1ccc(Br)cc1F Amb33450845 [0,1,1,0,0,0|2,0,0]=4 297 B15R1.5828 CC(C)(CC(=O)O)c1ccc(Br)cc1O Amb33477728 [0,1,1,0,0,0|2,0,0]=4 298 B15R1.5828 Cc1cc(Br)ccc1C(C)(C)CC(=O)O Amb33431181 [0,1,1,0,0,0|2,0,0]=4 299 B15R1.11348 CC(C)(c1ccc(Br)cc1)C(N)C(=O)O Amb33451625 [0,1,1,0,0,0|2,0,0]=4 300 B15R1.11348 CC(C)(c1ccc(Br)cc1)C(O)C(=O)O Amb33451493 [0,1,1,0,0,0|2,0,0]=4 301 B15R2.275 NCc1nc(-c2ccc(Br)cc2)co1 Amb18584285 [1,1,0,0,0,0|0,0,2]=4 302 B15R2.275 NCc1nc(-c2ccc(Br)cc2)no1 Amb7738924 [1,1,0,0,0,0|1,0,1]=4 303 B15R2.275 NNc1nc(-c2ccc(Br)cc2)no1 Amb27597802 [1,1,0,0,0,0|1,0,1]=4 304 B15R2.299 Cc1cc(C2COC(=O)N2)ccc1Br Amb26988409 [1,1,0,0,0,0|1,0,1]=4 305 B15R2.299 Cc1cc(C2COC(N)=N2)ccc1Br Amb27239274 [1,1,0,0,0,0|0,0,0]=2 306 B15R2.299 Cc1ccc(C2COC(N)=N2)cc1F Amb27464063 [1,1,0,0,0,0|1,0,0]=3 307 B15R2.299 NC1=NC(c2ccc(F)c(Cl)c2)CO1 Amb27875717 [1,1,0,0,0,0|0,1,0]=3 308 B15R2.299 NC1=NC(c2ccc(O)c(F)c2)CO1 Amb28423636 [1,1,0,0,0,0|1,0,0]=3 309 B15R2.299 NC1=N[C@@H](c2ccc(Cl)c(Cl)c2)CO1 Amb25936829 [1,1,0,0,0,0|0,1,0]=3 310 B15R2.299 NC1=N[C@@H](c2ccc(Cl)c(F)c2)CO1 Amb27832482 [1,1,0,0,0,0|0,1,0]=3 311 B15R2.299 NC1=N[C@H](c2ccc(Cl)c(F)c2)CO1 Amb28074081 [1,1,0,0,0,0|0,1,0]=3 312 B15R2.299 O=C1NC(c2ccc(Br)c(Cl)c2)CO1 Amb27656192 [1,1,0,0,0,0|1,0,1]=4 313 B15R2.299 O=C1NC(c2ccc(Br)c(F)c2)CO1 Amb25952289 [1,1,0,0,0,0|1,0,1]=4 314 B15R2.299 O=C1N[C@H](c2ccc(Br)c(Br)c2)CO1 Amb27174389 [1,1,0,0,0,0|1,0,1]=4 315 B15R2.299 O=C1N[C@H](c2ccc(Br)c(Cl)c2)CO1 Amb27481391 [1,1,0,0,0,0|1,0,1]=4 316 B15R2.299 O=C1N[C@H](c2ccc(Br)c(F)c2)CO1 Amb27464728 [1,1,0,0,0,0|1,0,1]=4 317 B15R2.307 CC1CN(c2ccc(Br)cc2)N=C1N Amb28072648 [1,1,0,0,0,0|2,0,0]=4 318 B15R2.309 C[C@H]1OC(=O)N[C@H]1c2ccc(Br)cc2 Amb28056029 [1,1,0,0,0,0|1,0,1]=4 319 B15R2.309 Cc1oc(N)nc1-c2ccc(Br)cc2 Amb27228467 [1,1,0,0,0,0|0,0,2]=4 320 B15R2.309 NC1=NC(c2ccc(Br)cc2)C(=O)N1 Amb27251614 [1,1,0,0,0,0|1,0,1]=4 321 B15R2.1153 Cc1cc(Br)ccc1C2COC(=O)N2 Amb27967029 [1,1,0,0,0,0|1,0,1]=4 322 B15R2.1153 Cc1cc(Br)ccc1N2CCC(N)=N2 Amb27432320 [1,1,0,0,0,0|2,0,0]=4 323 B15R2.1153 Cc1ccc(C2COC(N)=N2)c(Br)c1 Amb28078096 [1,1,0,0,0,0|1,0,0]=3 324 B15R2.1153 Cc1ccc(C2COC(N)=N2)c(C)c1 Amb27165055 [1,1,0,0,0,0|1,0,0]=3 325 B15R2.1153 Cc1ccc(C2COC(N)=N2)c(Cl)c1 Amb35730047 [1,1,0,0,0,0|1,0,0]=3 326 B15R2.1153 NC1=NC(c2ccc(Br)cc2Cl)CO1 Amb28183258 [1,1,0,0,0,0|0,0,0]=2 327 B15R2.1153 NC1=NC(c2ccc(Cl)cc2Br)CO1 Amb27796841 [1,1,0,0,0,0|0,1,0]=3 328 B15R2.1153 NC1=NC(c2ccc(F)cc2Br)CO1 Amb27663020 [1,1,0,0,0,0|0,1,0]=3 329 B15R2.1153 NC1=NC(c2ccc(F)cc2Cl)CO1 Amb27651096 [1,1,0,0,0,0|0,1,0]=3 330 B15R2.1153 NC1=NC(c2ccc(O)cc2F)CO1 Amb35696382 [1,1,0,0,0,0|1,0,0]=3 331 B15R2.1153 NC1=NC(c2ncc(Br)cc2Br)CO1 Amb28409263 [1,1,0,0,0,0|1,0,0]=3 332 B15R2.1153 NC1=NCC(c2ccc(Br)cc2Cl)N1 Amb28455537 [1,1,0,0,0,0|1,0,1]=4 333 B15R2.1153 NC1=N[C@@H](c2ccc(F)cc2F)CO1 Amb27166491 [1,1,0,0,0,0|0,1,0]=3 334 B15R2.1153 O=C1CC(c2ccc(Br)cc2F)CO1 Amb33495545 [1,1,0,0,0,0|2,0,0]=4 335 B15R2.1153 O=C1NC(c2ccc(Br)cc2Cl)CO1 Amb24625102 [1,1,0,0,0,0|1,0,1]=4 336 B15R2.1153 O=C1NC(c2ccc(Br)cc2F)CO1 Amb28066520 [1,1,0,0,0,0|1,0,1]=4 337 B15R2.1153 O=C1NC(c2ccc(Br)cc2O)CO1 Amb27631868 [1,1,0,0,0,0|1,0,1]=4 338 B15R2.1153 O=C1N[C@@H](c2ccc(Br)cc2Cl)CO1 Amb27172111 [1,1,0,0,0,0|1,0,1]=4 339 B15R2.18933 CN1C(N)=NCC1c2ccc(Br)cc2 Amb27210592 [1,1,0,0,0,0|1,0,1]=4 340 B15R2.324 CC1(c2ccccc2)CC(=O)OC1O Amb27785588 [1,1,0,0,0,0|2,0,0]=4 341 B15R2.5167 CCC1(c2ccccc2)COC(N)=N1 Amb27231050 [1,1,0,0,0,0|0,0,0]=2 342 B15R2.6783 COC1=NC(C)(c2ccccc2)CN1 Amb27588055 [1,1,0,0,0,0|2,0,0]=4 343 B15R2.25298 CC1(c2ccccc2Br)COC(N)=N1 Amb27749431 [1,1,0,0,0,0|0,0,0]=2 344 B15R2.25298 CC1(c2ccccc2Cl)COC(N)=N1 Amb27454150 [1,1,0,0,0,0|0,0,0]=2 345 B15R2.25298 CC1(c2ccccc2F)CN=C(N)N1 Amb27747423 [1,1,0,0,0,0|1,0,1]=4 346 B15R2.25298 CC1(c2ccccc2F)COC(N)=N1 Amb27772159 [1,1,0,0,0,0|0,0,0]=2 347 B15R2.25298 Cc1ccccc1C2(C)CN=C(N)N2 Amb27238393 [1,1,0,0,0,0|1,0,1]=4 348 B15R2.25298 Cc1nccnc1C2(C)COC(N)=N2 Amb27668565 [1,1,0,0,0,0|2,0,0]=4 349 B15R2.65021 CC1(c2cccc(Br)c2)COC(=O)N1 Amb25083209 [1,1,0,0,0,0|1,0,1]=4 350 B15R2.65021 CC1(c2cccc(Cl)c2)CN=C(N)N1 Amb27747472 [1,1,0,0,0,0|1,0,1]=4 351 B15R2.65021 CC1(c2cccc(F)c2)COC(=O)N1 Amb27402410 [1,1,0,0,0,0|1,0,1]=4 352 B15R2.65021 CC1(c2cccc(N)c2)COC(=O)N1 Amb32656209 [1,1,0,0,0,0|1,0,1]=4 353 B15R2.65021 CC1(c2cccc(N)c2)COC(=O)N1 Amb32676661 [1,1,0,0,0,0|1,0,1]=4 354 B15R2.65021 CC1(c2cncc(Br)c2)COC(N)=N1 Amb35669613 [1,1,0,0,0,0|1,0,0]=3 355 B15R2.4125 NCC1(c2ccc(Br)cc2)CCOC1 Amb29855907 [1,1,0,0,0,0|1,0,1]=4 356 B15R2.28 NC1=NC(c2ccc(Br)cc2)COC1 Amb27881867 [0,0,1,1,0,0|2,0,0]=4 357 B15R2.28 O=C1NC(c2ccc(Br)cc2)CCO1 Amb28065105 [0,0,1,1,0,0|1,0,1]=4 358 B15R2.1723 NCC1CC1(CO)c2ccc(Br)cc2 Amb32989892 [0,0,1,1,0,0|1,0,1]=4 359 B15R2.3 Cc1ccc(C2CN=C(N)NC2)cc1 Amb26505079 [0,0,1,1,0,0|2,0,0]=4 360 B15R2.3 NC1=NCC(c2ccc(Cl)cc2)CS1 Amb28065092 [0,0,1,1,0,0|0,2,0]=4 361 B15R2.3 Nc1ccc(C2CNC(=O)OC2)cc1 Amb18863710 [0,0,1,1,0,0|2,0,0]=4 362 B15R2.3 O=C1CCC(c2ccc(Br)cc2)CN1 Amb17414216 [0,0,1,1,0,0|2,0,0]=4 363 B15R2.3 O=C1NCC(c2ccc(Br)cc2)CN1 Amb25056731 [0,0,1,1,0,0|2,0,0]=4 364 B15R2.7491 CC1(C)CC(=O)Nc2cc(Br)ccc21 Amb21962686 [0,0,1,1,0,0|1,0,1]=4 365 B15R2.7491 CC1(C)NC(=O)Nc2cc(Br)ccc21 Amb24537507 [0,0,1,1,0,0|0,0,2]=4 366 B15R2.7491 CC1(C)OC(=O)Nc2cc(Br)ccc21 Amb16233698 [0,0,1,1,0,0|1,0,1]=4 367 B15R2.18917 N=C(N)CC1(c2ccc(Br)cc2)CC1 Amb33435662 [0,0,1,1,0,0|2,0,0]=4 368 B15R2.18917 NC(=S)CC1(c2ccc(Br)cc2)CC1 Amb33435675 [0,0,1,1,0,0|1,1,0]=4 369 B15R2.18917 O=C(O)CC1(c2ccc(Br)cc2)CC1 Amb17264235 [0,0,1,1,0,0|2,0,0]=4 370 B15R3.43362 NC12CC(c3ccc(Br)cc3)(C1)C2 Amb24058164 [0,0,0,1,1,0|1,0,1]=4 371 B13R1.21 CCC(=O)C(C)c1ccc(Br)cc1 Amb28367793 [0,0,1,0,1,0|2,0,0]=4 372 B13R1.21 CCC(N)C(C)c1ccc(Br)cc1 Amb27951208 [0,0,1,0,1,0|1,0,1]=4 373 B13R1.21 COC(=O)C(Br)c1ccc(Br)cc1 Amb25251647 [0,0,1,0,1,0|2,0,0]=4 374 B13R1.21 COC(=O)C(C)c1ccc(Br)cc1 Amb26304236 [0,0,1,0,1,0|1,0,0]=3 375 B13R1.21 COC(=O)C(C)c1ccc(Br)cn1 Amb32713068 [0,0,1,0,1,0|2,0,0]=4 376 B13R1.21 COC(=O)C(C)c1ccc(C)cc1 Amb18184314 [0,0,1,0,1,0|2,0,0]=4 377 B13R1.21 COC(=O)C(C)c1ccc(Cl)cc1 Amb19084562 [0,0,1,0,1,0|1,1,0]=4 378 B13R1.21 COC(=O)C(C)c1ccc(F)cc1 Amb18185420 [0,0,1,0,1,0|1,1,0]=4 379 B13R1.21 COC(=O)C(C)c1ccc(N)cc1 Amb18648244 [0,0,1,0,1,0|2,0,0]=4 380 B13R1.21 COC(=O)C(C)c1ccc(N)cc1 Amb32663645 [0,0,1,0,1,0|2,0,0]=4 381 B13R1.21 COC(=O)C(C)c1ccc(O)cc1 Amb18128607 [0,0,1,0,1,0|2,0,0]=4 382 B13R1.21 COC(=O)C(Cl)c1ccc(Br)cc1 Amb18883588 [0,0,1,0,1,0|2,0,0]=4 383 B13R1.21 COC(=O)C(N)c1ccc(Br)cc1 Amb3650081 [0,0,1,0,1,0|2,0,0]=4 384 B13R1.21 COC(=O)C(N)c1ccc(Br)cc1 Amb9175257 [0,0,1,0,1,0|2,0,0]=4 385 B13R1.21 COC(=O)C(O)c1ccc(Br)cc1 Amb23596562 [0,0,1,0,1,0|2,0,0]=4 386 B13R1.21 COC(=O)[C@@H](C)c1ccc(O)cc1 Amb25112603 [0,0,1,0,1,0|2,0,0]=4 387 B13R1.21 COC(=O)[C@@H](N)c1ccc(Br)cc1 Amb30633906 [0,0,1,0,1,0|2,0,0]=4 388 B13R1.21 COC(=O)[C@H](N)c1ccc(Br)cc1 Amb27181092 [0,0,1,0,1,0|2,0,0]=4 389 B13R1.21 COC(=O)[C@H](N)c1ccc(Br)cc1 Amb33801465 [0,0,1,0,1,0|2,0,0]=4 390 B13R1.522 CC(C)(C(=O)O)c1ccc(Br)cc1 Amb8385876 [0,0,1,0,1,0|1,0,0]=3 391 B13R1.522 CC(C)(C(=O)O)c1ccc(Br)cn1 Amb28323101 [0,0,1,0,1,0|2,0,0]=4 392 B13R1.522 CC(C)(C(=O)O)c1ccc(Br)nc1 Amb26362978 [0,0,1,0,1,0|2,0,0]=4 393 B13R1.522 CC(C)(C(=O)O)c1ccc(Cl)cc1 Amb2694736 [0,0,1,0,1,0|1,1,0]=4 394 B13R1.522 CC(C)(C(=O)O)c1ccc(F)cc1 Amb9132613 [0,0,1,0,1,0|1,1,0]=4 395 B13R1.522 CC(C)(C(=O)O)c1ccc(I)cc1 Amb24342439 [0,0,1,0,1,0|1,1,0]=4 396 B13R1.522 CC(C)(C(=O)O)c1ccc(N)cc1 Amb17194071 [0,0,1,0,1,0|2,0,0]=4 397 B13R1.522 CC(C)(C(=O)O)c1ccc(O)cc1 Amb17621422 [0,0,1,0,1,0|2,0,0]=4 398 B13R1.522 CC(C)(C(N)=O)c1ccc(Br)cc1 Amb10608206 [0,0,1,0,1,0|0,0,1]=3 399 B13R1.522 CC(C)(C(N)=O)c1ccc(Cl)cc1 Amb22039501 [0,0,1,0,1,0|0,1,1]=4 400 B13R1.522 CC(C)(C(N)=O)c1ccc(F)cc1 Amb26907409 [0,0,1,0,1,0|0,1,1]=4 401 B13R1.522 CC(C)(C(N)=O)c1ccc(N)cc1 Amb18934097 [0,0,1,0,1,0|1,0,1]=4 402 B13R1.522 CC(C)(C(N)=S)c1ccc(N)cc1 Amb27455518 [0,0,1,0,1,0|1,1,0]=4 403 B13R1.522 CC(N)(C(=O)O)c1ccc(Br)cc1 Amb3941854 [0,0,1,0,1,0|2,0,0]=4 404 B13R1.522 CC(N)(C(N)=O)c1ccc(Br)cc1 Amb18281152 [0,0,1,0,1,0|1,0,1]=4 405 B13R1.522 C[C@](O)(C(=O)O)c1ccc(Br)cc1 Amb27252998 [0,0,1,0,1,0|2,0,0]=4 406 B13R1.522 Cc1ccc(C(C)(C)C(=O)O)cc1 Amb7089068 [0,0,1,0,1,0|2,0,0]=4 407 B13R1.522 Cc1ccc(C(C)(C)C(N)=O)cc1 Amb26585201 [0,0,1,0,1,0|1,0,1]=4 408 B13R2.11 Cc1cc(C2COC(N)=N2)cs1 Amb27226422 [1,0,0,0,1,0|2,0,0]=4 409 B13R2.11 Cc1ccc(C2COC(N)=N2)s1 Amb27393765 [1,0,0,0,1,0|2,0,0]=4 410 B13R2.11 NC1=NC(c2ccc(Br)s2)CO1 Amb27462669 [1,0,0,0,1,0|1,0,0]=3 411 B13R2.146 O=C1CCC1c2ccc(Br)cc2 Amb28348621 [1,0,0,0,1,0|2,0,0]=4 412 B13R2.147 NC1CC(c2ccc(Br)cc2)C1 Amb19373627 [1,0,0,0,1,0|1,0,1]=4 413 B13R2.147 NC1CC(c2ccc(Br)cc2)C1 Amb9497087 [1,0,0,0,1,0|1,0,1]=4 414 B13R2.147 N[C@H]1C[C@H](c2ccc(Br)cc2)C1 Amb26353092 [1,0,0,0,1,0|1,0,1]=4 415 B13R2.147 N[C@H]1C[C@H](c2ccc(Br)cc2)C1 Amb33473590 [1,0,0,0,1,0|1,0,1]=4 416 B13R2.147 O=C1CC(c2ccc(Br)cc2)C1 Amb9774975 [1,0,0,0,1,0|2,0,0]=4 417 B13R2.147 O=C1CC(c2ccc(Br)cc2)N1 Amb33546351 [1,0,0,0,1,0|1,0,1]=4 418 B13R2.238 CC1(c2ccccc2)CC(=O)C1 Amb19373258 [1,0,0,0,1,0|2,0,0]=4 419 B13R2.238 CC1(c2ccccc2)CC(N)C1 Amb19373291 [1,0,0,0,1,0|1,0,1]=4 420 B13R2.238 CC1(c2ccccc2)CC(N)C1 Amb27770642 [1,0,0,0,1,0|1,0,1]=4 421 B13R2.413 CC1(c2ccccc2)CCC1=O Amb22496413 [1,0,0,0,1,0|2,0,0]=4 422 B13R2.413 CC1(c2ccccc2)CCC1N Amb27784417 [1,0,0,0,1,0|1,0,1]=4 423 B13R2.413 CC1(c2ccccc2)CNC1=O Amb26007017 [1,0,0,0,1,0|2,0,0]=4 424 B13R2.413 C[C@]1(c2ccccc2)CCC1=O Amb27389318 [1,0,0,0,1,0|2,0,0]=4 425 B13R2.2986 CC1(c2ccc(Br)cc2)CCC1 Amb25248550 [1,0,0,0,1,0|1,0,1]=4 426 B13R2.2986 CC1(c2ccc(Br)cc2)CCN1 Amb27859770 [1,0,0,0,1,0|0,0,2]=4 427 B13R2.2986 CC1(c2ccc(Br)cc2)CCO1 Amb25292728 [1,0,0,0,1,0|1,0,1]=4 428 B13R2.2986 CC1(c2ccc(Br)cc2)CNC1 Amb18070096 [1,0,0,0,1,0|1,0,1]=4 429 B13R2.2986 CC1(c2ccc(Br)cc2)CNC1 Amb32670788 [1,0,0,0,1,0|1,0,1]=4 430 B13R2.2986 CC1(c2ccc(Br)cc2)COC1 Amb22737356 [1,0,0,0,1,0|0,0,1]=3 431 B13R2.2986 CC1(c2ccc(N)cc2)COC1 Amb22388447 [1,0,0,0,1,0|1,0,1]=4 432 B13R2.2986 NC1(c2ccc(Br)cc2)COC1 Amb19893279 [1,0,0,0,1,0|1,0,1]=4 433 B13R2.2986 NC1(c2ccc(Br)cc2)COC1 Amb26406084 [1,0,0,0,1,0|1,0,1]=4 434 B13R2.2986 OC1(c2ccc(Br)cc2)COC1 Amb22386872 [1,0,0,0,1,0|1,0,1]=4 435 B13R2.2987 CC1(c2ccc(Br)cn2)CC1N Amb35676746 [0,0,0,0,2,0|1,0,1]=4 436 B13R2.2987 CC1(c2ccc(Cl)cc2)CC1N Amb18280086 [0,0,0,0,2,0|0,1,1]=4 437 B13R2.2987 CC1(c2ccc(F)cc2)CC1N Amb18947384 [0,0,0,0,2,0|0,1,1]=4 438 B13R2.2987 CC1(c2ccc(F)cc2)CC1N Amb33550664 [0,0,0,0,2,0|0,1,1]=4 439 B15R1.11336 CC(C)(CC(=O)O)Cc1ccc(Br)cc1 Amb17364052 [0,0,1,0,0,1|2,0,0]=4 440 B15R1.11336 CC(C)(CC(=O)O)Nc1ccc(Br)cc1 Amb35586449 [0,0,1,0,0,1|2,0,0]=4 441 B15R1.11336 CC(C)(CC(=O)O)Oc1ccc(Br)cc1 Amb17276807 [0,0,1,0,0,1|2,0,0]=4 442 B15R2.98 Cc1ccc(CC2COC(N)=N2)cc1 Amb27413652 [1,0,0,0,0,1|1,0,0]=3 443 B15R2.98 NC1=NC(Cc2ccc(F)cc2)CO1 Amb27169139 [1,0,0,0,0,1|0,1,0]=3 444 B15R2.98 NC1=NC(Cc2ccc(O)cc2)CS1 Amb28118481 [1,0,0,0,0,1|1,1,0]=4 445 B15R2.98 NC1=N[C@@H](Cc2ccc(F)cc2)CO1 Amb28204006 [1,0,0,0,0,1|0,1,0]=3 446 B15R2.98 NC1=N[C@H](Cc2ccc(O)cc2)CS1 Amb27248430 [1,0,0,0,0,1|1,1,0]=4 447 B15R2.1113 CC1(c2ccccc2)COCC(=O)N1 Amb24454773 [1,0,0,0,0,1|1,0,1]=4 448 B15R2.4086 CC1(Cc2ccccc2)CN=C(N)N1 Amb27871879 [1,0,0,0,0,1|1,0,1]=4 449 B15R2.4086 C[C@@]1(Cc2ccccc2)COC(=O)N1 Amb27841747 [1,0,0,0,0,1|1,0,1]=4 450 B15R2.4086 C[N+]1(Cc2ccccc2)CCC(N)=N1 Amb27484868 [1,0,0,0,0,1|2,0,0]=4 451 B15R2.4086 NC1=NP(=O)(Oc2ccccc2)CO1 Amb27631326 [1,0,0,0,0,1|2,0,0]=4