0 B16R2.2256 C(Cc1ccccc1)Oc2ccccc2 CSC011995743 [0,0,0,0,0,0|2,0,0]=2 1 B16R2.2256 C(Cc1ccccc1)Sc2ccccc2 CSC000031048 [0,0,0,0,0,0|2,0,0]=2 2 B16R2.2256 C(Cc1ccccn1)Sc2ccccc2 CSC046232085 [0,0,0,0,0,0|1,0,0]=1 3 B16R2.2256 C(Cc1ccncc1)Sc2ccccc2 CSC000018619 [0,0,0,0,0,0|3,0,0]=3 4 B16R2.2256 C(NCc1ccccn1)c2ccccc2 CSC000196071 [0,0,0,0,0,0|1,0,0]=1 5 B16R2.2256 C(NCc1ccccn1)c2cccnc2 CSC000200736 [0,0,0,0,0,0|2,0,0]=2 6 B16R2.2256 C(NCc1cccnc1)c2ccccc2 CSC000180891 [0,0,0,0,0,0|3,0,0]=3 7 B16R2.2256 C(NCc1cccnc1)c2cccnc2 CSC000185688 [0,0,0,0,0,0|4,0,0]=4 8 B16R2.2256 C(NCc1ccncc1)c2ccccc2 CSC000186794 [0,0,0,0,0,0|3,0,0]=3 9 B16R2.2256 C(SCc1ccccc1)c2ccccc2 CSC000004503 [0,0,0,0,0,0|2,0,0]=2 10 B16R2.2256 C(SCc1cccnc1)c2ccccc2 CSC000044160 [0,0,0,0,0,0|3,0,0]=3 11 B16R2.2256 N(N=Cc1ccccc1)c2ccccc2 CSC000007351 [0,0,0,0,0,0|3,0,1]=4 12 B16R2.2256 N(N=Cc1ccccn1)c2ccccc2 CSC045338594 [0,0,0,0,0,0|2,0,1]=3 13 B16R2.2256 N(N=Cc1ccccn1)c2ccccn2 CSC033963630 [0,0,0,0,0,0|3,0,1]=4 14 B16R2.2256 N(N=Cc1cccnc1)c2ccccn2 CSC039870379 [0,0,0,0,0,0|3,0,1]=4 15 B16R2.2256 N(N=Cc1ccncc1)c2ccccn2 CSC046252382 [0,0,0,0,0,0|3,0,1]=4 16 B17R2.143 CC(Cc1ccncc1)Nc2ncccn2 CSC020387400 [0,1,0,0,0,0|3,0,0]=4 17 B17R2.143 CN(Cc1ccccc1)Cc2ccccc2 CSC000006602 [0,1,0,0,0,0|2,0,0]=3 18 B17R2.143 CN(Cc1ccccc1)Cc2cccnc2 CSC045073747 [0,1,0,0,0,0|3,0,0]=4 19 B17R2.143 O=C(Nc1ccccc1)Nc2ccccn2 CSC000008272 [0,1,0,0,0,0|2,0,1]=4 20 B17R2.216 Brc1ccc(cc1)C=NNc2ccccn2 CSC020759081 [0,1,0,0,0,0|2,0,1]=4 21 B17R2.216 Brc1ccc(cc1)CNCc2cccnc2 CSC000261655 [0,1,0,0,0,0|3,0,0]=4 22 B17R2.216 Brc1ccc(cc1)CNCc2ccncc2 CSC000262445 [0,1,0,0,0,0|3,0,0]=4 23 B17R2.216 Brc1ccc(cc1)SCCc2ccccn2 CSC041168514 [0,1,0,0,0,0|1,0,0]=2 24 B17R2.216 Brc1ccc(cc1)SCCc2ccncc2 CSC009812605 [0,1,0,0,0,0|3,0,0]=4 25 B17R2.216 Cc1ccc(cc1)C=NNc2ccccn2 CSC046204968 [0,1,0,0,0,0|2,0,1]=4 26 B17R2.216 Cc1ccc(cc1)CNCc2cccnc2 CSC000261654 [0,1,0,0,0,0|3,0,0]=4 27 B17R2.216 Cc1ccc(cc1)CNCc2ccncc2 CSC000266118 [0,1,0,0,0,0|3,0,0]=4 28 B17R2.216 Cc1ccc(cc1)SCCc2ccccn2 CSC029896541 [0,1,0,0,0,0|1,0,0]=2 29 B17R2.216 Cc1ccc(cc1)SCCc2ccncc2 CSC033376349 [0,1,0,0,0,0|3,0,0]=4 30 B17R2.216 Cc1ccc(nn1)NCCc2ccccc2 CSC005511828 [0,1,0,0,0,0|2,0,0]=3 31 B17R2.216 Clc1ccc(cc1)C=NNc2ccccn2 CSC046134415 [0,1,0,0,0,0|2,0,1]=4 32 B17R2.216 Clc1ccc(cc1)CNCc2ccccc2 CSC000187221 [0,1,0,0,0,0|2,0,0]=3 33 B17R2.216 Clc1ccc(cc1)CNCc2ccccn2 CSC000266102 [0,1,0,0,0,0|1,0,0]=2 34 B17R2.216 Clc1ccc(cc1)CNCc2cccnc2 CSC000261368 [0,1,0,0,0,0|3,0,0]=4 35 B17R2.216 Clc1ccc(cc1)CNCc2ccncc2 CSC000266115 [0,1,0,0,0,0|3,0,0]=4 36 B17R2.216 Fc1ccc(cc1)CNCc2ccccc2 CSC000186788 [0,1,0,0,0,0|2,0,0]=3 37 B17R2.216 Fc1ccc(cc1)CNCc2ccccn2 CSC000262139 [0,1,0,0,0,0|1,0,0]=2 38 B17R2.216 Fc1ccc(cc1)CNCc2cccnc2 CSC000262393 [0,1,0,0,0,0|3,0,0]=4 39 B17R2.216 Fc1ccc(cc1)CNCc2ccncc2 CSC000262127 [0,1,0,0,0,0|3,0,0]=4 40 B17R2.216 Fc1ccc(cc1)SCCc2ccccn2 CSC031655834 [0,1,0,0,0,0|1,0,0]=2 41 B17R2.216 Fc1ccc(cc1)SCCc2ccncc2 CSC048863826 [0,1,0,0,0,0|3,0,0]=4 42 B17R2.2342 CC(NCc1ccccn1)c2ccccc2 CSC000268299 [0,1,0,0,0,0|1,0,0]=2 43 B17R2.2342 CC(NCc1cccnc1)c2ccccc2 CSC000261734 [0,1,0,0,0,0|3,0,0]=4 44 B17R2.2342 C[C@@H](NCc1ccccn1)c2ccccc2 CSC005780038 [0,1,0,0,0,0|1,0,0]=2 45 B17R2.2342 C[C@H](NCc1ccccc1)c2ccccc2 CSC011830324 [0,1,0,0,0,0|2,0,0]=3 46 B17R2.2342 O=C(CSc1ccccc1)c2ccccc2 CSC000150728 [0,1,0,0,0,0|2,0,1]=4 47 B17R2.2342 O=C(CSc1ccccn1)c2ccccc2 CSC000172316 [0,1,0,0,0,0|1,0,1]=3 48 B17R2.2342 O=C(CSc1ncccn1)c2ccccc2 CSC000148904 [0,1,0,0,0,0|2,0,1]=4 49 B17R2.2342 O=C(NCc1ccccc1)c2cnccn2 CSC000153174 [0,1,0,0,0,0|2,0,1]=4 50 B17R2.2342 O=C(NCc1cccnc1)c2ccccn2 CSC000002253 [0,1,0,0,0,0|2,0,1]=4 51 B17R2.2342 O=C(OCc1ccccn1)c2ccccc2 CSC043519954 [0,1,0,0,0,0|1,0,1]=3 52 B17R2.3956 Cc1ccccc1CNCc2ccncc2 CSC000266117 [0,1,0,0,0,0|3,0,0]=4 53 B17R2.3956 Cc1cccnc1CNCc2ccccc2 CSC011647448 [0,1,0,0,0,0|1,0,0]=2 54 B17R2.3956 Cc1cncnc1NCCc2ccccn2 CSC076185588 [0,1,0,0,0,0|3,0,0]=4 55 B17R2.3956 Clc1ccccc1CNCc2ccccc2 CSC000186977 [0,1,0,0,0,0|2,0,0]=3 56 B17R2.3956 Clc1ccccc1CNCc2ccccn2 CSC000266101 [0,1,0,0,0,0|1,0,0]=2 57 B17R2.3956 Clc1ccccc1CNCc2cccnc2 CSC000261723 [0,1,0,0,0,0|3,0,0]=4 58 B17R2.3956 Clc1ccccc1CNCc2ccncc2 CSC000262369 [0,1,0,0,0,0|3,0,0]=4 59 B17R2.3956 Fc1ccccc1CNCc2ccccc2 CSC000195875 [0,1,0,0,0,0|2,0,0]=3 60 B17R2.3956 Fc1ccccc1CNCc2ccccn2 CSC000266106 [0,1,0,0,0,0|1,0,0]=2 61 B17R2.3956 Fc1ccccc1CNCc2cccnc2 CSC000266130 [0,1,0,0,0,0|3,0,0]=4 62 B17R2.3956 Fc1ccccc1CNCc2ccncc2 CSC000266119 [0,1,0,0,0,0|3,0,0]=4 63 B17R2.3956 Oc1ccccc1C=NCc2ccccc2 CSC020645287 [0,1,0,0,0,0|2,0,1]=4 64 B17R2.5301 Brc1cccc(c1)C=NNc2ccccn2 CSC020759082 [0,1,0,0,0,0|2,0,1]=4 65 B17R2.5301 Brc1cccc(c1)CNCc2ccccc2 CSC000186528 [0,1,0,0,0,0|2,0,0]=3 66 B17R2.5301 Brc1cccc(c1)CNCc2ccccn2 CSC000262140 [0,1,0,0,0,0|1,0,0]=2 67 B17R2.5301 Brc1cccc(c1)CNCc2cccnc2 CSC000261721 [0,1,0,0,0,0|3,0,0]=4 68 B17R2.5301 Brc1cccc(c1)CNCc2ccncc2 CSC000262128 [0,1,0,0,0,0|3,0,0]=4 69 B17R2.5301 Cc1cc(ncn1)NCCc2ccccc2 CSC005503881 [0,1,0,0,0,0|2,0,0]=3 70 B17R2.5301 Cc1cccc(c1)CNCc2cccnc2 CSC000266133 [0,1,0,0,0,0|3,0,0]=4 71 B17R2.5301 Cc1cccc(c1)CNCc2ccncc2 CSC000266123 [0,1,0,0,0,0|3,0,0]=4 72 B17R2.5301 Cc1cccc(c1)NCCc2ccccc2 CSC000275342 [0,1,0,0,0,0|2,0,0]=3 73 B17R2.5301 Cc1cccc(n1)CNCc2ccccc2 CSC000687153 [0,1,0,0,0,0|1,0,0]=2 74 B17R2.5301 Clc1cccc(c1)CNCc2ccccc2 CSC000195861 [0,1,0,0,0,0|2,0,0]=3 75 B17R2.5301 Clc1cccc(c1)CNCc2ccccn2 CSC000266103 [0,1,0,0,0,0|1,0,0]=2 76 B17R2.5301 Clc1cccc(c1)CNCc2cccnc2 CSC000266128 [0,1,0,0,0,0|3,0,0]=4 77 B17R2.5301 Clc1cccc(c1)CNCc2ccncc2 CSC000266116 [0,1,0,0,0,0|3,0,0]=4 78 B17R2.5301 Fc1cccc(c1)CNCc2ccccc2 CSC000195876 [0,1,0,0,0,0|2,0,0]=3 79 B17R2.5301 Fc1cccc(c1)CNCc2cccnc2 CSC000266131 [0,1,0,0,0,0|3,0,0]=4 80 B15R1.157 C=CCNC(=O)CCCc1ccccc1 CSC000186579 [0,0,1,0,0,0|1,0,2]=4 81 B15R2.2195 C(=Cc1ccncn1)c2ccccc2 CSC046097546 [0,0,0,0,1,0|1,0,2]=4 82 B15R2.2195 C(Nc1ccccc1)c2ccccc2 CSC000188819 [0,0,0,0,1,0|2,0,0]=3 83 B15R2.2195 C(Nc1ccccc1)c2cccnc2 CSC011211160 [0,0,0,0,1,0|3,0,0]=4 84 B15R2.2195 C(Nc1ccccn1)c2ccccn2 CSC000156431 [0,0,0,0,1,0|2,0,0]=3 85 B15R2.2195 C(Nc1ccccn1)c2cccnc2 CSC000156437 [0,0,0,0,1,0|2,0,0]=3 86 B15R2.2195 C(Nc1cccnc1)c2ccccc2 CSC011230970 [0,0,0,0,1,0|3,0,0]=4 87 B15R2.2195 C(Nc1ncccn1)c2ccccn2 CSC000156432 [0,0,0,0,1,0|3,0,0]=4 88 B15R2.2195 C(Oc1ccncc1)c2ccccc2 CSC000045163 [0,0,0,0,1,0|3,0,0]=4 89 B15R2.2195 C(Sc1ccccc1)c2ccccc2 CSC000000821 [0,0,0,0,1,0|2,0,0]=3 90 B15R2.2195 C(Sc1ccccc1)c2cccnc2 CSC000044157 [0,0,0,0,1,0|3,0,0]=4 91 B15R2.2195 C(Sc1ccccn1)c2ccccn2 CSC000031117 [0,0,0,0,1,0|2,0,0]=3 92 B15R2.2195 C(Sc1ncccn1)c2ccccc2 CSC000000291 [0,0,0,0,1,0|2,0,0]=3 93 B15R2.2195 C(Sc1ncccn1)c2cccnc2 CSC000044158 [0,0,0,0,1,0|3,0,0]=4 94 B15R2.2195 C(Sc1ncccn1)c2ccncc2 CSC000048319 [0,0,0,0,1,0|3,0,0]=4 95 B15R2.2196 C(NCc1ccccc1)c2cccs2 CSC000186831 [0,0,0,0,1,0|2,0,0]=3 96 B15R2.2196 C(NCc1ccccc1)c2ccsc2 CSC000200316 [0,0,0,0,1,0|2,0,0]=3 97 B15R2.2196 C(NCc1ccccn1)c2ccco2 CSC000189414 [0,0,0,0,1,0|2,0,0]=3 98 B15R2.2196 C(NCc1ccccn1)c2cccs2 CSC000200735 [0,0,0,0,1,0|2,0,0]=3 99 B15R2.2196 C(NCc1ccccn1)c2ccsc2 CSC000200747 [0,0,0,0,1,0|2,0,0]=3 100 B15R2.2196 C(NCc1cccnc1)c2cccs2 CSC000186969 [0,0,0,0,1,0|3,0,0]=4 101 B15R2.2196 C(NCc1cccnc1)c2ccsc2 CSC000200793 [0,0,0,0,1,0|3,0,0]=4 102 B15R2.2196 C(NCc1ccncc1)c2ccco2 CSC000200087 [0,0,0,0,1,0|3,0,0]=4 103 B15R2.2196 C(NCc1ccncc1)c2cccs2 CSC000186846 [0,0,0,0,1,0|3,0,0]=4 104 B15R2.2196 C(NCc1ccncc1)c2ccsc2 CSC000200771 [0,0,0,0,1,0|3,0,0]=4 105 B17R2.2382 C(COc1ccccc1)Oc2ccccc2 CSC000248817 [0,0,0,0,0,1|2,0,0]=3 106 B17R2.2382 C(Cc1ccccc1)NCc2ccccn2 CSC000268403 [0,0,0,0,0,1|0,0,0]=1 107 B17R2.2382 C(Cc1ccccn1)NCc2ccccc2 CSC000177504 [0,0,0,0,0,1|0,0,0]=1 108 B17R2.2382 C(Cc1ccncc1)SCc2ccccc2 CSC041855685 [0,0,0,0,0,1|2,0,0]=3 109 B17R2.2382 C(Sc1ccccn1)C=Cc2ccccc2 CSC035435160 [0,0,0,0,0,1|0,0,2]=3 110 B16R2.71 Brc1ccccc1NCc2ccccc2 CSC000224041 [0,1,0,0,1,0|2,0,0]=4 111 B16R2.71 Brc1ccccc1OCc2ccccn2 CSC011214837 [0,1,0,0,1,0|1,0,0]=3 112 B16R2.71 Cc1ccccc1CNc2ccccc2 CSC000188235 [0,1,0,0,1,0|2,0,0]=4 113 B16R2.71 Cc1ccccc1CNc2ccccn2 CSC000176107 [0,1,0,0,1,0|1,0,0]=3 114 B16R2.71 Cc1ccccc1CSc2ncccn2 CSC000000288 [0,1,0,0,1,0|2,0,0]=4 115 B16R2.71 Cc1ccccc1NCc2ccccc2 CSC000188381 [0,1,0,0,1,0|2,0,0]=4 116 B16R2.71 Clc1ccccc1CNc2ccccc2 CSC000188236 [0,1,0,0,1,0|2,0,0]=4 117 B16R2.71 Clc1ccccc1CNc2ccccn2 CSC000156637 [0,1,0,0,1,0|1,0,0]=3 118 B16R2.71 Clc1ccccc1COc2ccccc2 CSC000151824 [0,1,0,0,1,0|2,0,0]=4 119 B16R2.71 Clc1ccccc1CSc2ccccc2 CSC000000823 [0,1,0,0,1,0|2,0,0]=4 120 B16R2.71 Clc1ccccc1CSc2ccccn2 CSC000006456 [0,1,0,0,1,0|1,0,0]=3 121 B16R2.71 Clc1ccccc1CSc2ncccn2 CSC032516865 [0,1,0,0,1,0|2,0,0]=4 122 B16R2.71 Fc1ccccc1CNc2ccccn2 CSC000156009 [0,1,0,0,1,0|1,0,0]=3 123 B16R2.71 Fc1ccccc1CSc2ccccc2 CSC000000819 [0,1,0,0,1,0|2,0,0]=4 124 B16R2.71 Fc1ccccc1NCc2ccccc2 CSC000224932 [0,1,0,0,1,0|2,0,0]=4 125 B16R2.88 CC(Nc1ccccc1)c2ccccn2 CSC011230782 [0,1,0,0,1,0|1,0,0]=3 126 B16R2.88 CN(Cc1ccccc1)c2ccccc2 CSC000006973 [0,1,0,0,1,0|2,0,0]=4 127 B16R2.88 O=C(Nc1ccccc1)c2ccccn2 CSC000153471 [0,1,0,0,1,0|1,0,1]=4 128 B16R2.88 O=S(Cc1ccccc1)c2ccccc2 CSC000064345 [0,1,0,0,1,0|2,0,0]=4 129 B16R2.132 Brc1ccc(cc1)CNc2ccccc2 CSC000188238 [0,1,0,0,1,0|2,0,0]=4 130 B16R2.132 Brc1ccc(cc1)CNc2ccccn2 CSC000186237 [0,1,0,0,1,0|1,0,0]=3 131 B16R2.132 Brc1ccc(cc1)COc2ccccc2 CSC000151822 [0,1,0,0,1,0|2,0,0]=4 132 B16R2.132 Brc1ccc(cc1)NCc2ccccn2 CSC000238286 [0,1,0,0,1,0|1,0,0]=3 133 B16R2.132 Brc1ccc(cc1)OCc2ccccc2 CSC000151783 [0,1,0,0,1,0|2,0,0]=4 134 B16R2.132 Brc1ccc(nc1)NCc2ccccc2 CSC000239955 [0,1,0,0,1,0|1,0,0]=3 135 B16R2.132 Brc1cnc(nc1)NCc2ccccc2 CSC011938770 [0,1,0,0,1,0|2,0,0]=4 136 B16R2.132 Brc1cnc(nc1)SCc2ccccc2 CSC011939521 [0,1,0,0,1,0|2,0,0]=4 137 B16R2.132 Cc1ccc(cc1)CNc2ccccc2 CSC000187236 [0,1,0,0,1,0|2,0,0]=4 138 B16R2.132 Cc1ccc(cc1)CNc2ccccn2 CSC000155969 [0,1,0,0,1,0|1,0,0]=3 139 B16R2.132 Cc1ccc(cc1)COc2ccccc2 CSC000151826 [0,1,0,0,1,0|2,0,0]=4 140 B16R2.132 Cc1ccc(cc1)CSc2ccccc2 CSC000000813 [0,1,0,0,1,0|2,0,0]=4 141 B16R2.132 Cc1ccc(cc1)CSc2ncccn2 CSC000000282 [0,1,0,0,1,0|2,0,0]=4 142 B16R2.132 Cc1ccc(cc1)OCc2ccccc2 CSC000151804 [0,1,0,0,1,0|2,0,0]=4 143 B16R2.132 Cc1ccc(cc1)SCc2ccccc2 CSC000006809 [0,1,0,0,1,0|2,0,0]=4 144 B16R2.132 Clc1ccc(cc1)CNc2ccccn2 CSC000156184 [0,1,0,0,1,0|1,0,0]=3 145 B16R2.132 Clc1ccc(cc1)CNc2cnccn2 CSC000156186 [0,1,0,0,1,0|2,0,0]=4 146 B16R2.132 Clc1ccc(cc1)COc2ccccc2 CSC000151820 [0,1,0,0,1,0|2,0,0]=4 147 B16R2.132 Clc1ccc(cc1)CSc2ccccc2 CSC000000820 [0,1,0,0,1,0|2,0,0]=4 148 B16R2.132 Clc1ccc(cc1)CSc2ncccn2 CSC046091165 [0,1,0,0,1,0|2,0,0]=4 149 B16R2.132 Clc1ccc(cc1)NCc2ccccn2 CSC000742532 [0,1,0,0,1,0|1,0,0]=3 150 B16R2.132 Clc1ccc(cc1)OCc2ccccc2 CSC000151798 [0,1,0,0,1,0|2,0,0]=4 151 B16R2.132 Fc1ccc(cc1)CNc2ccccn2 CSC000156842 [0,1,0,0,1,0|1,0,0]=3 152 B16R2.132 Fc1ccc(cc1)COc2ccccc2 CSC000151825 [0,1,0,0,1,0|2,0,0]=4 153 B16R2.132 Fc1ccc(cc1)CSc2ccccc2 CSC000000824 [0,1,0,0,1,0|2,0,0]=4 154 B16R2.132 Fc1ccc(cc1)CSc2ncccn2 CSC000000295 [0,1,0,0,1,0|2,0,0]=4 155 B16R2.132 Fc1ccc(cc1)NCc2ccccc2 CSC000187247 [0,1,0,0,1,0|2,0,0]=4 156 B16R2.132 Fc1ccc(cc1)NCc2ccccn2 CSC000742618 [0,1,0,0,1,0|1,0,0]=3 157 B16R2.132 Fc1ccc(cc1)OCc2ccccc2 CSC000151815 [0,1,0,0,1,0|2,0,0]=4 158 B16R2.132 Fc1ccc(cc1)SCc2ccccc2 CSC047495018 [0,1,0,0,1,0|2,0,0]=4 159 B16R2.132 Ic1ccc(cc1)CNc2ccccc2 CSC000188239 [0,1,0,0,1,0|2,0,0]=4 160 B16R2.132 Oc1ccc(cc1)SCc2ccccc2 CSC011362052 [0,1,0,0,1,0|2,0,0]=4 161 B16R2.252 Brc1cccc(c1)CSc2ncccn2 CSC000148903 [0,1,0,0,1,0|2,0,0]=4 162 B16R2.252 Brc1cccc(c1)OCc2ccccc2 CSC000151840 [0,1,0,0,1,0|2,0,0]=4 163 B16R2.252 Brc1cccc(c1)OCc2ccccn2 CSC011214830 [0,1,0,0,1,0|1,0,0]=3 164 B16R2.252 Brc1ccnc(c1)NCc2ccccc2 CSC010191162 [0,1,0,0,1,0|1,0,0]=3 165 B16R2.252 Cc1cccc(c1)CSc2ncccn2 CSC000000298 [0,1,0,0,1,0|2,0,0]=4 166 B16R2.252 Cc1cccc(c1)SCc2ccccc2 CSC000055753 [0,1,0,0,1,0|2,0,0]=4 167 B16R2.252 Cc1cccc(n1)NCc2ccccc2 CSC011215723 [0,1,0,0,1,0|1,0,0]=3 168 B16R2.252 Cc1ccnc(c1)NCc2ccccc2 CSC000239948 [0,1,0,0,1,0|1,0,0]=3 169 B16R2.252 Cc1ccnc(c1)NCc2cccnc2 CSC011381394 [0,1,0,0,1,0|2,0,0]=4 170 B16R2.252 Cc1ccnc(n1)NCc2ccccc2 CSC011780789 [0,1,0,0,1,0|2,0,0]=4 171 B16R2.252 Cc1ccnc(n1)SCc2ccccc2 CSC000013087 [0,1,0,0,1,0|2,0,0]=4 172 B16R2.252 Clc1cccc(c1)CNc2ccccn2 CSC000156640 [0,1,0,0,1,0|1,0,0]=3 173 B16R2.252 Clc1cccc(c1)CSc2ccccc2 CSC000000822 [0,1,0,0,1,0|2,0,0]=4 174 B16R2.252 Clc1cccc(c1)CSc2ncccn2 CSC000000293 [0,1,0,0,1,0|2,0,0]=4 175 B16R2.252 Clc1cccc(c1)NCc2ccccc2 CSC000224541 [0,1,0,0,1,0|2,0,0]=4 176 B16R2.252 Fc1cccc(c1)CNc2ccccn2 CSC000239960 [0,1,0,0,1,0|1,0,0]=3 177 B16R2.252 Fc1cccc(c1)COc2ccccc2 CSC000151828 [0,1,0,0,1,0|2,0,0]=4 178 B16R2.252 Fc1cccc(c1)CSc2ccccc2 CSC000000815 [0,1,0,0,1,0|2,0,0]=4 179 B16R2.252 Fc1cccc(c1)CSc2ccccn2 CSC000006702 [0,1,0,0,1,0|1,0,0]=3 180 B16R2.252 Fc1cccc(c1)CSc2ncccn2 CSC047219232 [0,1,0,0,1,0|2,0,0]=4 181 B16R2.252 Fc1cccc(c1)OCc2ccccc2 CSC000151861 [0,1,0,0,1,0|2,0,0]=4 182 B16R2.252 Nc1cccc(c1)COc2ccccc2 CSC000743254 [0,1,0,0,1,0|2,0,0]=4 183 B16R2.252 Nc1cccc(c1)CSc2ccccn2 CSC000747872 [0,1,0,0,1,0|1,0,0]=3 184 B16R2.252 Oc1cccc(c1)CNc2ccccc2 CSC011230791 [0,1,0,0,1,0|2,0,0]=4 185 B16R2.135 Brc1ccc(cc1)CNCc2ccco2 CSC000216222 [0,1,0,0,1,0|2,0,0]=4 186 B16R2.135 Brc1ccc(cc1)CNCc2cccs2 CSC000189064 [0,1,0,0,1,0|2,0,0]=4 187 B16R2.135 Brc1ccc(cc1)OCCn2cccn2 CSC011487139 [0,1,0,0,1,0|2,0,0]=4 188 B16R2.135 Cc1ccc(cc1)CNCc2cc[nH]n2 CSC011332822 [0,1,0,0,1,0|2,0,0]=4 189 B16R2.135 Cc1ccc(cc1)CNCc2ccsc2 CSC000202226 [0,1,0,0,1,0|2,0,0]=4 190 B16R2.135 Cc1ccc(cc1)CNCc2cocn2 CSC018947012 [0,1,0,0,1,0|2,0,0]=4 191 B16R2.135 Cc1ccc(cc1)CNCc2cscn2 CSC000228054 [0,1,0,0,1,0|2,0,0]=4 192 B16R2.135 Clc1ccc(cc1)CNCc2ccco2 CSC000200065 [0,1,0,0,1,0|2,0,0]=4 193 B16R2.135 Clc1ccc(cc1)CNCc2cccs2 CSC000186844 [0,1,0,0,1,0|2,0,0]=4 194 B16R2.135 Fc1ccc(cc1)CNCc2ccco2 CSC000188282 [0,1,0,0,1,0|2,0,0]=4 195 B16R2.135 Fc1ccc(cc1)CNCc2cccs2 CSC000186847 [0,1,0,0,1,0|2,0,0]=4 196 B16R2.135 Fc1ccc(cc1)CNCc2ccsc2 CSC000202074 [0,1,0,0,1,0|2,0,0]=4 197 B16R2.255 Brc1cccc(c1)CNCc2ccco2 CSC000216224 [0,1,0,0,1,0|2,0,0]=4 198 B16R2.255 Brc1cccc(c1)CNCc2cccs2 CSC000186848 [0,1,0,0,1,0|2,0,0]=4 199 B16R2.255 Cc1cccc(c1)CNCc2cccs2 CSC000196729 [0,1,0,0,1,0|2,0,0]=4 200 B16R2.255 Cc1cccc(c1)CNCc2cocn2 CSC019878337 [0,1,0,0,1,0|2,0,0]=4 201 B16R2.255 Cc1cccc(c1)CNCc2cscn2 CSC011425974 [0,1,0,0,1,0|2,0,0]=4 202 B16R2.255 Clc1cccc(c1)CNCc2ccco2 CSC000201557 [0,1,0,0,1,0|2,0,0]=4 203 B16R2.255 Clc1cccc(c1)CNCc2cccs2 CSC000196725 [0,1,0,0,1,0|2,0,0]=4 204 B16R2.255 Fc1cccc(c1)CNCc2ccco2 CSC000223615 [0,1,0,0,1,0|2,0,0]=4 205 B16R2.255 Oc1cccc(c1)CNCc2ccco2 CSC011195701 [0,1,0,0,1,0|2,0,0]=4 206 B16R2.2238 CC(NCc1ccccc1)c2ccco2 CSC000203568 [0,1,0,0,1,0|2,0,0]=4 207 B16R2.2238 CC(NCc1ccccn1)c2cccs2 CSC000202710 [0,1,0,0,1,0|2,0,0]=4 208 B16R2.2832 Brc1csc(c1)CNCc2ccccn2 CSC000200758 [0,1,0,0,1,0|2,0,0]=4 209 B16R2.2832 Brc1ncn(n1)CCCc2ccccc2 CSC010062340 [0,1,0,0,1,0|2,0,0]=4 210 B16R2.2832 Cc1ccc(o1)CNCc2ccccc2 CSC000200309 [0,1,0,0,1,0|2,0,0]=4 211 B16R2.2832 Cc1ccc(o1)CNCc2ccccn2 CSC000200743 [0,1,0,0,1,0|2,0,0]=4 212 B16R2.2832 Cc1ccc(s1)CNCc2ccccc2 CSC000200320 [0,1,0,0,1,0|2,0,0]=4 213 B16R2.2832 Cc1ccc(s1)CNCc2ccccn2 CSC000200751 [0,1,0,0,1,0|2,0,0]=4 214 B16R2.2832 Cc1csc(n1)CNCc2ccccc2 CSC011276375 [0,1,0,0,1,0|2,0,0]=4 215 B16R2.2832 Cc1csc(n1)CNCc2ccccc2 CSC011276375 [0,1,0,0,1,0|2,0,0]=4 216 B16R2.2832 Clc1ncn(n1)CCCc2ccccc2 CSC032245640 [0,1,0,0,1,0|2,0,0]=4 217 B16R2.2832 Cn1ccc(n1)CNCc2ccccc2 CSC011788736 [0,1,0,0,1,0|2,0,0]=4 218 B16R2.2959 Cc1ccccc1CCCn2ccnc2 CSC026557740 [0,1,0,0,1,0|2,0,0]=4 219 B16R2.2959 Cc1ccccc1CNCc2cc[nH]n2 CSC011368955 [0,1,0,0,1,0|2,0,0]=4 220 B16R2.2959 Cc1ccccc1CNCc2ccco2 CSC000202906 [0,1,0,0,1,0|2,0,0]=4 221 B16R2.2959 Cc1ccccc1CNCc2cccs2 CSC000196726 [0,1,0,0,1,0|2,0,0]=4 222 B16R2.2959 Cc1ccccc1CNCc2cocn2 CSC020493373 [0,1,0,0,1,0|2,0,0]=4 223 B16R2.2959 Cc1ccccc1CNCc2cscn2 CSC000232110 [0,1,0,0,1,0|2,0,0]=4 224 B16R2.2959 Clc1ccccc1CNCc2ccco2 CSC000201550 [0,1,0,0,1,0|2,0,0]=4 225 B16R2.2959 Clc1ccccc1CNCc2cccs2 CSC000186670 [0,1,0,0,1,0|2,0,0]=4 226 B16R2.2959 Clc1ccccc1CNCc2ccsc2 CSC000201552 [0,1,0,0,1,0|2,0,0]=4 227 B16R2.2959 Fc1ccccc1CNCc2ccco2 CSC000202385 [0,1,0,0,1,0|2,0,0]=4 228 B16R2.2959 Fc1ccccc1CNCc2cccs2 CSC000189307 [0,1,0,0,1,0|2,0,0]=4 229 B16R2.3250 Cc1ccsc1CNCc2ccccc2 CSC000200310 [0,1,0,0,1,0|2,0,0]=4 230 B16R2.3250 Cc1ccsc1CNCc2ccccn2 CSC000200745 [0,1,0,0,1,0|2,0,0]=4 231 B16R2.3250 Cn1cccc1CNCc2ccccc2 CSC000188269 [0,1,0,0,1,0|1,0,1]=4 232 B16R2.5767 CC(NCc1ccsc1)c2ccccc2 CSC000199999 [0,1,0,0,1,0|2,0,0]=4 233 B16R2.5767 CC(NCc1cocn1)c2ccccc2 CSC017377954 [0,1,0,0,1,0|2,0,0]=4 234 B16R2.5767 CC(NCc1cscn1)c2ccccc2 CSC000223588 [0,1,0,0,1,0|2,0,0]=4 235 B16R2.5767 C[C@@H](NCc1ccco1)c2ccccc2 CSC033751423 [0,1,0,0,1,0|2,0,0]=4 236 B18R2.270 Brc1ccc(cc1)CNCCc2ccccc2 CSC000389605 [0,1,0,0,0,1|1,0,0]=3 237 B18R2.270 Cc1ccc(cc1)CNCCc2ccccc2 CSC000389764 [0,1,0,0,0,1|1,0,0]=3 238 B18R2.270 Cc1ccc(cc1)CNCCc2ccccn2 CSC000488546 [0,1,0,0,0,1|0,0,0]=2 239 B18R2.270 Cc1ccc(cc1)SCCOc2ccccc2 CSC046145538 [0,1,0,0,0,1|2,0,0]=4 240 B18R2.270 Clc1ccc(cc1)CCNCc2ccccc2 CSC000196564 [0,1,0,0,0,1|1,0,0]=3 241 B18R2.270 Clc1ccc(cc1)CCNCc2ccccn2 CSC000496359 [0,1,0,0,0,1|0,0,0]=2 242 B18R2.270 Clc1ccc(cc1)CCNCc2cccnc2 CSC000496360 [0,1,0,0,0,1|2,0,0]=4 243 B18R2.270 Clc1ccc(cc1)CCNCc2ccncc2 CSC000496364 [0,1,0,0,0,1|2,0,0]=4 244 B18R2.270 Clc1ccc(cc1)SCCSc2ncccn2 CSC046233771 [0,1,0,0,0,1|2,0,0]=4 245 B18R2.270 Fc1ccc(cc1)CCNCc2ccccc2 CSC000196521 [0,1,0,0,0,1|1,0,0]=3 246 B18R2.270 Fc1ccc(cc1)CCNCc2ccccn2 CSC000496309 [0,1,0,0,0,1|0,0,0]=2 247 B18R2.270 Fc1ccc(cc1)CCNCc2cccnc2 CSC000496310 [0,1,0,0,0,1|2,0,0]=4 248 B18R2.270 Fc1ccc(cc1)CCNCc2ccncc2 CSC000496313 [0,1,0,0,0,1|2,0,0]=4 249 B18R2.270 Fc1ccc(cc1)CNCCc2ccccc2 CSC000489982 [0,1,0,0,0,1|1,0,0]=3 250 B18R2.270 Fc1ccc(cc1)OCCSc2ncccn2 CSC046236100 [0,1,0,0,0,1|2,0,0]=4 251 B18R2.2429 CC(Cc1ccccn1)NCc2ncccn2 CSC051302528 [0,1,0,0,0,1|2,0,0]=4 252 B18R2.2429 CN(CCc1ccccn1)Cc2ccccc2 CSC046488559 [0,1,0,0,0,1|0,0,0]=2 253 B18R2.2429 CN(CCc1ccccn1)Cc2ccccn2 CSC046258630 [0,1,0,0,0,1|1,0,0]=3 254 B18R2.2429 CN(CCc1ccccn1)Cc2cccnc2 CSC048211450 [0,1,0,0,0,1|1,0,0]=3 255 B18R2.2429 CN(CCc1ccccn1)Cc2ccncc2 CSC047423475 [0,1,0,0,0,1|1,0,0]=3 256 B18R2.2429 CN(CCc1ccccn1)Cc2cnccn2 CSC026951045 [0,1,0,0,0,1|2,0,0]=4 257 B18R2.2429 O=C(CCc1ccccc1)Nc2ccccc2 CSC000383235 [0,1,0,0,0,1|1,0,1]=4 258 B18R2.2429 O=C(CCc1ccccc1)Nc2cnccn2 CSC046170787 [0,1,0,0,0,1|1,0,1]=4 259 B18R2.2429 O=C(CCc1ccccc1)Oc2ccccc2 CSC047411435 [0,1,0,0,0,1|1,0,1]=4 260 B18R2.2429 O=C(CSc1ccccn1)Nc2ccccc2 CSC047509106 [0,1,0,0,0,1|1,0,1]=4 261 B18R2.2429 O=C(NCc1ccccn1)Nc2ccccc2 CSC015206686 [0,1,0,0,0,1|1,0,1]=4 262 B18R2.3984 Cc1ccccc1CCNCc2ccccn2 CSC000394047 [0,1,0,0,0,1|0,0,0]=2 263 B18R2.3984 Cc1ccccc1CCNCc2cccnc2 CSC000394048 [0,1,0,0,0,1|2,0,0]=4 264 B18R2.3984 Cc1ccccc1CCNCc2ccncc2 CSC000497017 [0,1,0,0,0,1|2,0,0]=4 265 B18R2.3984 Cc1ccccc1CNCCc2ccccc2 CSC000392155 [0,1,0,0,0,1|1,0,0]=3 266 B18R2.3984 Cc1ccccc1CNCCc2ccccn2 CSC000488665 [0,1,0,0,0,1|0,0,0]=2 267 B18R2.3984 Clc1ccccc1CNCCc2ccccc2 CSC000493383 [0,1,0,0,0,1|1,0,0]=3 268 B18R2.3984 Fc1ccccc1CCCNc2ncccn2 CSC048440945 [0,1,0,0,0,1|1,0,0]=3 269 B18R2.3984 Fc1ccccc1CCNCc2ccccc2 CSC000188266 [0,1,0,0,0,1|1,0,0]=3 270 B18R2.3984 Fc1ccccc1CCNCc2ccccn2 CSC000497524 [0,1,0,0,0,1|0,0,0]=2 271 B18R2.3984 Fc1ccccc1CCNCc2cccnc2 CSC000497525 [0,1,0,0,0,1|2,0,0]=4 272 B18R2.3984 Fc1ccccc1CCNCc2ccncc2 CSC000497531 [0,1,0,0,0,1|2,0,0]=4 273 B18R2.3984 Fc1ccccc1CNCCc2ccccc2 CSC000392156 [0,1,0,0,0,1|1,0,0]=3 274 B18R2.3984 Fc1ccccc1OCCSc2ncccn2 CSC046998216 [0,1,0,0,0,1|2,0,0]=4 275 B18R2.6483 Brc1cccc(c1)CNCCc2ccccc2 CSC000489928 [0,1,0,0,0,1|1,0,0]=3 276 B18R2.6483 Cc1cccc(c1)CCNCc2ccccn2 CSC007975024 [0,1,0,0,0,1|0,0,0]=2 277 B18R2.6483 Cc1cccc(c1)CCNCc2cccnc2 CSC054264340 [0,1,0,0,0,1|2,0,0]=4 278 B18R2.6483 Cc1cccc(c1)CCNCc2ccncc2 CSC000958501 [0,1,0,0,0,1|2,0,0]=4 279 B18R2.6483 Cc1cccc(c1)CNCCc2ccccc2 CSC000493386 [0,1,0,0,0,1|1,0,0]=3 280 B18R2.6483 Cc1cccc(c1)CNCCc2ccccn2 CSC000493896 [0,1,0,0,0,1|0,0,0]=2 281 B18R2.6483 Clc1cccc(c1)CCNCc2cccnc2 CSC041371388 [0,1,0,0,0,1|2,0,0]=4 282 B18R2.6483 Clc1cccc(c1)CNCCc2ccccc2 CSC000493384 [0,1,0,0,0,1|1,0,0]=3 283 B18R2.6483 Fc1cccc(c1)CCNCc2ccccc2 CSC000208301 [0,1,0,0,0,1|1,0,0]=3 284 B18R2.6483 Fc1cccc(c1)CCNCc2ccccn2 CSC000499394 [0,1,0,0,0,1|0,0,0]=2 285 B18R2.7189 CC(CNCc1ccccc1)c2ccccc2 CSC000196819 [0,1,0,0,0,1|1,0,0]=3 286 B18R2.7189 CC(CNCc1cccnc1)c2ccccc2 CSC000496122 [0,1,0,0,0,1|2,0,0]=4 287 B18R2.7189 CC(CNCc1cccnc1)c2ccccc2 CSC000496122 [0,1,0,0,0,1|2,0,0]=4 288 B18R2.7189 CC(CNCc1ccncc1)c2ccccc2 CSC000393650 [0,1,0,0,0,1|2,0,0]=4 289 B18R2.7189 CC(NCCc1ccccc1)c2ccccc2 CSC000393596 [0,1,0,0,0,1|1,0,0]=3 290 B18R2.7189 CC(NCCc1ccccc1)c2ccccn2 CSC000606927 [0,1,0,0,0,1|0,0,0]=2 291 B18R2.7189 CC(NCCc1ccccn1)c2ccccn2 CSC000511761 [0,1,0,0,0,1|1,0,0]=3 292 B18R2.7189 O=C(CCSc1ccccn1)c2ccccc2 CSC006007322 [0,1,0,0,0,1|0,0,1]=3 293 B18R2.7189 O=C(CSCc1ccccc1)c2ccccc2 CSC000257384 [0,1,0,0,0,1|1,0,1]=4 294 B18R2.7189 O=C(OCCc1ccccc1)c2ccccc2 CSC020627661 [0,1,0,0,0,1|1,0,1]=4 295 B18R2.7189 OC(CNCc1ccccc1)c2ccccc2 CSC000157147 [0,1,0,0,0,1|1,0,0]=3 296 B18R2.7189 OC(CNCc1ccccn1)c2ccccc2 CSC000583765 [0,1,0,0,0,1|0,0,0]=2 297 B18R2.7189 OC(CNCc1cccnc1)c2ccccc2 CSC000483448 [0,1,0,0,0,1|2,0,0]=4 298 B18R2.7189 OC(CNCc1ccncc1)c2ccccc2 CSC000483445 [0,1,0,0,0,1|2,0,0]=4 299 B18R2.199 CCN(Cc1ccccc1)Cc2ccccc2 CSC000006603 [0,2,0,0,0,0|2,0,0]=4 300 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cc2)Cl CSC000006958 [0,2,0,0,0,0|2,0,0]=4 301 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cc2)F CSC000006961 [0,2,0,0,0,0|2,0,0]=4 302 B18R2.266 Cc1ccc(cc1)CC(=O)Nc2ccccn2 CSC046142519 [0,2,0,0,0,0|1,0,1]=4 303 B18R2.266 Clc1ccc(cc1)CC(=O)Nc2ccccn2 CSC046082690 [0,2,0,0,0,0|1,0,1]=4 304 B18R2.266 Fc1ccc(cc1)CC(=O)Nc2ccccn2 CSC046135915 [0,2,0,0,0,0|1,0,1]=4 305 B18R2.3983 CN(Cc1ccccc1)Cc2ccccc2F CSC000006957 [0,2,0,0,0,0|2,0,0]=4 306 B18R2.3983 Clc1ccccc1CC(=O)Nc2ccccn2 CSC046140025 [0,2,0,0,0,0|1,0,1]=4 307 B18R2.6478 Cc1cccc(c1)CC(=O)Nc2ccccn2 CSC047572462 [0,2,0,0,0,0|1,0,1]=4 308 B18R2.7204 OC(C(=O)Nc1ccccn1)c2ccccc2 CSC046240097 [0,2,0,0,0,0|1,0,1]=4 309 B18R2.32233 O=S(=O)(Cc1ccccc1)Cc2ccccc2 CSC020620865 [0,2,0,0,0,0|2,0,0]=4 310 B18R2.32233 O=S(=O)(Cc1ccccc1)Nc2ccccn2 CSC046524037 [0,2,0,0,0,0|2,0,0]=4 311 B18R2.61 CCc1ccc(cc1)CNCc2ccccn2 CSC000493477 [0,2,0,0,0,0|1,0,0]=3 312 B18R2.61 COc1ccc(cc1)CNCc2ccccn2 CSC000602850 [0,2,0,0,0,0|1,0,0]=3 313 B18R2.61 CSc1ccc(cc1)CNCc2ccccc2 CSC000195867 [0,2,0,0,0,0|2,0,0]=4 314 B18R2.61 N#Cc1ccc(cc1)OCCc2ccccc2 CSC000490293 [0,2,0,0,0,0|2,0,0]=4 315 B18R2.253 Brc1ccc(cc1)C(=O)CSc2ccccn2 CSC000257358 [0,2,0,0,0,0|1,0,1]=4 316 B18R2.253 Brc1ccc(nc1)C(=O)NCc2ccccc2 CSC005704398 [0,2,0,0,0,0|1,0,1]=4 317 B18R2.253 CC(NCc1ccccn1)c2ccc(cc2)C CSC000524036 [0,2,0,0,0,0|1,0,0]=3 318 B18R2.253 Cc1ccc(cc1)C(=O)CSc2ccccn2 CSC000257359 [0,2,0,0,0,0|1,0,1]=4 319 B18R2.253 Clc1ccc(cc1)C(=O)CSc2ccccn2 CSC000257356 [0,2,0,0,0,0|1,0,1]=4 320 B18R2.253 Clc1ccc(cc1)C(=O)NCc2ccccn2 CSC046098424 [0,2,0,0,0,0|1,0,1]=4 321 B18R2.253 Clc1ccc(cc1)C(=O)OCc2ccccn2 CSC048509729 [0,2,0,0,0,0|1,0,1]=4 322 B18R2.253 Fc1ccc(cc1)C(=O)CSc2ccccn2 CSC000257357 [0,2,0,0,0,0|1,0,1]=4 323 B18R2.253 Fc1ccc(cc1)C(=O)NCc2ccccn2 CSC000250458 [0,2,0,0,0,0|1,0,1]=4 324 B18R2.253 Ic1ccc(cc1)C(=O)NCc2ccccn2 CSC000250459 [0,2,0,0,0,0|1,0,1]=4 325 B18R2.257 Brc1ccc(cc1)COC(=O)c2ccccn2 CSC047876670 [0,2,0,0,0,0|1,0,1]=4 326 B18R2.257 CC(NCc1ccc(cc1)Br)c2ccccc2 CSC000595519 [0,2,0,0,0,0|2,0,0]=4 327 B18R2.257 CC(NCc1ccc(cc1)C)c2ccccc2 CSC000489909 [0,2,0,0,0,0|2,0,0]=4 328 B18R2.257 CC(NCc1ccc(cc1)C)c2ccccn2 CSC000392618 [0,2,0,0,0,0|1,0,0]=3 329 B18R2.257 CC(NCc1ccc(cc1)Cl)c2ccccc2 CSC000489924 [0,2,0,0,0,0|2,0,0]=4 330 B18R2.257 CC(NCc1ccc(cc1)F)c2ccccc2 CSC000489925 [0,2,0,0,0,0|2,0,0]=4 331 B18R2.257 C[C@H](NCc1ccc(cc1)F)c2ccccc2 CSC003442034 [0,2,0,0,0,0|2,0,0]=4 332 B18R2.257 Cc1ccc(cc1)COC(=O)c2ccccn2 CSC046383574 [0,2,0,0,0,0|1,0,1]=4 333 B18R2.257 Clc1ccc(cc1)COC(=O)c2ccccn2 CSC046583624 [0,2,0,0,0,0|1,0,1]=4 334 B18R2.257 Fc1ccc(cc1)COC(=O)c2ccccn2 CSC047683161 [0,2,0,0,0,0|1,0,1]=4 335 B18R2.257 Ic1ccc(cc1)COC(=O)c2ccccn2 CSC047635326 [0,2,0,0,0,0|1,0,1]=4 336 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)Br CSC000494166 [0,2,0,0,0,0|2,0,0]=4 337 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)C CSC000603366 [0,2,0,0,0,0|2,0,0]=4 338 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)C CSC000603366 [0,2,0,0,0,0|2,0,0]=4 339 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)Cl CSC000493758 [0,2,0,0,0,0|2,0,0]=4 340 B18R2.269 Cc1ccc(cn1)CCNc2cccc(n2)C CSC028299755 [0,2,0,0,0,0|2,0,0]=4 341 B18R2.269 Cc1cccc(c1)CNCc2ccc(cc2)F CSC000603284 [0,2,0,0,0,0|2,0,0]=4 342 B18R2.269 Fc1ccc(cc1)CNCc2cccc(c2)Br CSC000490458 [0,2,0,0,0,0|2,0,0]=4 343 B18R2.269 Fc1ccc(cc1)CNCc2cccc(c2)Cl CSC000490461 [0,2,0,0,0,0|2,0,0]=4 344 B18R2.274 Brc1ccc(cc1)CNCc2ccc(cc2)Br CSC000519473 [0,2,0,0,0,0|2,0,0]=4 345 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)C CSC000392503 [0,2,0,0,0,0|2,0,0]=4 346 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)C CSC000392503 [0,2,0,0,0,0|2,0,0]=4 347 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)F CSC000490198 [0,2,0,0,0,0|2,0,0]=4 348 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cc2)Br CSC000596538 [0,2,0,0,0,0|2,0,0]=4 349 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cc2)Cl CSC000490199 [0,2,0,0,0,0|2,0,0]=4 350 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cc2)F CSC000490200 [0,2,0,0,0,0|2,0,0]=4 351 B18R2.4060 Cc1ccc(c(c1)C)CNCc2ccccc2 CSC000195885 [0,2,0,0,0,0|2,0,0]=4 352 B18R2.4060 Cc1ccc(c(c1)C)CNCc2ccccn2 CSC000493479 [0,2,0,0,0,0|1,0,0]=3 353 B18R2.4060 Clc1ccc(c(c1)Cl)CNCc2ccccc2 CSC000187938 [0,2,0,0,0,0|2,0,0]=4 354 B18R2.8976 Cc1ccc(cc1C)CNCc2ccccc2 CSC000195900 [0,2,0,0,0,0|2,0,0]=4 355 B18R2.8976 Clc1ccc(cc1Cl)CNCc2ccccc2 CSC000195857 [0,2,0,0,0,0|2,0,0]=4 356 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2C CSC000392502 [0,2,0,0,0,0|2,0,0]=4 357 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2C CSC000392502 [0,2,0,0,0,0|2,0,0]=4 358 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2F CSC000494170 [0,2,0,0,0,0|2,0,0]=4 359 B18R2.9237 Cc1ccccc1CNCc2ccc(cc2)F CSC000389993 [0,2,0,0,0,0|2,0,0]=4 360 B18R2.9237 Clc1ccc(cc1)CNCc2ccccc2Cl CSC000489922 [0,2,0,0,0,0|2,0,0]=4 361 B18R2.9237 Clc1ccccc1CNCc2ccc(cc2)Br CSC000390003 [0,2,0,0,0,0|2,0,0]=4 362 B18R2.9237 Fc1ccc(cc1)CNCc2ccccc2Cl CSC000389759 [0,2,0,0,0,0|2,0,0]=4 363 B18R2.9237 Fc1ccc(cc1)CNCc2ccccc2F CSC000392454 [0,2,0,0,0,0|2,0,0]=4 364 B18R2.3606 OC[C@H](NCc1ccccc1)c2ccccc2 CSC011416739 [0,2,0,0,0,0|2,0,0]=4 365 B18R2.3634 CC(NC(=O)c1ccccc1)c2ccccn2 CSC000383005 [0,2,0,0,0,0|1,0,1]=4 366 B18R2.3634 CC(NC(=O)c1ccccn1)c2ccccc2 CSC046201440 [0,2,0,0,0,0|1,0,1]=4 367 B18R2.3634 CC(NC(C)c1ccccn1)c2ccccn2 CSC000656058 [0,2,0,0,0,0|2,0,0]=4 368 B18R2.3634 CC(NC(C)c1ccccn1)c2cccnc2 CSC000412856 [0,2,0,0,0,0|2,0,0]=4 369 B18R2.3634 CC(NC(C)c1ccccn1)c2ccncc2 CSC000412836 [0,2,0,0,0,0|2,0,0]=4 370 B18R2.3990 CC(NCc1ccccc1C)c2ccccc2 CSC000490119 [0,2,0,0,0,0|2,0,0]=4 371 B18R2.3990 CC(NCc1ccccc1C)c2ccccn2 CSC000494511 [0,2,0,0,0,0|1,0,0]=3 372 B18R2.3990 CC(NCc1ccccc1Cl)c2ccccc2 CSC000489988 [0,2,0,0,0,0|2,0,0]=4 373 B18R2.3990 CC(NCc1ccccc1F)c2ccccc2 CSC000500699 [0,2,0,0,0,0|2,0,0]=4 374 B18R2.3990 CC(NCc1ncccc1C)c2ccccn2 CSC008088360 [0,2,0,0,0,0|2,0,0]=4 375 B18R2.3990 Clc1ccccc1COC(=O)c2ccccn2 CSC046345178 [0,2,0,0,0,0|1,0,1]=4 376 B18R2.3990 Fc1ccccc1COC(=O)c2ccccn2 CSC048140722 [0,2,0,0,0,0|1,0,1]=4 377 B18R2.4001 Brc1ccccc1C(=O)NCc2ccccn2 CSC000250456 [0,2,0,0,0,0|1,0,1]=4 378 B18R2.4001 CC(NCc1ccccn1)c2ccccc2C CSC000496801 [0,2,0,0,0,0|1,0,0]=3 379 B18R2.4001 Cc1ccccc1C(=O)NCc2ccccn2 CSC046221563 [0,2,0,0,0,0|1,0,1]=4 380 B18R2.4001 Clc1ccccc1C(=O)NCc2ccccn2 CSC046154706 [0,2,0,0,0,0|1,0,1]=4 381 B18R2.4001 Nc1ccccc1C(=O)NCc2ccccn2 CSC000403520 [0,2,0,0,0,0|1,0,1]=4 382 B18R2.4001 Oc1ccccc1C(=O)NCc2ccccn2 CSC000581538 [0,2,0,0,0,0|1,0,1]=4 383 B18R2.6463 Cc1cccc(c1)C(=O)NCc2ccccn2 CSC046103901 [0,2,0,0,0,0|1,0,1]=4 384 B18R2.6467 CC(NCc1cccc(c1)Br)c2ccccc2 CSC000489910 [0,2,0,0,0,0|2,0,0]=4 385 B18R2.6467 CC(NCc1cccc(c1)C)c2ccccn2 CSC000494516 [0,2,0,0,0,0|1,0,0]=3 386 B18R2.6467 CC(NCc1cccc(c1)Cl)c2ccccc2 CSC000500697 [0,2,0,0,0,0|2,0,0]=4 387 B18R2.6467 C[C@@H](NCc1cccc(c1)Cl)c2ccccc2 CSC008133503 [0,2,0,0,0,0|2,0,0]=4 388 B18R2.6467 Cc1cccc(c1)COC(=O)c2ccccn2 CSC047483083 [0,2,0,0,0,0|1,0,1]=4 389 B18R2.32237 O=S(=O)(CCc1ccccc1)c2ccccc2 CSC046157769 [0,2,0,0,0,0|2,0,0]=4 390 B18R2.32237 O=S(=O)(NCc1ccccn1)c2ccccc2 CSC000587368 [0,2,0,0,0,0|2,0,0]=4 391 B18R2.445 CCc1ccccc1CNCc2ccccc2 CSC011663688 [0,2,0,0,0,0|2,0,0]=4 392 B18R2.445 CCc1ccccc1CNCc2ccccn2 CSC003293423 [0,2,0,0,0,0|1,0,0]=3 393 B18R2.445 COc1ccccc1CCNc2ncccn2 CSC000582656 [0,2,0,0,0,0|2,0,0]=4 394 B18R2.445 COc1ccccc1CNCc2ccccn2 CSC000493475 [0,2,0,0,0,0|1,0,0]=3 395 B18R2.445 N#Cc1cccnc1NCCc2ccccc2 CSC000384212 [0,2,0,0,0,0|1,0,0]=3 396 B18R2.3922 Cc1cccc(c1C)CNCc2ccccc2 CSC000195899 [0,2,0,0,0,0|2,0,0]=4 397 B18R2.3922 Clc1cccc(c1Cl)CNCc2ccccc2 CSC000200300 [0,2,0,0,0,0|2,0,0]=4 398 B18R2.3922 Clc1cccc(c1Cl)CNCc2ccccn2 CSC000606093 [0,2,0,0,0,0|1,0,0]=3 399 B18R2.6470 Clc1cccc(c1CNCc2ccccc2)Cl CSC000195868 [0,2,0,0,0,0|2,0,0]=4 400 B18R2.6470 Clc1cccc(c1CNCc2ccccn2)Cl CSC000602853 [0,2,0,0,0,0|1,0,0]=3 401 B18R2.6470 Clc1cccc(c1SCCc2ccccn2)Cl CSC046239737 [0,2,0,0,0,0|1,0,0]=3 402 B18R2.6470 Fc1cccc(c1CNCc2ccccc2)Cl CSC000186789 [0,2,0,0,0,0|2,0,0]=4 403 B18R2.6470 Fc1cccc(c1CNCc2ccccn2)Cl CSC000490212 [0,2,0,0,0,0|1,0,0]=3 404 B18R2.6544 Clc1ccc(c(c1)CNCc2ccccc2)Cl CSC011388590 [0,2,0,0,0,0|2,0,0]=4 405 B18R2.6544 Clc1ccc(c(c1)SCCc2ccccn2)Cl CSC046260676 [0,2,0,0,0,0|1,0,0]=3 406 B18R2.32674 Cc1ccccc1CNCc2ccccc2C CSC000494576 [0,2,0,0,0,0|2,0,0]=4 407 B18R2.32674 Cc1ccccc1CNCc2ccccc2Cl CSC000493739 [0,2,0,0,0,0|2,0,0]=4 408 B18R2.32674 Clc1ccccc1CNCc2ccccc2Cl CSC000493738 [0,2,0,0,0,0|2,0,0]=4 409 B18R2.32674 Fc1ccccc1CNCc2ccccc2Cl CSC000493741 [0,2,0,0,0,0|2,0,0]=4 410 B18R2.65882 Cc1cccc(c1)CNCc2ccccc2C CSC000494580 [0,2,0,0,0,0|2,0,0]=4 411 B18R2.65882 Cc1cccc(c1)CNCc2ccccc2Cl CSC000493743 [0,2,0,0,0,0|2,0,0]=4 412 B18R2.65882 Clc1cccc(c1)CNCc2ccccc2Cl CSC000392307 [0,2,0,0,0,0|2,0,0]=4 413 B18R2.65882 Clc1ccccc1CNCc2cccc(c2)Br CSC000390004 [0,2,0,0,0,0|2,0,0]=4 414 B18R2.1508 COc1cccc(c1)CCNc2ncccn2 CSC007828239 [0,2,0,0,0,0|2,0,0]=4 415 B18R2.1508 COc1cccc(c1)CNCc2ccccc2 CSC000195864 [0,2,0,0,0,0|2,0,0]=4 416 B18R2.1508 COc1cccc(c1)CNCc2ccccn2 CSC000602852 [0,2,0,0,0,0|1,0,0]=3 417 B18R2.3665 Cc1cc(cc(c1)CNCc2ccccc2)C CSC000224168 [0,2,0,0,0,0|2,0,0]=4 418 B18R2.3665 Cc1cc(nc(n1)C)NCCc2ccccc2 CSC000640855 [0,2,0,0,0,0|2,0,0]=4 419 B18R2.3665 Cc1cc(nc(n1)NCCc2ccccc2)C CSC000640856 [0,2,0,0,0,0|2,0,0]=4 420 B18R2.3665 Nc1cc(nc(n1)SCCc2ccccc2)N CSC000402308 [0,2,0,0,0,0|2,0,0]=4 421 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)C CSC000521862 [0,2,0,0,0,0|2,0,0]=4 422 B18R2.6482 Clc1cccc(c1)CNCc2cccc(c2)Cl CSC000392313 [0,2,0,0,0,0|2,0,0]=4 423 B18R3.12875 C(N1Cc2ccccc2C1)c3ccccc3 CSC000013268 [0,1,0,1,0,0|2,0,0]=4 424 B18R3.12875 C1C(Cc2c1cccc2)Nc3ccccc3 CSC015207558 [0,1,0,1,0,0|2,0,0]=4 425 B14R2.101 C(Nc1ccccc1)c2cc[nH]n2 CSC011332748 [0,0,0,0,2,0|2,0,0]=4 426 B14R2.101 C(Nc1ccccc1)c2cccs2 CSC000219589 [0,0,0,0,2,0|2,0,0]=4 427 B14R2.101 C(Nc1ccccn1)c2ccco2 CSC000156104 [0,0,0,0,2,0|2,0,0]=4 428 B14R2.101 C(Nc1ccccn1)c2ccsc2 CSC011381429 [0,0,0,0,2,0|2,0,0]=4 429 B14R2.101 C(Sc1ncc[nH]1)c2ccccc2 CSC009928223 [0,0,0,0,2,0|2,0,0]=4 430 B18R2.2525 C(CNCc1ccccc1)Cc2ccccc2 CSC000196569 [0,0,0,0,0,2|1,0,0]=3 431 B18R2.2525 C(CNCc1ccccc1)Cc2ccccc2 CSC000196569 [0,0,0,0,0,2|1,0,0]=3 432 B18R2.2525 C(CNCc1ccccn1)Cc2ccccc2 CSC000496100 [0,0,0,0,0,2|0,0,0]=2 433 B18R2.2525 C(CNCc1ccncc1)Cc2ccccc2 CSC000393651 [0,0,0,0,0,2|2,0,0]=4 434 B18R2.2525 C(COc1ccccc1)COc2ccccc2 CSC000489780 [0,0,0,0,0,2|1,0,0]=3 435 B18R2.2525 C(CSc1ccccn1)CSc2ccccn2 CSC025761933 [0,0,0,0,0,2|1,0,0]=3 436 B18R2.2525 C(NCc1ccccc1)C=Cc2ccccc2 CSC000187228 [0,0,0,0,0,2|1,0,1]=4