0 B16R2.132 Brc1ccc(cc1)CNc2ccccc2 CSC000188238 [0,0,0,0,0,0|3,0,0]=3 1 B16R2.132 Brc1ccc(cc1)CNc2ccccn2 CSC000186237 [0,0,0,0,0,0|4,0,0]=4 2 B16R2.132 Brc1ccc(cc1)COc2ccccc2 CSC000151822 [0,0,0,0,0,0|3,0,0]=3 3 B16R2.132 Brc1ccc(cc1)NCc2ccccn2 CSC000238286 [0,0,0,0,0,0|3,0,0]=3 4 B16R2.132 Brc1ccc(cc1)NCc2cccnc2 CSC000189165 [0,0,0,0,0,0|3,0,0]=3 5 B16R2.132 Brc1ccc(cc1)OCc2ccccc2 CSC000151783 [0,0,0,0,0,0|1,0,0]=1 6 B16R2.132 Brc1ccc(cc1)SCc2cccnc2 CSC009814484 [0,0,0,0,0,0|2,1,0]=3 7 B16R2.132 Brc1ccc(nc1)NCc2ccccc2 CSC000239955 [0,0,0,0,0,0|3,0,0]=3 8 B16R2.132 Brc1cnc(nc1)NCc2ccccc2 CSC011938770 [0,0,0,0,0,0|4,0,0]=4 9 B16R2.132 Brc1cnc(nc1)SCc2ccccc2 CSC011939521 [0,0,0,0,0,0|3,1,0]=4 10 B16R2.132 Cc1ccc(cc1)CNc2ccccc2 CSC000187236 [0,0,0,0,0,0|3,0,0]=3 11 B16R2.132 Cc1ccc(cc1)CNc2ccccn2 CSC000155969 [0,0,0,0,0,0|4,0,0]=4 12 B16R2.132 Cc1ccc(cc1)CNc2cccnc2 CSC000712801 [0,0,0,0,0,0|4,0,0]=4 13 B16R2.132 Cc1ccc(cc1)COc2ccccc2 CSC000151826 [0,0,0,0,0,0|3,0,0]=3 14 B16R2.132 Cc1ccc(cc1)CSc2ccccc2 CSC000000813 [0,0,0,0,0,0|3,0,0]=3 15 B16R2.132 Cc1ccc(cc1)NCc2ccncc2 CSC000187425 [0,0,0,0,0,0|3,0,0]=3 16 B16R2.132 Cc1ccc(cc1)OCc2ccccc2 CSC000151804 [0,0,0,0,0,0|1,0,0]=1 17 B16R2.132 Cc1ccc(cc1)SCc2ccccc2 CSC000006809 [0,0,0,0,0,0|1,1,0]=2 18 B16R2.132 Cc1ccc(cc1)SCc2cccnc2 CSC032853044 [0,0,0,0,0,0|2,1,0]=3 19 B16R2.132 Clc1ccc(cc1)CNc2ccccn2 CSC000156184 [0,0,0,0,0,0|4,0,0]=4 20 B16R2.132 Clc1ccc(cc1)COc2ccccc2 CSC000151820 [0,0,0,0,0,0|3,0,0]=3 21 B16R2.132 Clc1ccc(cc1)CSc2ccccc2 CSC000000820 [0,0,0,0,0,0|3,0,0]=3 22 B16R2.132 Clc1ccc(cc1)NCc2ccccn2 CSC000742532 [0,0,0,0,0,0|3,0,0]=3 23 B16R2.132 Clc1ccc(cc1)NCc2cccnc2 CSC000187240 [0,0,0,0,0,0|3,0,0]=3 24 B16R2.132 Clc1ccc(cc1)OCc2ccccc2 CSC000151798 [0,0,0,0,0,0|1,0,0]=1 25 B16R2.132 Clc1ccc(cc1)SCc2cccnc2 CSC000024806 [0,0,0,0,0,0|2,1,0]=3 26 B16R2.132 Clc1ccc(cc1)SCc2ccncc2 CSC048345669 [0,0,0,0,0,0|2,1,0]=3 27 B16R2.132 Fc1ccc(cc1)CNc2ccccn2 CSC000156842 [0,0,0,0,0,0|4,0,0]=4 28 B16R2.132 Fc1ccc(cc1)COc2ccccc2 CSC000151825 [0,0,0,0,0,0|3,0,0]=3 29 B16R2.132 Fc1ccc(cc1)CSc2ccccc2 CSC000000824 [0,0,0,0,0,0|3,0,0]=3 30 B16R2.132 Fc1ccc(cc1)NCc2ccccc2 CSC000187247 [0,0,0,0,0,0|2,0,0]=2 31 B16R2.132 Fc1ccc(cc1)NCc2ccccn2 CSC000742618 [0,0,0,0,0,0|3,0,0]=3 32 B16R2.132 Fc1ccc(cc1)NCc2cccnc2 CSC000187043 [0,0,0,0,0,0|3,0,0]=3 33 B16R2.132 Fc1ccc(cc1)NCc2ccncc2 CSC000187248 [0,0,0,0,0,0|3,0,0]=3 34 B16R2.132 Fc1ccc(cc1)OCc2ccccc2 CSC000151815 [0,0,0,0,0,0|1,0,0]=1 35 B16R2.132 Fc1ccc(cc1)SCc2ccccc2 CSC047495018 [0,0,0,0,0,0|1,1,0]=2 36 B16R2.132 Ic1ccc(cc1)CNc2ccccc2 CSC000188239 [0,0,0,0,0,0|3,0,0]=3 37 B16R2.132 Oc1ccc(cc1)SCc2ccccc2 CSC011362052 [0,0,0,0,0,0|0,1,0]=1 38 B15R2.2195 C(Nc1ccccc1)c2ccccc2 CSC000188819 [1,0,0,0,0,0|1,0,0]=2 39 B15R2.2195 C(Nc1ccccc1)c2cccnc2 CSC011211160 [1,0,0,0,0,0|2,0,0]=3 40 B15R2.2195 C(Nc1ccccn1)c2ccccn2 CSC000156431 [1,0,0,0,0,0|3,0,0]=4 41 B15R2.2195 C(Nc1ccccn1)c2cccnc2 CSC000156437 [1,0,0,0,0,0|3,0,0]=4 42 B15R2.2195 C(Nc1cccnc1)c2ccccc2 CSC011230970 [1,0,0,0,0,0|2,0,0]=3 43 B15R2.2195 C(Oc1ccncc1)c2ccccc2 CSC000045163 [1,0,0,0,0,0|1,0,0]=2 44 B15R2.2195 C(Sc1ccccc1)c2ccccc2 CSC000000821 [1,0,0,0,0,0|0,1,0]=2 45 B15R2.2195 C(Sc1ccccc1)c2cccnc2 CSC000044157 [1,0,0,0,0,0|1,1,0]=3 46 B15R2.2195 C(Sc1ccccn1)c2ccccn2 CSC000031117 [1,0,0,0,0,0|2,1,0]=4 47 B15R2.2195 C(Sc1ncccn1)c2ccccc2 CSC000000291 [1,0,0,0,0,0|2,1,0]=4 48 B17R2.48 CCc1ccc(cc1)NCc2ccccc2 CSC000186842 [0,1,0,0,0,0|2,0,0]=3 49 B17R2.48 COc1ccc(cc1)CNc2cccnc2 CSC000284450 [0,1,0,0,0,0|3,0,0]=4 50 B17R2.48 COc1ccc(cc1)CSc2ccccc2 CSC047260545 [0,1,0,0,0,0|2,0,0]=3 51 B17R2.48 COc1ccc(cc1)CSc2ccccn2 CSC047961020 [0,1,0,0,0,0|3,0,0]=4 52 B17R2.48 COc1ccc(cc1)OCc2ccccc2 CSC000001255 [0,1,0,0,0,0|0,0,0]=1 53 B17R2.48 COc1ccc(cc1)SCc2ccccc2 CSC000007071 [0,1,0,0,0,0|0,1,0]=2 54 B17R2.48 COc1ccc(cc1)SCc2cccnc2 CSC047739140 [0,1,0,0,0,0|1,1,0]=3 55 B17R2.48 CSc1ccc(cc1)CNc2ccccc2 CSC000262137 [0,1,0,0,0,0|2,1,0]=4 56 B17R2.48 N#Cc1ccc(cc1)COc2ccccc2 CSC000248810 [0,1,0,0,0,0|3,0,0]=4 57 B17R2.48 N#Cc1ccc(cc1)CSc2ccccc2 CSC000248151 [0,1,0,0,0,0|3,0,0]=4 58 B17R2.48 N#Cc1ccc(cc1)NCc2ccccc2 CSC000234318 [0,1,0,0,0,0|2,0,0]=3 59 B17R2.48 N#Cc1ccc(cc1)OCc2ccccc2 CSC000151850 [0,1,0,0,0,0|1,0,0]=2 60 B17R2.48 N#Cc1ccc(cc1)OCc2cccnc2 CSC000296873 [0,1,0,0,0,0|2,0,0]=3 61 B17R2.48 N#Cc1ccc(cc1)SCc2ccccc2 CSC000282417 [0,1,0,0,0,0|1,1,0]=3 62 B17R2.48 N#Cc1ncc(cn1)OCc2ccccc2 CSC010212502 [0,1,0,0,0,0|3,0,0]=4 63 B17R2.48 NCc1ccc(cc1)OCc2ccccn2 CSC000287709 [0,1,0,0,0,0|2,0,0]=3 64 B17R2.48 OCc1ccc(cc1)COc2ccccc2 CSC005794414 [0,1,0,0,0,0|2,0,0]=3 65 B17R2.48 OCc1ccc(cc1)OCc2cccnc2 CSC000299152 [0,1,0,0,0,0|1,0,0]=2 66 B17R2.48 OCc1ccc(cn1)OCc2ccccc2 CSC012343989 [0,1,0,0,0,0|1,0,0]=2 67 B17R2.192 Brc1ccc(cc1)C(=O)Oc2ccccc2 CSC009811611 [0,1,0,0,0,0|3,0,0]=4 68 B17R2.192 Cc1ccc(cc1)C(=O)Nc2ccccc2 CSC000249605 [0,1,0,0,0,0|3,0,0]=4 69 B17R2.192 Cc1ccc(cc1)C(=O)Oc2ccccc2 CSC028538067 [0,1,0,0,0,0|3,0,0]=4 70 B17R2.192 Cc1ccc(cc1)S(=O)Cc2ccccc2 CSC000064352 [0,1,0,0,0,0|1,1,0]=3 71 B17R2.192 Clc1ccc(cc1)C(=O)Oc2ccccc2 CSC029575162 [0,1,0,0,0,0|3,0,0]=4 72 B17R2.192 Fc1ccc(cc1)C(=O)Nc2ccccc2 CSC000153475 [0,1,0,0,0,0|3,0,0]=4 73 B17R2.192 Fc1ccc(cc1)C(=O)Oc2ccccc2 CSC032946694 [0,1,0,0,0,0|3,0,0]=4 74 B17R2.192 Nc1ccc(cc1)C(=O)Nc2ccccc2 CSC012350528 [0,1,0,0,0,0|3,0,0]=4 75 B17R2.193 Cc1cc(ccc1Br)NCc2ccccn2 CSC000303279 [0,1,0,0,0,0|3,0,0]=4 76 B17R2.193 Cc1cc(ccc1Br)NCc2ccncc2 CSC000278145 [0,1,0,0,0,0|3,0,0]=4 77 B17R2.193 Cc1ccc(cc1C)NCc2ccccc2 CSC000187031 [0,1,0,0,0,0|2,0,0]=3 78 B17R2.193 Cc1ccc(cc1C)NCc2ccccn2 CSC000291920 [0,1,0,0,0,0|3,0,0]=4 79 B17R2.193 Cc1ccc(cc1C)NCc2cccnc2 CSC000261750 [0,1,0,0,0,0|3,0,0]=4 80 B17R2.193 Clc1ccc(cc1Cl)CNc2ccccc2 CSC000262121 [0,1,0,0,0,0|3,0,0]=4 81 B17R2.193 Fc1ccc(cc1Cl)NCc2ccccc2 CSC000186866 [0,1,0,0,0,0|2,0,0]=3 82 B17R2.193 Fc1ccc(cc1Cl)NCc2cccnc2 CSC000262397 [0,1,0,0,0,0|3,0,0]=4 83 B17R2.193 Fc1ccc(cc1F)CSc2ccccc2 CSC000016553 [0,1,0,0,0,0|3,0,0]=4 84 B17R2.207 Cc1ccc(cc1)CNc2ccc(cc2)C CSC000261855 [0,1,0,0,0,0|2,0,0]=3 85 B17R2.207 Cc1ccc(cc1)CNc2ccc(cc2)Cl CSC000261807 [0,1,0,0,0,0|2,0,0]=3 86 B17R2.207 Cc1ccc(cc1)CNc2ccc(cc2)F CSC000262376 [0,1,0,0,0,0|2,0,0]=3 87 B17R2.207 Cc1ccc(cc1)CSc2ccc(cc2)F CSC047342678 [0,1,0,0,0,0|1,1,0]=3 88 B17R2.207 Cc1ccc(cc1)NCc2ccc(cc2)Br CSC000273778 [0,1,0,0,0,0|2,0,0]=3 89 B17R2.207 Cc1ccc(cc1)NCc2ccc(cc2)Cl CSC000262275 [0,1,0,0,0,0|2,0,0]=3 90 B17R2.207 Cc1ccc(cc1)NCc2ccc(cc2)F CSC000261759 [0,1,0,0,0,0|2,0,0]=3 91 B17R2.207 Cc1ccc(cc1)NCc2ccc(cc2)I CSC000273779 [0,1,0,0,0,0|2,0,0]=3 92 B17R2.207 Cc1ccc(cc1)SCc2ccc(cc2)F CSC000006701 [0,1,0,0,0,0|1,1,0]=3 93 B17R2.207 Clc1ccc(cc1)CNc2ccc(cn2)Br CSC000239954 [0,1,0,0,0,0|3,0,0]=4 94 B17R2.207 Fc1ccc(cc1)COc2ccc(cc2)Br CSC000151787 [0,1,0,0,0,0|1,0,0]=2 95 B17R2.207 Fc1ccc(cc1)CSc2ccc(cc2)F CSC000000082 [0,1,0,0,0,0|1,1,0]=3 96 B17R2.207 Fc1ccc(cc1)NCc2ccc(cc2)Br CSC000262168 [0,1,0,0,0,0|2,0,0]=3 97 B17R2.207 Fc1ccc(cc1)NCc2ccc(cc2)Cl CSC000262375 [0,1,0,0,0,0|2,0,0]=3 98 B17R2.207 Fc1ccc(cc1)NCc2ccc(cc2)I CSC000262458 [0,1,0,0,0,0|2,0,0]=3 99 B17R2.207 Fc1ccc(cc1)OCc2ccc(cc2)Br CSC000151816 [0,1,0,0,0,0|1,0,0]=2 100 B17R2.209 Brc1ccc(cc1)NC(=O)c2ccccc2 CSC000153585 [0,1,0,0,0,0|2,0,1]=4 101 B17R2.209 Brc1ccc(cc1)OC(=O)c2ccccc2 CSC009811600 [0,1,0,0,0,0|1,0,1]=3 102 B17R2.209 Brc1ccc(cc1)OC(=O)c2cccnc2 CSC021553122 [0,1,0,0,0,0|2,0,1]=4 103 B17R2.209 CC(Nc1ccc(cc1)C)c2ccccc2 CSC017095269 [0,1,0,0,0,0|2,0,0]=3 104 B17R2.209 CN(Cc1ccc(cc1)Cl)c2ccccc2 CSC048233832 [0,1,0,0,0,0|3,0,0]=4 105 B17R2.209 CN(Cc1ccc(cc1)F)c2ccccc2 CSC046578148 [0,1,0,0,0,0|3,0,0]=4 106 B17R2.209 Cc1ccc(cc1)OC(=O)c2ccccc2 CSC000001893 [0,1,0,0,0,0|1,0,1]=3 107 B17R2.209 Cc1ccc(cc1)OC(=O)c2cccnc2 CSC000001890 [0,1,0,0,0,0|2,0,1]=4 108 B17R2.209 Clc1ccc(cc1)OC(=O)c2ccccc2 CSC000001870 [0,1,0,0,0,0|1,0,1]=3 109 B17R2.209 Fc1ccc(cc1)OC(=O)c2ccccc2 CSC046475016 [0,1,0,0,0,0|1,0,1]=3 110 B17R2.209 Fc1ccc(cc1)OC(=O)c2cccnc2 CSC038743143 [0,1,0,0,0,0|2,0,1]=4 111 B17R2.209 Ic1ccc(cc1)NC(=O)c2ccccc2 CSC000155230 [0,1,0,0,0,0|2,0,1]=4 112 B17R2.215 Cc1ccc(cc1)CNc2cccc(c2)C CSC000277117 [0,1,0,0,0,0|3,0,0]=4 113 B17R2.215 Cc1ccc(cc1)NCc2cccc(c2)Cl CSC000273780 [0,1,0,0,0,0|2,0,0]=3 114 B17R2.215 Cc1ccc(cc1)NCc2cccc(c2)O CSC000303909 [0,1,0,0,0,0|2,0,0]=3 115 B17R2.215 Cc1ccc(cc1)SCc2cccc(c2)F CSC046673442 [0,1,0,0,0,0|1,1,0]=3 116 B17R2.215 Cc1cccc(c1)CSc2ccc(cc2)F CSC047939259 [0,1,0,0,0,0|1,1,0]=3 117 B17R2.215 Cc1cccc(c1)NCc2ccc(cc2)Br CSC000277113 [0,1,0,0,0,0|3,0,0]=4 118 B17R2.215 Cc1cccc(c1)NCc2ccc(cc2)Cl CSC000277112 [0,1,0,0,0,0|3,0,0]=4 119 B17R2.215 Fc1ccc(cc1)COc2cccc(c2)Br CSC000151844 [0,1,0,0,0,0|3,0,0]=4 120 B17R2.215 Fc1ccc(cc1)NCc2cccc(c2)Br CSC000261650 [0,1,0,0,0,0|2,0,0]=3 121 B17R2.215 Fc1ccc(cc1)OCc2cccc(c2)Br CSC000173241 [0,1,0,0,0,0|1,0,0]=2 122 B17R2.215 Fc1ccc(cc1)SCc2cccc(c2)F CSC000000076 [0,1,0,0,0,0|1,1,0]=3 123 B17R2.215 Fc1cccc(c1)COc2ccc(cc2)Br CSC000151790 [0,1,0,0,0,0|1,0,0]=2 124 B17R2.215 Fc1cccc(c1)OCc2ccc(cc2)Br CSC000151862 [0,1,0,0,0,0|3,0,0]=4 125 B17R2.215 Nc1cccc(c1)COc2ccc(cc2)Cl CSC000293987 [0,1,0,0,0,0|1,0,0]=2 126 B17R2.496 Cc1ccc(cc1)CNc2ccccc2C CSC000262164 [0,1,0,0,0,0|3,0,0]=4 127 B17R2.496 Cc1ccc(cc1)N=Cc2ccccc2O CSC028498728 [0,1,0,0,0,0|2,0,1]=4 128 B17R2.496 Cc1ccc(cc1)NCc2ccccc2C CSC000273776 [0,1,0,0,0,0|2,0,0]=3 129 B17R2.496 Cc1ccc(cc1)NCc2ccccc2Cl CSC000273777 [0,1,0,0,0,0|2,0,0]=3 130 B17R2.496 Cc1ccc(cc1)NCc2ccccc2F CSC000262315 [0,1,0,0,0,0|2,0,0]=3 131 B17R2.496 Cc1ccc(cc1)SCc2ccccc2F CSC048928133 [0,1,0,0,0,0|1,1,0]=3 132 B17R2.496 Cc1ccccc1CNc2ccc(cc2)F CSC000262167 [0,1,0,0,0,0|2,0,0]=3 133 B17R2.496 Cc1ccccc1NCc2ccc(cc2)Br CSC000262451 [0,1,0,0,0,0|3,0,0]=4 134 B17R2.496 Cc1ccccc1NCc2ccc(cc2)Cl CSC000262314 [0,1,0,0,0,0|3,0,0]=4 135 B17R2.496 Cc1ccccc1NCc2ccc(cc2)I CSC000262166 [0,1,0,0,0,0|3,0,0]=4 136 B17R2.496 Fc1ccc(cc1)COc2ccccc2Br CSC000151720 [0,1,0,0,0,0|3,0,0]=4 137 B17R2.496 Fc1ccc(cc1)SCc2ccccc2F CSC000000077 [0,1,0,0,0,0|1,1,0]=3 138 B17R2.496 Fc1ccccc1CNc2ccc(cc2)Cl CSC000262134 [0,1,0,0,0,0|2,0,0]=3 139 B17R2.496 Fc1ccccc1COc2ccc(cc2)Br CSC000151781 [0,1,0,0,0,0|1,0,0]=2 140 B17R2.496 Fc1ccccc1OCc2ccc(cc2)Br CSC000151778 [0,1,0,0,0,0|3,0,0]=4 141 B17R2.496 Oc1ccccc1C=Nc2ccc(cc2)Cl CSC046238273 [0,1,0,0,0,0|2,0,1]=4 142 B17R2.496 Oc1ccccc1C=Nc2ccc(cc2)F CSC037196000 [0,1,0,0,0,0|2,0,1]=4 143 B17R2.5360 Cc1cc(ccc1NCc2ccccc2)Br CSC000215941 [0,1,0,0,0,0|2,0,0]=3 144 B17R2.5360 Cc1cc(ccc1NCc2cccnc2)Br CSC000291918 [0,1,0,0,0,0|3,0,0]=4 145 B17R2.5360 Cc1cc(ccc1NCc2cccnc2)F CSC000291915 [0,1,0,0,0,0|3,0,0]=4 146 B17R2.5360 Cc1ccc(c(c1)Br)NCc2cccnc2 CSC000282767 [0,1,0,0,0,0|3,0,0]=4 147 B17R2.5360 Cc1ccc(c(c1)Br)NCc2ccncc2 CSC000278592 [0,1,0,0,0,0|3,0,0]=4 148 B17R2.5360 Cc1ccc(c(c1)C)NCc2ccccc2 CSC000224092 [0,1,0,0,0,0|2,0,0]=3 149 B17R2.5360 Cc1ccc(c(c1)C)NCc2ccccn2 CSC000302654 [0,1,0,0,0,0|3,0,0]=4 150 B17R2.5360 Clc1ccc(c(c1)Cl)CNc2ccccc2 CSC000261766 [0,1,0,0,0,0|3,0,0]=4 151 B17R2.5360 Clc1ccc(c(c1)Cl)NCc2ccccc2 CSC000215940 [0,1,0,0,0,0|2,0,0]=3 152 B17R2.5360 Fc1cc(ccc1OCc2ccccc2)Br CSC009811563 [0,1,0,0,0,0|1,0,0]=2 153 B17R2.5360 Fc1cc(cnc1NCc2ccccc2)Cl CSC012357441 [0,1,0,0,0,0|3,0,0]=4 154 B17R2.5360 Fc1ccc(c(c1)Br)OCc2ccccc2 CSC000151671 [0,1,0,0,0,0|1,0,0]=2 155 B15R2.29 Fc1ccc(cc1)Oc2ncccn2 CSC032195680 [0,0,0,0,1,0|3,0,0]=4 156 B15R2.29 Ic1ccc(cc1)Oc2ncccn2 CSC000173529 [0,0,0,0,1,0|3,0,0]=4 157 B15R2.100 Brc1ccc(cc1)NCc2ccco2 CSC000238346 [0,0,0,0,1,0|3,0,0]=4 158 B15R2.100 Clc1ccc(cc1)NCc2cccs2 CSC000189042 [0,0,0,0,1,0|3,0,0]=4 159 B15R2.100 Clc1ccc(cc1)NCc2ccsc2 CSC000215781 [0,0,0,0,1,0|3,0,0]=4 160 B17R2.216 Brc1ccc(cc1)CNCc2cccnc2 CSC000261655 [0,0,0,0,0,1|3,0,0]=4 161 B17R2.216 Brc1ccc(cc1)CNCc2ccncc2 CSC000262445 [0,0,0,0,0,1|3,0,0]=4 162 B17R2.216 Brc1ccc(cc1)SCCc2ccccn2 CSC041168514 [0,0,0,0,0,1|2,1,0]=4 163 B17R2.216 Brc1ccc(cc1)SCCc2ccncc2 CSC009812605 [0,0,0,0,0,1|2,1,0]=4 164 B17R2.216 Cc1ccc(cc1)CNCc2cccnc2 CSC000261654 [0,0,0,0,0,1|3,0,0]=4 165 B17R2.216 Cc1ccc(cc1)CNCc2ccncc2 CSC000266118 [0,0,0,0,0,1|3,0,0]=4 166 B17R2.216 Cc1ccc(cc1)SCCc2ccccn2 CSC029896541 [0,0,0,0,0,1|2,1,0]=4 167 B17R2.216 Cc1ccc(cc1)SCCc2ccncc2 CSC033376349 [0,0,0,0,0,1|2,1,0]=4 168 B17R2.216 Clc1ccc(cc1)CNCc2ccccc2 CSC000187221 [0,0,0,0,0,1|2,0,0]=3 169 B17R2.216 Clc1ccc(cc1)CNCc2ccccn2 CSC000266102 [0,0,0,0,0,1|3,0,0]=4 170 B17R2.216 Clc1ccc(cc1)CNCc2cccnc2 CSC000261368 [0,0,0,0,0,1|3,0,0]=4 171 B17R2.216 Clc1ccc(cc1)CNCc2ccncc2 CSC000266115 [0,0,0,0,0,1|3,0,0]=4 172 B17R2.216 Fc1ccc(cc1)CNCc2ccccc2 CSC000186788 [0,0,0,0,0,1|2,0,0]=3 173 B17R2.216 Fc1ccc(cc1)CNCc2ccccn2 CSC000262139 [0,0,0,0,0,1|3,0,0]=4 174 B17R2.216 Fc1ccc(cc1)CNCc2cccnc2 CSC000262393 [0,0,0,0,0,1|3,0,0]=4 175 B17R2.216 Fc1ccc(cc1)CNCc2ccncc2 CSC000262127 [0,0,0,0,0,1|3,0,0]=4 176 B17R2.216 Fc1ccc(cc1)SCCc2ccccn2 CSC031655834 [0,0,0,0,0,1|2,1,0]=4 177 B17R2.216 Fc1ccc(cc1)SCCc2ccncc2 CSC048863826 [0,0,0,0,0,1|2,1,0]=4 178 B16R2.71 Brc1ccccc1NCc2ccccc2 CSC000224041 [1,1,0,0,0,0|1,0,0]=3 179 B16R2.71 Brc1ccccc1NCc2ccncc2 CSC000224054 [1,1,0,0,0,0|2,0,0]=4 180 B16R2.71 Brc1ccccc1OCc2ccccn2 CSC011214837 [1,1,0,0,0,0|1,0,0]=3 181 B16R2.71 Cc1ccccc1CNc2ccccc2 CSC000188235 [1,1,0,0,0,0|1,0,0]=3 182 B16R2.71 Cc1ccccc1CNc2ccccn2 CSC000176107 [1,1,0,0,0,0|2,0,0]=4 183 B16R2.71 Cc1ccccc1NCc2ccccc2 CSC000188381 [1,1,0,0,0,0|1,0,0]=3 184 B16R2.71 Clc1ccccc1CNc2ccccc2 CSC000188236 [1,1,0,0,0,0|1,0,0]=3 185 B16R2.71 Clc1ccccc1CNc2ccccn2 CSC000156637 [1,1,0,0,0,0|2,0,0]=4 186 B16R2.71 Clc1ccccc1COc2ccccc2 CSC000151824 [1,1,0,0,0,0|0,0,0]=2 187 B16R2.71 Clc1ccccc1CSc2ccccc2 CSC000000823 [1,1,0,0,0,0|0,1,0]=3 188 B16R2.71 Clc1ccccc1CSc2ccccn2 CSC000006456 [1,1,0,0,0,0|1,1,0]=4 189 B16R2.71 Fc1ccccc1CNc2ccccn2 CSC000156009 [1,1,0,0,0,0|2,0,0]=4 190 B16R2.71 Fc1ccccc1CSc2ccccc2 CSC000000819 [1,1,0,0,0,0|0,1,0]=3 191 B16R2.71 Fc1ccccc1NCc2ccccc2 CSC000224932 [1,1,0,0,0,0|1,0,0]=3 192 B16R2.71 Oc1ccccc1C=Nc2ccccc2 CSC032043572 [1,1,0,0,0,0|1,0,1]=4 193 B16R2.88 CC(Nc1ccccc1)c2ccccn2 CSC011230782 [1,1,0,0,0,0|2,0,0]=4 194 B16R2.88 CN(Cc1ccccc1)c2ccccc2 CSC000006973 [1,1,0,0,0,0|1,0,0]=3 195 B16R2.88 CN(Cc1cccnc1)c2ccccc2 CSC047003010 [1,1,0,0,0,0|2,0,0]=4 196 B16R2.88 O=C(Nc1ccccc1)c2ccccc2 CSC000153489 [1,1,0,0,0,0|1,0,1]=4 197 B16R2.88 O=S(Cc1ccccc1)c2ccccc2 CSC000064345 [1,1,0,0,0,0|0,1,0]=3 198 B16R2.252 Brc1cccc(c1)OCc2ccccc2 CSC000151840 [1,1,0,0,0,0|0,0,0]=2 199 B16R2.252 Brc1cccc(c1)OCc2ccccn2 CSC011214830 [1,1,0,0,0,0|1,0,0]=3 200 B16R2.252 Brc1ccnc(c1)NCc2ccccc2 CSC010191162 [1,1,0,0,0,0|2,0,0]=4 201 B16R2.252 Cc1cccc(c1)NCc2ccncc2 CSC000224075 [1,1,0,0,0,0|2,0,0]=4 202 B16R2.252 Cc1cccc(c1)SCc2ccccc2 CSC000055753 [1,1,0,0,0,0|0,1,0]=3 203 B16R2.252 Cc1cccc(n1)NCc2ccccc2 CSC011215723 [1,1,0,0,0,0|2,0,0]=4 204 B16R2.252 Cc1ccnc(c1)NCc2ccccc2 CSC000239948 [1,1,0,0,0,0|2,0,0]=4 205 B16R2.252 Clc1cccc(c1)CNc2ccccn2 CSC000156640 [1,1,0,0,0,0|2,0,0]=4 206 B16R2.252 Clc1cccc(c1)CSc2ccccc2 CSC000000822 [1,1,0,0,0,0|0,1,0]=3 207 B16R2.252 Clc1cccc(c1)NCc2ccccc2 CSC000224541 [1,1,0,0,0,0|1,0,0]=3 208 B16R2.252 Fc1cccc(c1)CNc2ccccn2 CSC000239960 [1,1,0,0,0,0|2,0,0]=4 209 B16R2.252 Fc1cccc(c1)COc2ccccc2 CSC000151828 [1,1,0,0,0,0|0,0,0]=2 210 B16R2.252 Fc1cccc(c1)CSc2ccccc2 CSC000000815 [1,1,0,0,0,0|0,1,0]=3 211 B16R2.252 Fc1cccc(c1)CSc2ccccn2 CSC000006702 [1,1,0,0,0,0|1,1,0]=4 212 B16R2.252 Fc1cccc(c1)OCc2ccccc2 CSC000151861 [1,1,0,0,0,0|0,0,0]=2 213 B16R2.252 Nc1cccc(c1)COc2ccccc2 CSC000743254 [1,1,0,0,0,0|0,0,0]=2 214 B16R2.252 Nc1cccc(c1)CSc2ccccn2 CSC000747872 [1,1,0,0,0,0|1,1,0]=4 215 B16R2.252 Oc1cccc(c1)CNc2ccccc2 CSC011230791 [1,1,0,0,0,0|1,0,0]=3 216 B16R2.2 COc1ccc(cc1)Cc2ccccc2 CSC000065633 [0,1,0,0,1,0|0,0,0]=2 217 B16R2.2 NCc1ccc(cc1)Oc2ccccn2 CSC011219347 [0,1,0,0,1,0|2,0,0]=4 218 B18R2.61 COc1ccc(cc1)CNCc2ccccn2 CSC000602850 [0,1,0,0,0,1|2,0,0]=4 219 B18R2.61 COc1ccc(cc1)CNCc2cccnc2 CSC000493498 [0,1,0,0,0,1|2,0,0]=4 220 B18R2.61 COc1ccc(cc1)CNCc2ccncc2 CSC000493484 [0,1,0,0,0,1|2,0,0]=4 221 B18R2.61 COc1ccc(cc1)SCCc2ccncc2 CSC046124326 [0,1,0,0,0,1|1,1,0]=4 222 B18R2.61 CSc1ccc(cc1)CNCc2ccccc2 CSC000195867 [0,1,0,0,0,1|1,1,0]=4 223 B18R2.61 N#Cc1ccc(cc1)OCCc2ccccc2 CSC000490293 [0,1,0,0,0,1|1,0,0]=3 224 B18R2.253 Brc1ccc(cc1)C(=O)CSc2ccccc2 CSC000248155 [0,1,0,0,0,1|2,0,0]=4 225 B18R2.253 Brc1ccc(cc1)C(=O)NCc2ccccc2 CSC000153122 [0,1,0,0,0,1|2,0,0]=4 226 B18R2.253 Brc1ccc(cc1)C(=O)OCc2ccccc2 CSC009811551 [0,1,0,0,0,1|1,0,0]=3 227 B18R2.253 Cc1ccc(cc1)C(=O)CSc2ccccc2 CSC000248157 [0,1,0,0,0,1|2,0,0]=4 228 B18R2.253 Cc1ccc(cc1)C(=O)NCc2ccccc2 CSC000153169 [0,1,0,0,0,1|2,0,0]=4 229 B18R2.253 Cc1ccc(cc1)C(=O)OCc2ccccc2 CSC000000260 [0,1,0,0,0,1|1,0,0]=3 230 B18R2.253 Clc1ccc(cc1)C(=O)CSc2ccccc2 CSC000248152 [0,1,0,0,0,1|2,0,0]=4 231 B18R2.253 Clc1ccc(cc1)C(=O)NCc2ccccc2 CSC000153127 [0,1,0,0,0,1|2,0,0]=4 232 B18R2.253 Clc1ccc(cc1)C(=O)OCc2ccccn2 CSC048509729 [0,1,0,0,0,1|2,0,0]=4 233 B18R2.253 Fc1ccc(cc1)C(=O)NCc2ccccc2 CSC000153124 [0,1,0,0,0,1|2,0,0]=4 234 B18R2.253 Fc1ccc(cc1)C(=O)OCc2ccccc2 CSC000150330 [0,1,0,0,0,1|1,0,0]=3 235 B18R2.253 Nc1ccc(cc1)C(=O)NCc2ccccc2 CSC015186760 [0,1,0,0,0,1|2,0,0]=4 236 B18R2.257 Brc1ccc(cc1)COC(=O)c2ccccc2 CSC049087585 [0,1,0,0,0,1|1,0,1]=4 237 B18R2.257 CC(NCc1ccc(cc1)Br)c2ccccc2 CSC000595519 [0,1,0,0,0,1|2,0,0]=4 238 B18R2.257 CC(NCc1ccc(cc1)C)c2ccccc2 CSC000489909 [0,1,0,0,0,1|2,0,0]=4 239 B18R2.257 CC(NCc1ccc(cc1)Cl)c2ccccc2 CSC000489924 [0,1,0,0,0,1|2,0,0]=4 240 B18R2.257 CC(NCc1ccc(cc1)F)c2ccccc2 CSC000489925 [0,1,0,0,0,1|2,0,0]=4 241 B18R2.257 C[C@H](NCc1ccc(cc1)F)c2ccccc2 CSC003442034 [0,1,0,0,0,1|2,0,0]=4 242 B18R2.257 Cc1ccc(cc1)COC(=O)c2ccccc2 CSC046119931 [0,1,0,0,0,1|1,0,1]=4 243 B18R2.257 Cc1ccc(cc1)SCC(=O)c2ccccc2 CSC000257770 [0,1,0,0,0,1|1,1,0]=4 244 B18R2.257 Clc1ccc(cc1)COC(=O)c2ccccc2 CSC046145778 [0,1,0,0,0,1|1,0,1]=4 245 B18R2.257 Clc1ccc(cc1)OCC(=O)c2ccccc2 CSC000247975 [0,1,0,0,0,1|1,0,0]=3 246 B18R2.257 Clc1ccc(cc1)SCC(=O)c2ccccc2 CSC000247988 [0,1,0,0,0,1|1,1,0]=4 247 B18R2.257 Fc1ccc(cc1)COC(=O)c2ccccc2 CSC047862238 [0,1,0,0,0,1|1,0,1]=4 248 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cc2)Cl CSC000006958 [0,1,0,0,0,1|2,0,0]=4 249 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cc2)F CSC000006961 [0,1,0,0,0,1|2,0,0]=4 250 B18R2.266 Oc1ccc(cc1)CC(=O)Nc2ccccc2 CSC020626308 [0,1,0,0,0,1|1,0,1]=4 251 B18R2.266 Oc1ccc(cc1)NC(=O)Nc2ccccc2 CSC000637676 [0,1,0,0,0,1|1,0,1]=4 252 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)Br CSC000494166 [0,1,0,0,0,1|2,0,0]=4 253 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)C CSC000603366 [0,1,0,0,0,1|2,0,0]=4 254 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)C CSC000603366 [0,1,0,0,0,1|2,0,0]=4 255 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)Cl CSC000493758 [0,1,0,0,0,1|2,0,0]=4 256 B18R2.269 Cc1cccc(c1)CNCc2ccc(cc2)F CSC000603284 [0,1,0,0,0,1|2,0,0]=4 257 B18R2.269 Fc1ccc(cc1)CNCc2cccc(c2)Br CSC000490458 [0,1,0,0,0,1|2,0,0]=4 258 B18R2.269 Fc1ccc(cc1)CNCc2cccc(c2)Cl CSC000490461 [0,1,0,0,0,1|2,0,0]=4 259 B18R2.274 Brc1ccc(cc1)CNCc2ccc(cc2)Br CSC000519473 [0,1,0,0,0,1|2,0,0]=4 260 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)C CSC000392503 [0,1,0,0,0,1|2,0,0]=4 261 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)C CSC000392503 [0,1,0,0,0,1|2,0,0]=4 262 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)F CSC000490198 [0,1,0,0,0,1|2,0,0]=4 263 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cc2)Br CSC000596538 [0,1,0,0,0,1|2,0,0]=4 264 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cc2)Cl CSC000490199 [0,1,0,0,0,1|2,0,0]=4 265 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cc2)F CSC000490200 [0,1,0,0,0,1|2,0,0]=4 266 B18R2.4060 Cc1ccc(c(c1)C)CNCc2ccccc2 CSC000195885 [0,1,0,0,0,1|2,0,0]=4 267 B18R2.4060 Clc1ccc(c(c1)Cl)CNCc2ccccc2 CSC000187938 [0,1,0,0,0,1|2,0,0]=4 268 B18R2.8976 Cc1ccc(cc1C)CNCc2ccccc2 CSC000195900 [0,1,0,0,0,1|2,0,0]=4 269 B18R2.8976 Clc1ccc(cc1Cl)CNCc2ccccc2 CSC000195857 [0,1,0,0,0,1|2,0,0]=4 270 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2C CSC000392502 [0,1,0,0,0,1|2,0,0]=4 271 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2C CSC000392502 [0,1,0,0,0,1|2,0,0]=4 272 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2F CSC000494170 [0,1,0,0,0,1|2,0,0]=4 273 B18R2.9237 Cc1ccccc1CNCc2ccc(cc2)F CSC000389993 [0,1,0,0,0,1|2,0,0]=4 274 B18R2.9237 Clc1ccc(cc1)CNCc2ccccc2Cl CSC000489922 [0,1,0,0,0,1|2,0,0]=4 275 B18R2.9237 Clc1ccc(cc1)OCCn2ccccc2=O CSC000595663 [0,1,0,0,0,1|2,0,0]=4 276 B18R2.9237 Clc1ccccc1CNCc2ccc(cc2)Br CSC000390003 [0,1,0,0,0,1|2,0,0]=4 277 B18R2.9237 Fc1ccc(cc1)CNCc2ccccc2Cl CSC000389759 [0,1,0,0,0,1|2,0,0]=4 278 B18R2.9237 Fc1ccc(cc1)CNCc2ccccc2F CSC000392454 [0,1,0,0,0,1|2,0,0]=4 279 B18R2.52 Brc1ccc(cc1)COc2ccc(cc2)C#N CSC000248841 [0,2,0,0,0,0|1,0,0]=3 280 B18R2.52 Brc1ccc(cc1)SCc2ccc(cc2)C#N CSC000576316 [0,2,0,0,0,0|1,1,0]=4 281 B18R2.52 CCc1ccc(cc1)NCc2ccc(cc2)Br CSC000596456 [0,2,0,0,0,0|2,0,0]=4 282 B18R2.52 CCc1ccc(cc1)NCc2ccc(cc2)C CSC000595770 [0,2,0,0,0,0|2,0,0]=4 283 B18R2.52 CCc1ccc(cc1)NCc2ccc(cc2)Cl CSC000596013 [0,2,0,0,0,0|2,0,0]=4 284 B18R2.52 COc1ccc(cc1)CNc2ccc(cc2)Br CSC000595824 [0,2,0,0,0,0|2,0,0]=4 285 B18R2.52 COc1ccc(cc1)CNc2ccc(cc2)C CSC046257120 [0,2,0,0,0,0|2,0,0]=4 286 B18R2.52 COc1ccc(cc1)CNc2ccc(cc2)Cl CSC000489940 [0,2,0,0,0,0|2,0,0]=4 287 B18R2.52 COc1ccc(cc1)OCc2ccc(cc2)Br CSC000248871 [0,2,0,0,0,0|0,0,0]=2 288 B18R2.52 COc1ccc(cc1)OCc2ccc(cc2)Cl CSC046201082 [0,2,0,0,0,0|0,0,0]=2 289 B18R2.52 COc1ccc(cc1)SCc2ccc(cc2)Cl CSC048436303 [0,2,0,0,0,0|0,1,0]=3 290 B18R2.52 CSc1ccc(cc1)CNc2ccc(cc2)Br CSC000596236 [0,2,0,0,0,0|2,0,0]=4 291 B18R2.52 CSc1ccc(cc1)CNc2ccc(cc2)C CSC000490208 [0,2,0,0,0,0|2,0,0]=4 292 B18R2.52 CSc1ccc(cc1)CNc2ccc(cc2)Cl CSC000596235 [0,2,0,0,0,0|2,0,0]=4 293 B18R2.52 CSc1ccc(cc1)CNc2ccc(cc2)F CSC000490209 [0,2,0,0,0,0|2,0,0]=4 294 B18R2.52 Cc1ccc(cc1)COc2ccc(cc2)C#N CSC000481308 [0,2,0,0,0,0|1,0,0]=3 295 B18R2.52 Cc1ccc(cc1)COc2ccc(cc2)CN CSC000631268 [0,2,0,0,0,0|1,0,0]=3 296 B18R2.52 Cc1ccc(cc1)NCc2ccc(cc2)C#N CSC000612781 [0,2,0,0,0,0|2,0,0]=4 297 B18R2.52 Cc1ccc(cc1)SCc2ccc(cc2)C#N CSC000487278 [0,2,0,0,0,0|1,1,0]=4 298 B18R2.52 Clc1ccc(cc1)COc2ccc(cc2)C#N CSC000481305 [0,2,0,0,0,0|1,0,0]=3 299 B18R2.52 Clc1ccc(cc1)SCc2ccc(cc2)C#N CSC000576936 [0,2,0,0,0,0|1,1,0]=4 300 B18R2.52 Fc1ccc(cc1)COc2ccc(cc2)C#N CSC000578454 [0,2,0,0,0,0|1,0,0]=3 301 B18R2.52 Fc1ccc(cc1)SCc2ccc(cc2)C#N CSC000575423 [0,2,0,0,0,0|1,1,0]=4 302 B18R2.52 OCc1ccc(cc1)OCc2ccc(cc2)Br CSC000248651 [0,2,0,0,0,0|0,0,0]=2 303 B18R2.52 OCc1ccc(cc1)OCc2ccc(cc2)F CSC000578217 [0,2,0,0,0,0|0,0,0]=2 304 B18R2.52 OCc1ccc(cc1)OCc2ccc(cc2)I CSC000262334 [0,2,0,0,0,0|0,0,0]=2 305 B18R2.57 CCc1ccc(cc1)OC(=O)c2ccccc2 CSC046732186 [0,2,0,0,0,0|1,0,1]=4 306 B18R2.57 COc1ccc(cc1)NC(=O)c2ccccc2 CSC000580491 [0,2,0,0,0,0|1,0,1]=4 307 B18R2.57 COc1ccc(cc1)OC(=O)c2ccccc2 CSC046135794 [0,2,0,0,0,0|0,0,1]=3 308 B18R2.57 COc1ccc(cc1)OC(=O)c2cccnc2 CSC046168948 [0,2,0,0,0,0|1,0,1]=4 309 B18R2.57 COc1ccc(cc1)OC(=O)c2ccncc2 CSC048315268 [0,2,0,0,0,0|1,0,1]=4 310 B18R2.57 O=C(Oc1ccc(cc1)C#N)c2ccccc2 CSC046207620 [0,2,0,0,0,0|1,0,1]=4 311 B18R2.60 CCc1ccc(cc1)NCc2cccc(c2)O CSC000412079 [0,2,0,0,0,0|2,0,0]=4 312 B18R2.60 COc1ccc(cc1)CNc2cccc(c2)C CSC000514581 [0,2,0,0,0,0|2,0,0]=4 313 B18R2.60 COc1ccc(cc1)CNc2cccc(c2)F CSC000514604 [0,2,0,0,0,0|2,0,0]=4 314 B18R2.60 COc1ccc(cc1)OCc2cccc(c2)Br CSC000257669 [0,2,0,0,0,0|0,0,0]=2 315 B18R2.60 COc1ccc(cc1)OCc2cccc(c2)N CSC000639310 [0,2,0,0,0,0|0,0,0]=2 316 B18R2.60 Cc1cccc(c1)COc2ccc(cc2)C#N CSC000591136 [0,2,0,0,0,0|1,0,0]=3 317 B18R2.60 Cc1cccc(c1)COc2ccc(cc2)CO CSC000591148 [0,2,0,0,0,0|0,0,0]=2 318 B18R2.60 OCc1ccc(cc1)OCc2cccc(c2)Br CSC000257702 [0,2,0,0,0,0|0,0,0]=2 319 B18R2.60 OCc1ccc(cc1)OCc2cccc(c2)Cl CSC000578213 [0,2,0,0,0,0|0,0,0]=2 320 B18R2.81 COc1ccc(cc1)C(=O)Nc2ccccc2 CSC000383231 [0,2,0,0,0,0|2,0,0]=4 321 B18R2.81 COc1ccc(cc1)C(=O)Oc2ccccc2 CSC016991644 [0,2,0,0,0,0|2,0,0]=4 322 B18R2.1666 Ic1cc(ccc1OCc2ccccc2)C#N CSC011084124 [0,2,0,0,0,0|1,0,0]=3 323 B18R2.1666 Ic1cc(ccc1OCc2cccnc2)C#N CSC046117744 [0,2,0,0,0,0|2,0,0]=4 324 B18R2.1666 OCc1cc(=O)c(co1)OCc2ccccc2 CSC000684608 [0,2,0,0,0,0|1,0,0]=3 325 B18R2.2562 COc1ccc(cc1Br)CNc2ccccc2 CSC032644205 [0,2,0,0,0,0|2,0,0]=4 326 B18R2.2562 COc1ccc(cc1C)CNc2ccccc2 CSC046127571 [0,2,0,0,0,0|2,0,0]=4 327 B18R2.2562 COc1ccc(cc1Cl)CNc2ccccc2 CSC008260748 [0,2,0,0,0,0|2,0,0]=4 328 B18R2.3840 CCOc1ccc(cc1)CNc2ccccc2 CSC041016192 [0,2,0,0,0,0|2,0,0]=4 329 B18R2.3840 CCOc1ccc(cc1)OCc2ccccc2 CSC000001157 [0,2,0,0,0,0|0,0,0]=2 330 B18R2.3840 OCCc1ccc(cc1)OCc2ccccc2 CSC011216245 [0,2,0,0,0,0|0,0,0]=2 331 B18R2.4327 Brc1ccccc1COc2ccc(cc2)C#N CSC000257617 [0,2,0,0,0,0|1,0,0]=3 332 B18R2.4327 CCc1ccc(cc1)NCc2ccccc2Cl CSC000504491 [0,2,0,0,0,0|2,0,0]=4 333 B18R2.4327 COc1ccc(cc1)CCn2ccccc2=O CSC001319674 [0,2,0,0,0,0|2,0,0]=4 334 B18R2.4327 COc1ccc(cc1)CNc2ccccc2C CSC041659668 [0,2,0,0,0,0|2,0,0]=4 335 B18R2.4327 COc1ccc(cc1)CNc2ccccc2Cl CSC000514770 [0,2,0,0,0,0|2,0,0]=4 336 B18R2.4327 COc1ccc(cc1)N=Cc2ccccc2O CSC046130754 [0,2,0,0,0,0|1,0,1]=4 337 B18R2.4327 Cc1ccccc1COc2ccc(cc2)C#N CSC000481312 [0,2,0,0,0,0|1,0,0]=3 338 B18R2.4327 Cc1ccccc1COc2ccc(cc2)CO CSC000578226 [0,2,0,0,0,0|0,0,0]=2 339 B18R2.4327 Clc1ccccc1COc2ccc(cc2)C#N CSC000578451 [0,2,0,0,0,0|1,0,0]=3 340 B18R2.4327 Fc1ccccc1COc2ccc(cc2)C#N CSC000578449 [0,2,0,0,0,0|1,0,0]=3 341 B18R2.4327 OCc1ccc(cc1)OCc2ccccc2Cl CSC000578214 [0,2,0,0,0,0|0,0,0]=2 342 B18R2.4327 OCc1ccc(cc1)OCc2ccccc2F CSC000481136 [0,2,0,0,0,0|0,0,0]=2 343 B18R2.7076 CC(C)c1ccc(cc1)NCc2ccccc2 CSC000226262 [0,2,0,0,0,0|2,0,0]=4 344 B18R2.7076 CC(N)c1ccc(cc1)OCc2ccccc2 CSC011194332 [0,2,0,0,0,0|1,0,0]=3 345 B18R2.7076 NC(=O)c1ccc(cc1)OCc2ccccn2 CSC046116258 [0,2,0,0,0,0|1,0,1]=4 346 B18R2.7076 NC(=O)c1ccc(cc1)OCc2cccnc2 CSC046083160 [0,2,0,0,0,0|1,0,1]=4 347 B18R2.7076 OC(=O)c1ccc(cc1)CNc2ccccc2 CSC000261628 [0,2,0,0,0,0|2,0,0]=4 348 B18R2.7076 [O-][N+](=O)c1ccc(cc1)NCc2ccccc2 CSC000156207 [0,2,0,0,0,0|1,0,1]=4 349 B18R2.7076 [O-][N+](=O)c1ccc(cc1)OCc2ccccn2 CSC015198906 [0,2,0,0,0,0|1,0,1]=4 350 B18R2.7076 [O-][N+](=O)c1ccc(cc1)OCc2cccnc2 CSC015198916 [0,2,0,0,0,0|1,0,1]=4 351 B18R2.7076 [O-][N+](=O)c1ccc(cc1)SCc2ccccc2 CSC000086755 [0,2,0,0,0,0|0,1,1]=4 352 B18R2.260 Cc1ccc(cc1)S(=O)(=O)Cc2ccccc2 CSC046147744 [0,2,0,0,0,0|1,1,0]=4 353 B18R2.260 Clc1ccc(cc1)S(=O)(=O)Cc2ccccc2 CSC046238508 [0,2,0,0,0,0|1,1,0]=4 354 B18R2.3762 Cc1ccc(cc1)C(=O)Oc2ccc(cc2)F CSC047263533 [0,2,0,0,0,0|1,0,1]=4 355 B18R2.3762 Cc1ccc(cc1)OC(=O)c2ccc(cc2)Br CSC046330404 [0,2,0,0,0,0|1,0,1]=4 356 B18R2.3762 Cc1ccc(cc1)OC(=O)c2ccc(cc2)Cl CSC048390014 [0,2,0,0,0,0|1,0,1]=4 357 B18R2.3762 Cc1ccc(cc1)OC(=O)c2ccc(cc2)F CSC049066970 [0,2,0,0,0,0|1,0,1]=4 358 B18R2.3762 Fc1ccc(cc1)C(=O)Oc2ccc(cc2)Cl CSC047022522 [0,2,0,0,0,0|1,0,1]=4 359 B18R2.3762 Fc1ccc(cc1)OC(=O)c2ccc(cc2)Cl CSC046100918 [0,2,0,0,0,0|1,0,1]=4 360 B18R2.3762 Oc1ccc(cc1)NC(=O)c2ccc(cc2)Br CSC000261394 [0,2,0,0,0,0|1,0,1]=4 361 B18R2.3762 Oc1ccc(cc1)NC(=O)c2ccc(cc2)F CSC000264347 [0,2,0,0,0,0|1,0,1]=4 362 B18R2.249 Cc1cc(ccc1Cl)OC(=O)c2ccccc2 CSC025761511 [0,2,0,0,0,0|1,0,1]=4 363 B18R2.249 Cc1cc(ccc1O)NC(=O)c2ccccc2 CSC000595537 [0,2,0,0,0,0|1,0,1]=4 364 B18R2.249 Cc1ccc(cc1C)OC(=O)c2ccccc2 CSC046540476 [0,2,0,0,0,0|1,0,1]=4 365 B18R2.9259 Cc1ccc(cc1)CNc2ccc(c(c2)C)C CSC000595821 [0,2,0,0,0,0|2,0,0]=4 366 B18R2.9259 Cc1ccc(cc1C)NCc2ccc(cc2)Br CSC000617530 [0,2,0,0,0,0|2,0,0]=4 367 B18R2.9259 Cc1ccc(cc1C)NCc2ccc(cc2)Cl CSC000389767 [0,2,0,0,0,0|2,0,0]=4 368 B18R2.9259 Cc1ccc(cc1C)NCc2ccc(cc2)F CSC000489815 [0,2,0,0,0,0|2,0,0]=4 369 B18R2.9259 Fc1ccc(cc1)SCc2ccc(c(c2)F)F CSC046080348 [0,2,0,0,0,0|1,1,0]=4 370 B18R2.38706 Oc1c(cc(cc1Br)CNc2ccccc2)Br CSC031889373 [0,2,0,0,0,0|2,0,0]=4 371 B18R2.39765 Cc1ccc(cc1C)NCc2ccccc2Cl CSC000617533 [0,2,0,0,0,0|2,0,0]=4 372 B18R2.39765 Cc1ccc(cc1C)NCc2ccccc2F CSC000490248 [0,2,0,0,0,0|2,0,0]=4 373 B18R2.39765 Cc1ccccc1CNc2ccc(c(c2)Cl)F CSC000612798 [0,2,0,0,0,0|2,0,0]=4 374 B18R2.39765 Fc1ccc(cc1Cl)NCc2ccccc2F CSC000490215 [0,2,0,0,0,0|2,0,0]=4 375 B18R2.39765 Fc1ccccc1CNc2ccc(c(c2)Cl)Cl CSC000596241 [0,2,0,0,0,0|2,0,0]=4 376 B18R2.65908 Cc1ccc(cc1C)NCc2cccc(c2)O CSC000523703 [0,2,0,0,0,0|2,0,0]=4 377 B18R2.65908 Cc1ccc(cc1Cl)NCc2cccc(c2)O CSC000523085 [0,2,0,0,0,0|2,0,0]=4 378 B18R2.9252 Cc1ccc(c(c1)C)NCc2ccc(cc2)Br CSC000617510 [0,2,0,0,0,0|2,0,0]=4 379 B18R2.9252 Cc1ccc(c(c1)C)NCc2ccc(cc2)Cl CSC000398445 [0,2,0,0,0,0|2,0,0]=4 380 B18R2.9252 Fc1ccc(c(c1)F)OCc2ccc(cc2)Br CSC000296533 [0,2,0,0,0,0|1,0,0]=3 381 B18R2.9252 Fc1ccc(cc1)NCc2ccc(cc2Cl)Cl CSC000490394 [0,2,0,0,0,0|2,0,0]=4 382 B18R2.265 Cc1ccc(cc1)OC(=O)c2cccc(c2)C CSC046195386 [0,2,0,0,0,0|1,0,1]=4 383 B18R2.265 Cc1ccc(cc1)OC(=O)c2cccc(c2)Cl CSC020646250 [0,2,0,0,0,0|1,0,1]=4 384 B18R2.265 Cc1cccc(c1)C(=O)Oc2ccc(cc2)Cl CSC047023380 [0,2,0,0,0,0|1,0,1]=4 385 B18R2.265 Nc1cccc(c1)C(=O)Nc2ccc(cc2)O CSC000612876 [0,2,0,0,0,0|1,0,1]=4 386 B18R2.265 Oc1ccc(cc1)NC(=O)c2cccc(c2)Cl CSC000595584 [0,2,0,0,0,0|1,0,1]=4 387 B18R2.265 Oc1ccc(cc1)NC(=O)c2cccc(c2)F CSC000599517 [0,2,0,0,0,0|1,0,1]=4 388 B18R2.6540 Cc1cc(ccc1NC(=O)c2ccccc2)O CSC000490369 [0,2,0,0,0,0|1,0,1]=4 389 B18R2.6540 Cc1cc(ccc1OC(=O)c2ccccc2)Cl CSC046353414 [0,2,0,0,0,0|1,0,1]=4 390 B18R2.9218 Cc1ccc(cc1)OC(=O)c2ccccc2C CSC046215251 [0,2,0,0,0,0|1,0,1]=4 391 B18R2.9218 Cc1ccc(cc1)OC(=O)c2ccccc2F CSC020586329 [0,2,0,0,0,0|1,0,1]=4 392 B18R2.9218 Cc1ccccc1C(=O)Nc2ccc(cc2)O CSC000491939 [0,2,0,0,0,0|1,0,1]=4 393 B18R2.9218 Cc1ccccc1C(=O)Oc2ccc(cc2)Cl CSC048195586 [0,2,0,0,0,0|1,0,1]=4 394 B18R2.9218 Fc1ccc(cc1)OC(=O)c2ccccc2Cl CSC046130426 [0,2,0,0,0,0|1,0,1]=4 395 B18R2.9218 Fc1ccc(cc1)OC(=O)c2ccccc2F CSC048439150 [0,2,0,0,0,0|1,0,1]=4 396 B18R2.9218 Oc1ccc(cc1)NC(=O)c2ccccc2F CSC000261569 [0,2,0,0,0,0|1,0,1]=4 397 B18R2.9218 Oc1ccc(cc1)NC(=O)c2ccccc2O CSC000599514 [0,2,0,0,0,0|1,0,1]=4 398 B18R2.1492 COc1cccc(c1)CNc2ccc(cc2)Br CSC000503435 [0,2,0,0,0,0|2,0,0]=4 399 B18R2.1492 COc1cccc(c1)CNc2ccc(cc2)C CSC040479230 [0,2,0,0,0,0|2,0,0]=4 400 B18R2.1492 COc1cccc(c1)CNc2ccc(cc2)Cl CSC000503800 [0,2,0,0,0,0|2,0,0]=4 401 B18R2.1492 COc1cccc(c1)CNc2ccc(cc2)F CSC000503530 [0,2,0,0,0,0|2,0,0]=4 402 B18R2.1492 COc1cccc(c1)CSc2ccc(cc2)Cl CSC047591181 [0,2,0,0,0,0|1,1,0]=4 403 B18R2.1492 Cc1ccc(cc1)NCc2cccc(c2)C#N CSC000396538 [0,2,0,0,0,0|2,0,0]=4 404 B18R2.1492 Cc1ccc(cc1)OCc2cccc(c2)C#N CSC000391512 [0,2,0,0,0,0|1,0,0]=3 405 B18R2.65901 Cc1ccc(c(c1)C)NCc2cccc(c2)O CSC000522856 [0,2,0,0,0,0|2,0,0]=4 406 B18R2.65901 Cc1ccc(c(c1)C)OCc2cccc(c2)N CSC000639287 [0,2,0,0,0,0|1,0,0]=3 407 B18R2.65901 Fc1ccc(c(c1)F)OCc2cccc(c2)Br CSC000296539 [0,2,0,0,0,0|1,0,0]=3 408 B18R2.65901 Fc1cccc(c1)COc2ccc(cc2Br)F CSC000248630 [0,2,0,0,0,0|1,0,0]=3 409 B18R2.327 Brc1ccc(cc1)SCc2ccccc2C#N CSC000480072 [0,2,0,0,0,0|1,1,0]=4 410 B18R2.327 COc1ccccc1CNc2ccc(cc2)Br CSC000490039 [0,2,0,0,0,0|2,0,0]=4 411 B18R2.327 COc1ccccc1CNc2ccc(cc2)C CSC000490336 [0,2,0,0,0,0|2,0,0]=4 412 B18R2.327 COc1ccccc1CNc2ccc(cc2)Cl CSC000489943 [0,2,0,0,0,0|2,0,0]=4 413 B18R2.327 COc1ccccc1CNc2ccc(cc2)F CSC000503533 [0,2,0,0,0,0|2,0,0]=4 414 B18R2.327 Cc1ccc(cc1)NCc2ccccc2C#N CSC000612780 [0,2,0,0,0,0|2,0,0]=4 415 B18R2.327 Cc1ccc(cc1)SCc2ccccc2C#N CSC000487177 [0,2,0,0,0,0|1,1,0]=4 416 B18R2.327 Clc1ccc(cc1)OCc2ccccc2C#N CSC000578376 [0,2,0,0,0,0|1,0,0]=3 417 B18R2.327 Clc1ccc(cc1)SCc2ccccc2C#N CSC000576927 [0,2,0,0,0,0|1,1,0]=4 418 B18R2.327 Fc1ccc(cc1)NCc2ccccc2C#N CSC000596284 [0,2,0,0,0,0|2,0,0]=4 419 B18R2.327 Fc1ccc(cc1)SCc2ccccc2C#N CSC000575412 [0,2,0,0,0,0|1,1,0]=4 420 B18R2.33281 Cc1ccc(c(c1)C)NCc2ccccc2Cl CSC000617515 [0,2,0,0,0,0|2,0,0]=4 421 B18R2.33281 Fc1ccc(c(c1)Br)OCc2ccccc2F CSC000248622 [0,2,0,0,0,0|1,0,0]=3 422 B18R2.33281 Fc1ccc(c(c1)F)OCc2ccccc2Br CSC000296538 [0,2,0,0,0,0|1,0,0]=3 423 B18R2.94069 Cc1ccc(cc1)NCc2c(cccc2Cl)F CSC000490401 [0,2,0,0,0,0|2,0,0]=4 424 B18R2.94069 Fc1cccc(c1CNc2ccc(cc2)Cl)Cl CSC000390158 [0,2,0,0,0,0|2,0,0]=4 425 B18R2.1046 Brc1ccc(c(c1)C#N)OCc2ccccc2 CSC000188256 [0,2,0,0,0,0|1,0,0]=3 426 B18R3.30705 Oc1ccc(cc1)c2nc3ccccc3[nH]2 CSC000258266 [0,1,0,1,0,0|2,0,0]=4 427 B14R2.101 C(Nc1ccccc1)c2cccs2 CSC000219589 [1,0,0,0,1,0|2,0,0]=4 428 B14R2.68 Cc1ccc(cc1)c2ccccn2 CSC000035180 [0,0,0,0,2,0|2,0,0]=4 429 B14R2.68 Clc1ccc(cc1)c2ccccc2 CSC011217223 [0,0,0,0,2,0|1,0,0]=3 430 B14R2.68 Fc1ccc(cc1)c2ccccc2 CSC000040000 [0,0,0,0,2,0|1,0,0]=3 431 B14R2.68 Fc1ccc(cc1)c2ccncc2 CSC000088885 [0,0,0,0,2,0|2,0,0]=4 432 B14R2.68 Nc1ccc(cc1)c2cccnc2 CSC011399839 [0,0,0,0,2,0|2,0,0]=4 433 B14R2.68 Nc1ccc(cc1)c2ccncc2 CSC011410175 [0,0,0,0,2,0|2,0,0]=4 434 B14R2.68 Nc1ccc(cn1)c2ccccc2 CSC000743117 [0,0,0,0,2,0|2,0,0]=4 435 B14R2.68 Oc1ccc(cc1)c2cncnc2 CSC011997985 [0,0,0,0,2,0|2,0,0]=4 436 B16R2.2256 C(Cc1ccccc1)Oc2ccccc2 CSC011995743 [1,0,0,0,0,1|0,0,0]=2 437 B16R2.2256 C(Cc1ccccc1)Sc2ccccc2 CSC000031048 [1,0,0,0,0,1|0,1,0]=3 438 B16R2.2256 C(Cc1ccccn1)Sc2ccccc2 CSC046232085 [1,0,0,0,0,1|1,1,0]=4 439 B16R2.2256 C(Cc1ccncc1)Sc2ccccc2 CSC000018619 [1,0,0,0,0,1|1,1,0]=4 440 B16R2.2256 C(NCc1ccccn1)c2ccccc2 CSC000196071 [1,0,0,0,0,1|2,0,0]=4 441 B16R2.2256 C(NCc1cccnc1)c2ccccc2 CSC000180891 [1,0,0,0,0,1|2,0,0]=4 442 B16R2.2256 C(NCc1ccncc1)c2ccccc2 CSC000186794 [1,0,0,0,0,1|2,0,0]=4 443 B16R2.2256 C(SCc1ccccc1)c2ccccc2 CSC000004503 [1,0,0,0,0,1|0,1,0]=3 444 B16R2.2256 C(SCc1cccnc1)c2ccccc2 CSC000044160 [1,0,0,0,0,1|1,1,0]=4 445 B16R2.2256 N(N=Cc1ccccc1)c2ccccc2 CSC000007351 [1,0,0,0,0,1|1,0,1]=4 446 B18R2.270 Brc1ccc(cc1)CNCCc2ccccc2 CSC000389605 [0,0,0,0,0,2|2,0,0]=4 447 B18R2.270 Cc1ccc(cc1)CNCCc2ccccc2 CSC000389764 [0,0,0,0,0,2|2,0,0]=4 448 B18R2.270 Cc1ccc(cc1)SCCOc2ccccc2 CSC046145538 [0,0,0,0,0,2|1,1,0]=4 449 B18R2.270 Clc1ccc(cc1)CCNCc2ccccc2 CSC000196564 [0,0,0,0,0,2|2,0,0]=4 450 B18R2.270 Fc1ccc(cc1)CCNCc2ccccc2 CSC000196521 [0,0,0,0,0,2|2,0,0]=4 451 B18R2.270 Fc1ccc(cc1)CNCCc2ccccc2 CSC000489982 [0,0,0,0,0,2|2,0,0]=4