0 B22R3.253815 Brc1ccccc1C(=O)Nc2ccc3ncccc3c2 CSC046145815 [0,0,0,0,0,0|3,0,0]=3 1 B22R3.253815 Cc1ccccc1C(=O)Nc2ccc3ccccc3c2 CSC048018866 [0,0,0,0,0,0|2,0,0]=2 2 B22R3.253815 Clc1ccccc1C(=O)Nc2ccc3ccccc3c2 CSC046220904 [0,0,0,0,0,0|2,0,0]=2 3 B22R3.253815 Clc1ccccc1C(=O)Nc2cnc3ccccc3c2 CSC046211119 [0,0,0,0,0,0|3,0,0]=3 4 B22R3.253815 Fc1ccccc1C(=O)Nc2ccc3ccccc3c2 CSC046160080 [0,0,0,0,0,0|2,0,0]=2 5 B22R3.253815 Fc1ccccc1C(=O)Nc2ccc3ncccc3c2 CSC031361389 [0,0,0,0,0,0|3,0,0]=3 6 B22R3.253815 Ic1ccccc1C(=O)Nc2ccc3ccccc3c2 CSC045774333 [0,0,0,0,0,0|2,0,0]=2 7 B22R3.253815 Oc1ccccc1C(=O)Nc2ccc3ccccc3n2 CSC046236571 [0,0,0,0,0,0|3,0,0]=3 8 B21R3.24492 O=C(Nc1ccc2ccccc2c1)c3ccccc3 CSC037904660 [1,0,0,0,0,0|1,0,0]=2 9 B21R3.24492 O=C(Nc1ccc2ccccc2c1)c3cccnc3 CSC046118136 [1,0,0,0,0,0|2,0,0]=3 10 B21R3.24492 O=C(Nc1ccc2ccccc2c1)c3ccncc3 CSC046147956 [1,0,0,0,0,0|2,0,0]=3 11 B21R3.24492 O=C(Nc1ccc2ccccc2n1)c3ccccc3 CSC046121142 [1,0,0,0,0,0|2,0,0]=3 12 B21R3.24492 O=C(Nc1ccc2ncccc2c1)c3cccnc3 CSC046879065 [1,0,0,0,0,0|3,0,0]=4 13 B21R3.24492 O=C(Nc1ccc2ncccc2c1)c3ccncc3 CSC046872183 [1,0,0,0,0,0|3,0,0]=4 14 B21R3.24492 O=C(Nc1ccc2nccnc2c1)c3ccccc3 CSC038461891 [1,0,0,0,0,0|3,0,0]=4 15 B21R3.24492 O=C(Nc1cnc2ccccc2c1)c3ccccn3 CSC046210428 [1,0,0,0,0,0|3,0,0]=4 16 B21R3.24492 O=C(Oc1ccc2ccccc2c1)c3ccccc3 CSC000016185 [1,0,0,0,0,0|0,0,0]=1 17 B21R3.24492 O=C(Oc1ccc2ccccc2c1)c3cccnc3 CSC046608287 [1,0,0,0,0,0|1,0,0]=2 18 B21R3.24492 O=C(Oc1ccc2ccccc2c1)c3ccncc3 CSC046088853 [1,0,0,0,0,0|1,0,0]=2 19 B21R3.24492 O=C(Oc1ccc2nccnc2c1)c3ccccc3 CSC046408596 [1,0,0,0,0,0|2,0,0]=3 20 B21R3.24492 O=C(Oc1ccc2nccnc2c1)c3cccnc3 CSC046100216 [1,0,0,0,0,0|3,0,0]=4 21 B23R3.168032 Cc1cc(ccc1C(=O)Nc2ccc3ccccc3c2)F CSC046413759 [0,1,0,0,0,0|2,0,0]=3 22 B23R3.168032 Cc1ccc(c(c1)C)C(=O)Nc2ccc3ccccc3c2 CSC046656425 [0,1,0,0,0,0|2,0,0]=3 23 B23R3.168032 Fc1cc(ccc1C(=O)Nc2ccc3ccccc3c2)Br CSC046212648 [0,1,0,0,0,0|2,0,0]=3 24 B23R3.168032 Fc1cc(ccc1C(=O)Nc2ccc3ccccc3c2)Cl CSC047899159 [0,1,0,0,0,0|2,0,0]=3 25 B23R3.168032 Nc1ccc(c(c1)Cl)C(=O)Nc2ccc3ccccc3c2 CSC046225590 [0,1,0,0,0,0|2,0,0]=3 26 B23R3.809925 Clc1cccc(c1C(=O)Nc2ccc3ccccc3n2)Cl CSC046089438 [0,1,0,0,0,0|3,0,0]=4 27 B23R3.823020 Cc1ccc(c(c1)C(=O)Nc2ccc3ccccc3c2)C CSC048190333 [0,1,0,0,0,0|2,0,0]=3 28 B23R3.823020 Clc1ccc(c(c1)C(=O)Nc2ccc3ncccc3c2)Cl CSC046168113 [0,1,0,0,0,0|3,0,0]=4 29 B23R3.2054088 COc1ccccc1C(=O)Oc2ccc3ccccc3c2 CSC048222078 [0,1,0,0,0,0|1,0,0]=2 30 B23R3.2054088 CSc1ccccc1C(=O)Nc2ccc3ccccc3c2 CSC046398706 [0,1,0,0,0,0|2,0,0]=3 31 B23R3.7978075 Brc1ccccc1C(=O)Nc2ccc3oc(=O)ccc3c2 CSC046112529 [0,1,0,0,0,0|3,0,0]=4 32 B23R3.7978075 Cc1ccccc1C(=O)Nc2ccc3oc(=O)ccc3c2 CSC046083668 [0,1,0,0,0,0|3,0,0]=4 33 B23R3.7978075 Clc1ccccc1C(=O)Nc2ccc3oc(=O)ccc3c2 CSC047688106 [0,1,0,0,0,0|3,0,0]=4 34 B23R3.7978075 Fc1ccccc1C(=O)Nc2ccc3oc(=O)ccc3c2 CSC046242144 [0,1,0,0,0,0|3,0,0]=4 35 B23R3.7978075 Ic1ccccc1C(=O)Nc2ccc3oc(=O)ccc3c2 CSC046872888 [0,1,0,0,0,0|3,0,0]=4 36 B23R3.15966213 Cc1ccccc1S(=O)(=O)Nc2ccc3ccccc3c2 CSC047380100 [0,1,0,0,0,0|3,0,0]=4 37 B21R3.169280 Cc1ccoc1C(=O)Nc2ccc3ccccc3c2 CSC046150917 [0,0,0,0,1,0|3,0,0]=4 38 B21R3.169280 Cc1occc1C(=O)Nc2ccc3ccccc3c2 CSC046159342 [0,0,0,0,1,0|3,0,0]=4 39 B23R3.157683 Brc1ccccc1NC(=O)Cc2ccc3ccccc3c2 CSC048490811 [0,0,0,0,0,1|2,0,0]=3 40 B23R3.157683 Cc1ccccc1NC(=O)Cc2ccc3ccccc3c2 CSC046615317 [0,0,0,0,0,1|2,0,0]=3 41 B23R3.157683 Clc1ccccc1NC(=O)Nc2cnc3ccccc3c2 CSC046184479 [0,0,0,0,0,1|3,0,0]=4 42 B23R3.303149 Brc1ccccc1C(=O)NCc2ccc3ccccc3c2 CSC046684452 [0,0,0,0,0,1|2,0,0]=3 43 B23R3.303149 Cc1ccccc1C(=O)NCc2ccc3ccccc3c2 CSC046475832 [0,0,0,0,0,1|2,0,0]=3 44 B23R3.303149 Clc1ccccc1C(=O)NCc2ccc3ccccc3c2 CSC047462156 [0,0,0,0,0,1|2,0,0]=3 45 B23R3.303149 Fc1ccccc1C(=O)NCc2ccc3ccccc3c2 CSC046948092 [0,0,0,0,0,1|2,0,0]=3 46 B23R3.303149 Ic1ccccc1C(=O)NCc2ccc3ccccc3c2 CSC048055599 [0,0,0,0,0,1|2,0,0]=3 47 B20R3.30190 C(Nc1ccc2ccccc2c1)c3ccccc3 CSC000224561 [2,0,0,0,0,0|1,0,1]=4 48 B22R3.46008 Brc1ccc(cc1)C(=O)Nc2ccc3ccccc3c2 CSC049103089 [1,1,0,0,0,0|1,0,0]=3 49 B22R3.46008 Brc1ccc(cc1)C(=O)Nc2ccc3ccccc3n2 CSC047177621 [1,1,0,0,0,0|2,0,0]=4 50 B22R3.46008 Cc1ccc(cc1)C(=O)Nc2ccc3ccccc3c2 CSC048163880 [1,1,0,0,0,0|1,0,0]=3 51 B22R3.46008 Cc1ccc(cc1)C(=O)Nc2ccc3ccccc3n2 CSC046129575 [1,1,0,0,0,0|2,0,0]=4 52 B22R3.46008 Cc1ccc(cc1)C(=O)Nc2ccc3ncccc3c2 CSC046080860 [1,1,0,0,0,0|2,0,0]=4 53 B22R3.46008 Cc1ccc(cc1)C(=O)Oc2ccc3nccnc3c2 CSC046678737 [1,1,0,0,0,0|2,0,0]=4 54 B22R3.46008 Fc1ccc(cc1)C(=O)Nc2ccc3ccccc3c2 CSC046242507 [1,1,0,0,0,0|1,0,0]=3 55 B22R3.46008 Nc1ccc(cc1)C(=O)Nc2ccc3ccccc3c2 CSC045118197 [1,1,0,0,0,0|1,0,0]=3 56 B22R3.242340 O=C(Oc1ccc2ccc(=O)oc2c1)c3ccccc3 CSC046194979 [1,1,0,0,0,0|1,0,0]=3 57 B22R3.242707 O=C(Nc1ccc2oc(=O)ccc2c1)c3ccccc3 CSC046208779 [1,1,0,0,0,0|2,0,0]=4 58 B22R3.707668 Cc1cccc(c1)C(=O)Nc2ccc3ccccc3c2 CSC046172521 [1,1,0,0,0,0|1,0,0]=3 59 B22R3.707668 Cc1cccc(c1)C(=O)Nc2ccc3ncccc3c2 CSC046135771 [1,1,0,0,0,0|2,0,0]=4 60 B22R3.707668 Nc1cccc(c1)C(=O)Nc2ccc3ccccc3c2 CSC040271419 [1,1,0,0,0,0|1,0,0]=3 61 B22R3.5612282 O=S(=O)(Nc1ccc2ccccc2c1)c3ccccc3 CSC042233441 [1,1,0,0,0,0|2,0,0]=4 62 B24R3.2446257 Cc1ccc(c(c1)CC(=O)Nc2ccc3ccccc3c2)C CSC048323194 [0,1,0,0,0,1|2,0,0]=4 63 B24R3.2446257 Cc1ccc(c(c1)NC(=O)Cc2ccc3ccccc3c2)O CSC048117778 [0,1,0,0,0,1|2,0,0]=4 64 B24R3.1330489 COc1ccccc1C(=O)NCc2ccc3ccccc3c2 CSC046176461 [0,1,0,0,0,1|2,0,0]=4 65 B24R3.1330489 CSc1ccccc1C(=O)NCc2ccc3ccccc3c2 CSC047264789 [0,1,0,0,0,1|2,0,0]=4 66 B24R3.2447366 Cc1ccc(c(c1)C(=O)NCc2ccc3ccccc3c2)C CSC046966274 [0,1,0,0,0,1|2,0,0]=4 67 B24R3.2656946 CC(NC(=O)c1ccccc1C)c2ccc3ccccc3c2 CSC046154836 [0,1,0,0,0,1|2,0,0]=4 68 B24R3.2656946 CC(NC(=O)c1ccccc1Cl)c2ccc3ccccc3c2 CSC046689360 [0,1,0,0,0,1|2,0,0]=4 69 B24R3.3149892 Brc1ccccc1C(=O)OCc2cc3ccccc3[nH]c2=O CSC048930659 [0,1,0,0,0,1|2,0,0]=4 70 B24R3.3149892 Cc1ccccc1C(=O)OCc2cc3ccccc3[nH]c2=O CSC046908422 [0,1,0,0,0,1|2,0,0]=4 71 B24R3.3149892 Clc1ccccc1C(=O)OCc2cc3ccccc3[nH]c2=O CSC046839195 [0,1,0,0,0,1|2,0,0]=4 72 B24R3.3149892 Fc1ccccc1C(=O)OCc2cc3ccccc3[nH]c2=O CSC048493298 [0,1,0,0,0,1|2,0,0]=4 73 B24R3.26725364 Cc1ccc(c(c1)C)C(=O)NCc2ccc3ccccc3c2 CSC046467712 [0,1,0,0,0,1|2,0,0]=4 74 B24R3.26725364 Fc1cc(ccc1C(=O)NCc2ccc3ccccc3c2)Cl CSC049075964 [0,1,0,0,0,1|2,0,0]=4 75 B24R3.12033559 Clc1ccc(c(c1)Cl)C(=O)Oc2ccc3ccc(=O)oc3c2 CSC046089992 [0,2,0,0,0,0|2,0,0]=4 76 B24R3.2032056 COc1ccc(cc1C(=O)Nc2ccc3ccccc3c2)Br CSC047766676 [0,2,0,0,0,0|2,0,0]=4 77 B24R3.2032056 COc1ccc(cc1C(=O)Nc2ccc3ccccc3c2)Cl CSC046510066 [0,2,0,0,0,0|2,0,0]=4 78 B24R3.436631 [O-][N+](=O)c1ccccc1C(=O)Oc2ccc3ccccc3c2 CSC020583665 [0,2,0,0,0,0|0,0,1]=3 79 B24R3.525043 CCOc1ccccc1C(=O)Nc2ccc3ccccc3c2 CSC047853973 [0,2,0,0,0,0|2,0,0]=4 80 B24R3.123236146 Cc1cc(=O)oc2c1ccc(c2)OC(=O)c3ccccc3Br CSC046100162 [0,2,0,0,0,0|2,0,0]=4 81 B24R3.123236146 Cc1cc(=O)oc2c1ccc(c2)OC(=O)c3ccccc3Cl CSC046167566 [0,2,0,0,0,0|2,0,0]=4 82 B24R3.123236146 Cc1cc(=O)oc2c1ccc(c2)OC(=O)c3ccccc3F CSC046714425 [0,2,0,0,0,0|2,0,0]=4 83 B24R3.123236146 Cc1cc(=O)oc2c1ccc(c2)OC(=O)c3ccccc3I CSC048108454 [0,2,0,0,0,0|2,0,0]=4 84 B24R3.123236146 Cc1ccccc1C(=O)Oc2ccc3c(cc(=O)oc3c2)C CSC046131215 [0,2,0,0,0,0|2,0,0]=4 85 B22R3.12007 Brc1ccccc1C(=O)Nc2cccc3c2cccc3 CSC046156597 [0,0,1,1,0,0|2,0,0]=4 86 B22R3.12007 Cc1ccccc1C(=O)Nc2cccc3c2cccc3 CSC046097950 [0,0,1,1,0,0|2,0,0]=4 87 B22R3.12007 Fc1ccccc1C(=O)Nc2cccc3c2cccc3 CSC035567795 [0,0,1,1,0,0|2,0,0]=4 88 B22R3.12007 Fc1ccccc1C(=O)Oc2cccc3c2cccc3 CSC046116971 [0,0,1,1,0,0|1,0,0]=3 89 B22R3.12007 Ic1ccccc1C(=O)Nc2cccc3c2cccc3 CSC039736215 [0,0,1,1,0,0|2,0,0]=4 90 B20R3.16108 O=C(Nc1ccc2[nH]ccc2c1)c3ccccc3 CSC003487593 [1,0,0,0,1,0|2,0,0]=4 91 B20R3.16123 O=C(Nc1ccc2ccccc2c1)c3ccco3 CSC000580572 [1,0,0,0,1,0|2,0,0]=4 92 B20R3.16123 O=C(Nc1ccc2ccccc2c1)c3cccs3 CSC000580573 [1,0,0,0,1,0|2,0,0]=4 93 B20R3.16123 O=C(Nc1ccc2ccccc2c1)c3ccsc3 CSC046255631 [1,0,0,0,1,0|2,0,0]=4 94 B22R3.212251 O=C(CSc1ccc2ccccc2n1)c3ccccc3 CSC037717624 [1,0,0,0,0,1|1,1,0]=4 95 B22R3.212251 O=C(NCc1ccc2ccccc2c1)c3ccccc3 CSC048038989 [1,0,0,0,0,1|1,0,0]=3 96 B22R3.212251 O=C(NCc1ccc2ccccc2c1)c3cccnc3 CSC046942751 [1,0,0,0,0,1|2,0,0]=4 97 B22R3.212251 O=C(OCc1ccc2ccccc2c1)c3cnccn3 CSC047405079 [1,0,0,0,0,1|2,0,0]=4 98 B24R3.181045 Cc1ccccc1OC(=O)COc2ccc3ccccc3c2 CSC046688418 [0,0,0,0,0,2|1,0,0]=3 99 B24R3.181045 Clc1ccccc1CC(=O)NCc2ccc3ccccc3c2 CSC046835923 [0,0,0,0,0,2|2,0,0]=4 100 B24R3.181045 Fc1ccccc1CC(=O)NCc2ccc3ccccc3c2 CSC049035418 [0,0,0,0,0,2|2,0,0]=4 101 B24R3.2657823 Cc1ccccc1OCC(=O)Nc2ccc3ccccc3c2 CSC047697881 [0,0,0,0,0,2|2,0,0]=4 102 B24R3.2657823 Cc1ccccc1OCC(=O)Oc2ccc3ccccc3c2 CSC048233478 [0,0,0,0,0,2|1,0,0]=3 103 B24R3.2657823 Clc1ccccc1CNC(=O)Nc2ccc3ccccc3c2 CSC047970607 [0,0,0,0,0,2|2,0,0]=4 104 B24R3.2657823 Fc1ccccc1CCC(=O)Nc2ccc3ccccc3c2 CSC048402028 [0,0,0,0,0,2|2,0,0]=4