0 B12R2.18 Cc1[n+](c2ccccc2s1)C CUR-0100063 [0,0,0,0,0,0|3,0,1]=4 1 B12R2.18 Cc1c([nH]c2c1cccc2)C CUR-0102255 [0,0,0,0,0,0|3,0,0]=3 2 B12R2.18 Cc1nc2ccccc2n1C CUR-0101100 [0,0,0,0,0,0|2,0,1]=3 3 B12R2.18 Cn1c2ccccc2nc1Cl CUR-0099879 [0,0,0,0,0,0|2,0,1]=3 4 B12R2.18 Cn1c2ccccc2sc1=N CUR-0098047 [0,0,0,0,0,0|3,0,0]=3 5 B12R2.18 c1ccc2c(c1)C(=O)C(=O)N2 CUR-0016414 [0,0,0,0,0,0|1,0,1]=2 6 B11R2.1 c1ccc2c(c1)c(=O)s[nH]2 CUR-0122526 [1,0,0,0,0,0|2,0,1]=4 7 B11R2.1 c1ccc2c(c1)nnn2O CUR-0015141 [1,0,0,0,0,0|1,0,1]=3 8 B11R2.1 c1ccc2c(c1)nnn2O CUR-0102463 [1,0,0,0,0,0|1,0,1]=3 9 B11R2.10 CC1Cc2ccccc2N1 CUR-0102021 [1,0,0,0,0,0|2,0,1]=4 10 B11R2.10 Cc1[nH]c2ccccc2n1 CUR-0005431 [1,0,0,0,0,0|1,0,1]=3 11 B11R2.10 Cc1cc2ccccc2[nH]1 CUR-0101978 [1,0,0,0,0,0|2,0,0]=3 12 B11R2.10 Cc1cc2ccccc2s1 CUR-0099928 [1,0,0,0,0,0|3,0,0]=4 13 B11R2.10 Cc1nc2ccccc2s1 CUR-0003139 [1,0,0,0,0,0|2,0,1]=4 14 B11R2.10 c1cc2c([nH]c(=O)[nH]2)nc1 CUR-0118814 [1,0,0,0,0,0|1,0,0]=2 15 B11R2.10 c1cc2c([nH]c(=O)s2)nc1 CUR-0123939 [1,0,0,0,0,0|2,0,0]=3 16 B11R2.10 c1ccc2c(c1)CC(=O)C2 CUR-0101992 [1,0,0,0,0,0|2,0,0]=3 17 B11R2.10 c1ccc2c(c1)CC(=O)N2 CUR-0102010 [1,0,0,0,0,0|1,0,0]=2 18 B11R2.10 c1ccc2c(c1)[nH]c(=O)[nH]2 CUR-0095698 [1,0,0,0,0,0|0,0,0]=1 19 B11R2.10 c1ccc2c(c1)[nH]c(=O)s2 CUR-0095959 [1,0,0,0,0,0|1,0,0]=2 20 B11R2.10 c1ccc2c(c1)[nH]c(n2)Cl CUR-0102447 [1,0,0,0,0,0|1,0,1]=3 21 B11R2.10 c1ccc2c(c1)[nH]c(n2)N CUR-0102013 [1,0,0,0,0,0|1,0,1]=3 22 B11R2.10 c1ccc2c(c1)[nH]c(n2)S CUR-0022978 [1,0,0,0,0,0|0,1,1]=3 23 B11R2.10 c1ccc2c(c1)nc(o2)Cl CUR-0102470 [1,0,0,0,0,0|2,0,1]=4 24 B11R2.10 c1ccc2c(c1)nc(o2)N CUR-0107958 [1,0,0,0,0,0|2,0,1]=4 25 B11R2.10 c1ccc2c(c1)nc(o2)S CUR-0019538 [1,0,0,0,0,0|1,1,1]=4 26 B11R2.10 c1ccc2c(c1)nc(s2)Cl CUR-0097725 [1,0,0,0,0,0|2,0,1]=4 27 B11R2.10 c1ccc2c(c1)nc(s2)N CUR-0102375 [1,0,0,0,0,0|2,0,1]=4 28 B11R2.10 c1ccc2c(c1)nc(s2)S CUR-0004791 [1,0,0,0,0,0|1,1,1]=4 29 B13R2.45 Cn1c2ccccc2nc1C=O CUR-0095820 [0,1,0,0,0,0|1,0,1]=3 30 B13R2.45 Cn1c2ccccc2nc1CN CUR-0100631 [0,1,0,0,0,0|2,0,1]=4 31 B13R2.45 Cn1c2ccccc2nc1CO CUR-0095833 [0,1,0,0,0,0|1,0,2]=4 32 B13R2.135 CCn1c2ccccc2nc1S CUR-0096042 [0,1,0,0,0,0|1,1,1]=4 33 B13R2.135 CCn1c2ccccc2sc1=N CUR-0098282 [0,1,0,0,0,0|3,0,0]=4 34 B13R2.3028 Cc1ccc2c(c1)C(=O)C(=O)N2 CUR-0095509 [0,1,0,0,0,0|1,0,1]=3 35 B13R2.3028 c1cc2c(cc1Br)C(=O)C(=O)N2 CUR-0103742 [0,1,0,0,0,0|1,0,1]=3 36 B13R2.3028 c1cc2c(cc1Cl)C(=O)C(=O)N2 CUR-0101084 [0,1,0,0,0,0|1,0,1]=3 37 B13R2.3028 c1cc2c(cc1F)C(=O)C(=O)N2 CUR-0101371 [0,1,0,0,0,0|1,0,1]=3 38 B13R2.3085 CN1c2ccccc2C(=O)C1=O CUR-0095689 [0,1,0,0,0,0|1,0,1]=3 39 B13R2.4825 Cc1cccc2c1NC(=O)C2=O CUR-0016456 [0,1,0,0,0,0|1,0,1]=3 40 B13R2.4856 Cn1c2c(cccc2sc1=N)F CUR-0098272 [0,1,0,0,0,0|3,0,0]=4 41 B13R2.5190 CN1c2ccc(cc2CC1=O)N CUR-0089230 [0,1,0,0,0,0|2,0,0]=3 42 B13R2.5190 Cn1c2ccc(cc2nc1N)Br CUR-0033243 [0,1,0,0,0,0|2,0,1]=4 43 B13R2.5190 Cn1c2ccc(cc2sc1=N)Br CUR-0096286 [0,1,0,0,0,0|3,0,0]=4 44 B13R2.5190 Cn1c2ccc(cc2sc1=N)Cl CUR-0003827 [0,1,0,0,0,0|3,0,0]=4 45 B13R2.5190 Cn1c2ccc(cc2sc1=N)F CUR-0098114 [0,1,0,0,0,0|3,0,0]=4 46 B13R2.5190 c1cc2c(cc1Cl)NC(=O)C2=O CUR-0099953 [0,1,0,0,0,0|1,0,1]=3 47 B13R2.5190 c1cc2c(cc1F)NC(=O)C2=O CUR-0002672 [0,1,0,0,0,0|1,0,1]=3 48 B11R1.36 CC(=O)C(c1ccccc1)Br CUR-0122545 [0,0,1,0,0,0|3,0,0]=4 49 B11R1.36 CC(c1ccccc1)C(=O)O CUR-0102369 [0,0,1,0,0,0|3,0,0]=4 50 B11R1.36 c1ccc(cc1)C(C(=O)N)Cl CUR-0017900 [0,0,1,0,0,0|2,0,0]=3 51 B11R1.36 c1ccc(cc1)C(C(=O)O)N CUR-0009918 [0,0,1,0,0,0|3,0,0]=4 52 B11R1.36 c1ccc(cc1)C(C(=O)O)O CUR-0102425 [0,0,1,0,0,0|2,0,0]=3 53 B11R1.36 c1ccc(cc1)[C@H](C(=O)O)O CUR-0101108 [0,0,1,0,0,0|2,0,0]=3 54 B11R1.40 CNC(=S)Nc1ccccc1 CUR-0079179 [0,0,1,0,0,0|1,1,0]=3 55 B11R1.40 c1cc(cnc1)NC(=O)CCl CUR-0027624 [0,0,1,0,0,0|3,0,0]=4 56 B11R1.40 c1ccc(cc1)CC(=O)CO CUR-0026508 [0,0,1,0,0,0|2,0,0]=3 57 B11R1.40 c1ccc(cc1)C\C(=N\O)\N CUR-0097985 [0,0,1,0,0,0|2,0,1]=4 58 B11R1.40 c1ccc(cc1)NC(=O)CN CUR-0099867 [0,0,1,0,0,0|2,0,0]=3 59 B11R1.40 c1ccc(cc1)NC(=S)NN CUR-0022762 [0,0,1,0,0,0|1,1,0]=3 60 B13R2.328 Cc1cc(=O)c2ccccc2[nH]1 CUR-0100838 [0,0,0,0,0,1|2,0,1]=4 61 B13R2.328 c1ccc2c(c1)CC(=O)OC2=O CUR-0102648 [0,0,0,0,0,1|2,0,1]=4 62 B13R2.328 c1ccc2c(c1)c(=O)[nH]c(=O)[nH]2 CUR-0012116 [0,0,0,0,0,1|1,0,1]=3 63 B13R2.328 c1ccc2c(c1)c(=O)oc(=O)[nH]2 CUR-0102683 [0,0,0,0,0,1|1,0,1]=3 64 B13R2.328 c1ccc2c(c1)c(cc(=O)[nH]2)O CUR-0018472 [0,0,0,0,0,1|1,0,0]=2 65 B13R2.328 c1ccc2c(c1)c(cc(=O)o2)O CUR-0012673 [0,0,0,0,0,1|2,0,0]=3 66 B13R2.369 CC1C(=O)Oc2ccccc2O1 CUR-0020581 [0,0,0,0,0,1|3,0,0]=4 67 B13R2.369 c1cc2c([nH]c(=O)c(=O)[nH]2)nc1 CUR-0099916 [0,0,0,0,0,1|2,0,1]=4 68 B13R2.369 c1ccc2c(c1)cc(c(=O)o2)N CUR-0097539 [0,0,0,0,0,1|3,0,0]=4 69 B13R2.369 c1ccc2c(c1)nc(c(n2)O)O CUR-0027724 [0,0,0,0,0,1|1,0,2]=4 70 B13R2.369 c1ccc2cc(c(cc2c1)O)O CUR-0102612 [0,0,0,0,0,1|2,0,1]=4 71 B10R1.15 CC(C=O)c1ccccc1 CUR-0102035 [1,0,1,0,0,0|2,0,0]=4 72 B10R1.15 CN(C=O)c1ccccc1 CUR-0102052 [1,0,1,0,0,0|1,0,0]=3 73 B10R1.18 CC(=O)Nc1ccccc1 CUR-0023816 [1,0,1,0,0,0|1,0,0]=3 74 B10R1.18 c1cc(cnc1)CC(=O)O CUR-0008193 [1,0,1,0,0,0|2,0,0]=4 75 B10R1.18 c1cc(cnc1)CC(=O)O CUR-0102936 [1,0,1,0,0,0|2,0,0]=4 76 B10R1.18 c1cc(cnc1)NC(=S)N CUR-0002363 [1,0,1,0,0,0|1,1,0]=4 77 B10R1.18 c1ccc(cc1)CC(=O)Cl CUR-0102510 [1,0,1,0,0,0|2,0,0]=4 78 B10R1.18 c1ccc(cc1)CC(=O)N CUR-0023680 [1,0,1,0,0,0|1,0,0]=3 79 B10R1.18 c1ccc(cc1)NC(=N)N CUR-0098795 [1,0,1,0,0,0|1,0,0]=3 80 B10R1.18 c1ccc(cc1)NC(=S)N CUR-0002897 [1,0,1,0,0,0|0,1,0]=3 81 B10R1.18 c1ccc(cc1)OC(=O)Cl CUR-0102546 [1,0,1,0,0,0|2,0,0]=4 82 B10R1.18 c1cnccc1CC(=O)O CUR-0012283 [1,0,1,0,0,0|2,0,0]=4 83 B10R1.18 c1cnccc1NC(=S)N CUR-0102469 [1,0,1,0,0,0|1,1,0]=4 84 B10R1.17 c1ccc(cc1)NCCO CUR-0102101 [1,0,1,0,0,0|1,0,1]=4 85 B10R1.4 C=CCc1ccccc1O CUR-0020961 [1,0,1,0,0,0|2,0,0]=4 86 B10R1.20 COc1ccccc1C=O CUR-0101243 [1,0,1,0,0,0|2,0,0]=4 87 B10R1.61 Cc1ccccc1C(=O)O CUR-0016076 [1,0,1,0,0,0|2,0,0]=4 88 B10R1.61 c1cc(c(nc1)N)C(=O)O CUR-0029106 [1,0,1,0,0,0|2,0,0]=4 89 B10R1.61 c1ccc(c(c1)C(=O)N)N CUR-0102070 [1,0,1,0,0,0|2,0,0]=4 90 B10R1.61 c1ccc(c(c1)C(=O)O)Br CUR-0103453 [1,0,1,0,0,0|2,0,0]=4 91 B10R1.61 c1ccc(c(c1)C(=O)O)Cl CUR-0100755 [1,0,1,0,0,0|2,0,0]=4 92 B10R1.61 c1ccc(c(c1)C(=O)O)F CUR-0100763 [1,0,1,0,0,0|2,0,0]=4 93 B10R1.61 c1ccc(c(c1)C(=O)O)I CUR-0026358 [1,0,1,0,0,0|2,0,0]=4 94 B10R1.61 c1ccc(c(c1)C(=O)O)O CUR-0018701 [1,0,1,0,0,0|2,0,0]=4 95 B10R1.61 c1ccc(c(c1)C(=O)O)S CUR-0102494 [1,0,1,0,0,0|2,0,0]=4 96 B10R1.61 c1ccc(c(c1)N)[N+](=O)[O-] CUR-0016319 [1,0,1,0,0,0|0,0,2]=4 97 B10R2.7 c1ccc2c(c1)CC=C2 CUR-0101760 [2,0,0,0,0,0|2,0,0]=4 98 B10R2.7 c1ccc2c(c1)CCN2 CUR-0004344 [2,0,0,0,0,0|1,0,1]=4 99 B10R2.7 c1ccc2c(c1)[nH]cn2 CUR-0001355 [2,0,0,0,0,0|0,0,1]=3 100 B10R2.7 c1ccc2c(c1)[nH]cn2 CUR-0100600 [2,0,0,0,0,0|0,0,1]=3 101 B10R2.7 c1ccc2c(c1)[nH]nn2 CUR-0006438 [2,0,0,0,0,0|1,0,1]=4 102 B10R2.7 c1ccc2c(c1)cc[nH]2 CUR-0100766 [2,0,0,0,0,0|1,0,0]=3 103 B10R2.7 c1ccc2c(c1)ncs2 CUR-0016195 [2,0,0,0,0,0|1,0,1]=4 104 B12R1.20 CC(=O)N(C)c1ccc(cc1)O CUR-0098675 [0,1,1,0,0,0|2,0,0]=4 105 B12R1.34 CNC(=O)C(c1ccccc1)Cl CUR-0075715 [0,1,1,0,0,0|2,0,0]=4 106 B12R1.43 c1cc(cnc1)NC(=O)C(=O)O CUR-0064248 [0,1,1,0,0,0|2,0,0]=4 107 B12R1.43 c1ccc(cc1)NC(=O)C(=O)O CUR-0012601 [0,1,1,0,0,0|1,0,0]=3 108 B12R1.43 c1ccnc(c1)NC(=O)C(=O)O CUR-0031930 [0,1,1,0,0,0|2,0,0]=4 109 B12R1.49 Cc1ccc(cc1)NC(=O)CCl CUR-0096456 [0,1,1,0,0,0|2,0,0]=4 110 B12R1.49 c1cc(ccc1NC(=O)CCl)Cl CUR-0096454 [0,1,1,0,0,0|2,0,0]=4 111 B12R1.49 c1cc(ccc1NC(=O)CCl)F CUR-0099682 [0,1,1,0,0,0|2,0,0]=4 112 B12R1.49 c1cc(ccc1NC(=O)CN)Br CUR-0095790 [0,1,1,0,0,0|2,0,0]=4 113 B12R1.50 Cc1cccc(c1)NC(=O)CCl CUR-0100112 [0,1,1,0,0,0|2,0,0]=4 114 B12R1.371 c1ccc(c(c1)NC(=O)CCl)F CUR-0099715 [0,1,1,0,0,0|2,0,0]=4 115 B12R2.1 c1ccc2c(c1)c(c[nH]2)C=O CUR-0095950 [1,1,0,0,0,0|1,0,1]=4 116 B12R2.1 c1ccc2c(c1)c(c[nH]2)CN CUR-0040048 [1,1,0,0,0,0|2,0,0]=4 117 B12R2.1 c1ccc2c(c1)c(c[nH]2)CN CUR-0100709 [1,1,0,0,0,0|2,0,0]=4 118 B12R2.1 c1ccc2c(c1)nnn2CO CUR-0029154 [1,1,0,0,0,0|1,0,1]=4 119 B12R2.612 Cn1cnc2c1ccc(c2)O CUR-0097669 [1,1,0,0,0,0|1,0,1]=4 120 B12R2.32 CCc1[nH]c2ccccc2n1 CUR-0101197 [1,1,0,0,0,0|1,0,1]=4 121 B12R2.32 c1ccc2c(c1)[nH]c(n2)CCl CUR-0095660 [1,1,0,0,0,0|1,0,1]=4 122 B12R2.32 c1ccc2c(c1)[nH]c(n2)CN CUR-0103054 [1,1,0,0,0,0|1,0,1]=4 123 B12R2.32 c1ccc2c(c1)[nH]c(n2)CO CUR-0029231 [1,1,0,0,0,0|0,0,2]=4 124 B12R2.32 c1ccc2c(c1)[nH]c(n2)NN CUR-0095866 [1,1,0,0,0,0|1,0,1]=4 125 B12R2.606 Cc1cc2cc(ccc2[nH]1)O CUR-0099134 [1,1,0,0,0,0|2,0,0]=4 126 B12R2.606 Cc1ccc2c(c1)nc([nH]2)S CUR-0096449 [1,1,0,0,0,0|0,1,1]=4 127 B12R2.606 c1c(cnc2c1NC(=O)C2)Br CUR-0139949 [1,1,0,0,0,0|2,0,0]=4 128 B12R2.606 c1cc2=NC(=O)N=c2cc1N CUR-0102297 [1,1,0,0,0,0|0,0,2]=4 129 B14R2.7724 Cn1c2ccccc2c(=O)oc1=O CUR-0096393 [0,1,0,0,0,1|2,0,0]=4 130 B14R2.8188 Cn1c2c(cccn2)[nH]c(=O)c1=O CUR-0099915 [0,1,0,0,0,1|2,0,0]=4 131 B14R2.29369 CN1c2ccc(cc2CCC1=O)N CUR-0012081 [0,1,0,0,0,1|2,0,0]=4 132 B14R2.8045 c1cc2c(c(c1)Cl)[nH]c(=O)oc2=O CUR-0096931 [0,1,0,0,0,1|1,0,1]=4 133 B14R2.8235 Cc1ccc2c(c1)c(=O)oc(=O)[nH]2 CUR-0011188 [0,1,0,0,0,1|1,0,1]=4 134 B14R2.8235 c1cc2c(cc1Br)c(=O)[nH]c(=O)[nH]2 CUR-0121763 [0,1,0,0,0,1|1,0,1]=4 135 B14R2.8235 c1cc2c(cc1Br)c(=O)oc(=O)[nH]2 CUR-0013789 [0,1,0,0,0,1|1,0,1]=4 136 B14R2.8235 c1cc2c(cc1Cl)c(=O)oc(=O)[nH]2 CUR-0095409 [0,1,0,0,0,1|1,0,1]=4 137 B14R2.29365 Cc1cc(=O)[nH]c2c1ccc(c2)N CUR-0095524 [0,1,0,0,0,1|2,0,0]=4 138 B14R2.1128 CCC1C(=O)Nc2ccccc2O1 CUR-0011069 [0,1,0,0,0,1|2,0,0]=4 139 B14R2.1128 c1ccc2c(c1)cc(c(=O)[nH]2)C=O CUR-0095582 [0,1,0,0,0,1|1,0,1]=4 140 B14R2.450 Cn1c2ccccc2cc1C(=O)O CUR-0102978 [0,2,0,0,0,0|2,0,0]=4 141 B14R2.517 c1ccc2c(c1)nc(n2CCO)Cl CUR-0096426 [0,2,0,0,0,0|1,0,1]=4 142 B14R2.642 CC(=C)n1c2ccccc2[nH]c1=O CUR-0095653 [0,2,0,0,0,0|1,0,0]=3 143 B14R2.4217 CCN1c2ccc(cc2CC1=O)N CUR-0027882 [0,2,0,0,0,0|2,0,0]=4 144 B14R2.19306 CCN1c2ccccc2C(=O)C1=O CUR-0095595 [0,2,0,0,0,0|1,0,1]=4 145 B14R2.19306 c1ccc2c(c1)C(=O)C(=O)N2CO CUR-0095586 [0,2,0,0,0,0|1,0,0]=3 146 B14R2.645 c1c2c(cc(c1F)Cl)NC(=O)C2=O CUR-0098652 [0,2,0,0,0,0|1,0,1]=4 147 B14R2.3274 COc1ccc2c(c1)C(=O)C(=O)N2 CUR-0095867 [0,2,0,0,0,0|1,0,1]=4 148 B14R2.4506 c1cc(c(c2c1NC(=O)C2=O)Cl)F CUR-0098606 [0,2,0,0,0,0|1,0,1]=4 149 B14R2.8716 CN1c2ccc(cc2C(=O)C1=O)Br CUR-0095619 [0,2,0,0,0,0|1,0,1]=4 150 B14R2.8716 CN1c2ccc(cc2C(=O)C1=O)Cl CUR-0096797 [0,2,0,0,0,0|1,0,1]=4 151 B14R2.9184 c1c(cc(c2c1C(=O)C(=O)N2)Cl)Cl CUR-0095382 [0,2,0,0,0,0|1,0,1]=4 152 B14R2.28485 CN1c2c(cccc2Cl)C(=O)C1=O CUR-0097698 [0,2,0,0,0,0|1,0,1]=4 153 B14R2.8620 Cc1ccc(c2c1C(=O)C(=O)N2)C CUR-0095982 [0,2,0,0,0,0|1,0,1]=4 154 B14R2.8620 c1cc(c2c(c1Cl)C(=O)C(=O)N2)Cl CUR-0095826 [0,2,0,0,0,0|1,0,1]=4 155 B14R2.8737 Cc1ccc2c(c1C)NC(=O)C2=O CUR-0095909 [0,2,0,0,0,0|1,0,1]=4 156 B14R2.27750 c1c(cc(c2c1NC(=O)C2=O)Cl)F CUR-0090738 [0,2,0,0,0,0|1,0,1]=4 157 B14R2.1815 COc1ccc2c(c1)NC(=O)C2=O CUR-0113286 [0,2,0,0,0,0|1,0,1]=4 158 B12R2.24 c1ccc2c(c1)CC(=O)NC2 CUR-0120672 [0,0,1,1,0,0|2,0,0]=4 159 B12R2.24 c1ccc2c(c1)CCC(=O)N2 CUR-0014024 [0,0,1,1,0,0|2,0,0]=4 160 B12R2.24 c1ccc2c(c1)OCC(=O)O2 CUR-0015502 [0,0,1,1,0,0|2,0,0]=4 161 B12R2.24 c1ccc2c(c1)[nH]c(=O)cn2 CUR-0102273 [0,0,1,1,0,0|2,0,0]=4 162 B12R1.27 c1ccc(cc1)CNC(=O)CCl CUR-0095549 [0,0,1,0,0,1|2,0,0]=4 163 B12R1.27 c1ccc(cc1)OCC(=O)NN CUR-0037772 [0,0,1,0,0,1|2,0,0]=4 164 B14R2.738 CC1=Nc2ccccc2NC(=O)C1 CUR-0011405 [0,0,0,0,0,2|2,0,0]=4 165 B14R2.738 CC1CC(=O)Nc2ccccc2N1 CUR-0095514 [0,0,0,0,0,2|2,0,0]=4