0 B15R2.2195 C(#Cc1ccccc1)c2ccccc2 Amb8390026 [0,0,0,0,0,0|2,0,0]=2 1 B15R2.2195 C(#Cc1cccnc1)c2ccccc2 Amb8388336 [0,0,0,0,0,0|3,0,0]=3 2 B15R2.2195 C(#Cc1cccnc1)c2cccnc2 Amb16192298 [0,0,0,0,0,0|4,0,0]=4 3 B15R2.2195 C(#Cc1ccncc1)c2ccncc2 Amb22497600 [0,0,0,0,0,0|4,0,0]=4 4 B15R2.2195 C(#Cc1cncnc1)c2ccccc2 Amb3485535 [0,0,0,0,0,0|4,0,0]=4 5 B15R2.2195 C(=C/c1ccccc1)/c2ccccc2 Amb16192901 [0,0,0,0,0,0|2,0,0]=2 6 B15R2.2195 C(=C/c1ccccn1)/c2ccccn2 Amb2503976 [0,0,0,0,0,0|4,0,0]=4 7 B15R2.2195 C(=C/c1ccncc1)/c2ccncc2 Amb24567274 [0,0,0,0,0,0|4,0,0]=4 8 B15R2.2195 C(=C\c1ccccc1)/c2ccccc2 Amb18511865 [0,0,0,0,0,0|2,0,0]=2 9 B15R2.2195 C(=C\c1ccccn1)/c2ccccc2 Amb6430521 [0,0,0,0,0,0|3,0,0]=3 10 B15R2.2195 C(=C\c1ccccn1)/c2ccccn2 Amb31276021 [0,0,0,0,0,0|4,0,0]=4 11 B15R2.2195 C(=C\c1ccccn1)/c2cccnc2 Amb4006368 [0,0,0,0,0,0|4,0,0]=4 12 B15R2.2195 C(=C\c1ccccn1)/c2ccncc2 Amb9786480 [0,0,0,0,0,0|4,0,0]=4 13 B15R2.2195 C(=C\c1cccnc1)/c2ccccc2 Amb5718974 [0,0,0,0,0,0|3,0,0]=3 14 B15R2.2195 C(=C\c1cccnc1)/c2ccncc2 Amb27454085 [0,0,0,0,0,0|4,0,0]=4 15 B15R2.2195 C(=C\c1cccnn1)/c2ccccc2 Amb24589878 [0,0,0,0,0,0|4,0,0]=4 16 B15R2.2195 C(=C\c1ccncc1)/c2ccccc2 Amb2226978 [0,0,0,0,0,0|3,0,0]=3 17 B15R2.2195 C(=C\c1ccncc1)/c2ccncc2 Amb3726139 [0,0,0,0,0,0|4,0,0]=4 18 B15R2.2195 C(=C\c1ccncn1)/c2ccccc2 Amb10605842 [0,0,0,0,0,0|4,0,0]=4 19 B15R2.2195 C(=N\c1ccccc1)/c2ccccc2 Amb32411825 [0,0,0,0,0,0|2,0,0]=2 20 B15R2.2195 C(=N\c1ccccc1)/c2ccccn2 Amb25173927 [0,0,0,0,0,0|3,0,0]=3 21 B15R2.2195 C(=N\c1ccccc1)/c2ccncc2 Amb3693127 [0,0,0,0,0,0|3,0,0]=3 22 B15R2.2195 C1=CNC(\N=C\c2ccccc2)C=C1 Amb27387814 [0,0,0,0,0,0|3,0,1]=4 23 B15R2.2195 C1=COC(OCc2ccccc2)C=C1 Amb4011814 [0,0,0,0,0,0|2,1,1]=4 24 B15R2.2195 c1cc(CCc2ccncc2)ccn1 Amb6336326 [0,0,0,0,0,0|4,0,0]=4 25 B15R2.2195 c1cc(SSc2ccncc2)ccn1 Amb632116 [0,0,0,0,0,0|2,0,0]=2 26 B15R2.2195 c1cc[n+](CC[n+]2ccccc2)cc1 Amb2221672 [0,0,0,0,0,0|4,0,0]=4 27 B15R2.2195 c1ccc(CCc2ccccc2)cc1 Amb17678850 [0,0,0,0,0,0|2,0,0]=2 28 B15R2.2195 c1ccc(CCc2ccccn2)cc1 Amb5494186 [0,0,0,0,0,0|3,0,0]=3 29 B15R2.2195 c1ccc(CCc2ccccn2)nc1 Amb2713299 [0,0,0,0,0,0|4,0,0]=4 30 B15R2.2195 c1ccc(CCc2cccnc2)nc1 Amb6769550 [0,0,0,0,0,0|4,0,0]=4 31 B15R2.2195 c1ccc(CCc2ccncc2)cc1 Amb2612998 [0,0,0,0,0,0|3,0,0]=3 32 B15R2.2195 c1ccc(CCc2cnccn2)cc1 Amb15695191 [0,0,0,0,0,0|4,0,0]=4 33 B15R2.2195 c1ccc(CNc2ccccc2)cc1 Amb6355841 [0,0,0,0,0,0|2,0,0]=2 34 B15R2.2195 c1ccc(CNc2ccccn2)cc1 Amb1087875 [0,0,0,0,0,0|3,0,0]=3 35 B15R2.2195 c1ccc(CNc2ccccn2)nc1 Amb6642874 [0,0,0,0,0,0|4,0,0]=4 36 B15R2.2195 c1ccc(CNc2cccnc2)cc1 Amb2383000 [0,0,0,0,0,0|3,0,0]=3 37 B15R2.2195 c1ccc(CNc2cccnc2)nc1 Amb6686655 [0,0,0,0,0,0|4,0,0]=4 38 B15R2.2195 c1ccc(CNc2ccncc2)cc1 Amb597752 [0,0,0,0,0,0|3,0,0]=3 39 B15R2.2195 c1ccc(CNc2ccncc2)nc1 Amb6656695 [0,0,0,0,0,0|4,0,0]=4 40 B15R2.2195 c1ccc(CNc2ccncn2)cc1 Amb18973887 [0,0,0,0,0,0|4,0,0]=4 41 B15R2.2195 c1ccc(CNc2cnccn2)cc1 Amb2444500 [0,0,0,0,0,0|4,0,0]=4 42 B15R2.2195 c1ccc(CNc2cncnc2)cc1 Amb2612437 [0,0,0,0,0,0|4,0,0]=4 43 B15R2.2195 c1ccc(COc2ccccc2)cc1 Amb24097492 [0,0,0,0,0,0|1,1,0]=2 44 B15R2.2195 c1ccc(COc2ccccc2)cc1 Amb2691207 [0,0,0,0,0,0|1,1,0]=2 45 B15R2.2195 c1ccc(COc2ccccn2)cc1 Amb16191945 [0,0,0,0,0,0|2,1,0]=3 46 B15R2.2195 c1ccc(COc2cccnc2)cc1 Amb21927728 [0,0,0,0,0,0|2,1,0]=3 47 B15R2.2195 c1ccc(COc2cccnc2)nc1 Amb27236662 [0,0,0,0,0,0|3,1,0]=4 48 B15R2.2195 c1ccc(COc2ccncc2)cc1 Amb10603750 [0,0,0,0,0,0|2,1,0]=3 49 B15R2.2195 c1ccc(COc2cncnc2)cc1 Amb24098649 [0,0,0,0,0,0|3,1,0]=4 50 B15R2.2195 c1ccc(CSc2ccccc2)cc1 Amb2684670 [0,0,0,0,0,0|1,0,0]=1 51 B15R2.2195 c1ccc(CSc2ccccn2)cc1 Amb3862159 [0,0,0,0,0,0|2,0,0]=2 52 B15R2.2195 c1ccc(CSc2cccnn2)cc1 Amb25785634 [0,0,0,0,0,0|3,0,0]=3 53 B15R2.2195 c1ccc(CSc2ncccn2)cc1 Amb1263972 [0,0,0,0,0,0|3,0,0]=3 54 B15R2.2195 c1ccc(CSc2ncccn2)nc1 Amb9820311 [0,0,0,0,0,0|4,0,0]=4 55 B15R2.2195 c1ccc(C[SiH2]c2ccccc2)cc1 Amb22347054 [0,0,0,0,0,0|2,0,0]=2 56 B15R2.2195 c1ccc(NCc2ccccn2)cc1 Amb6356069 [0,0,0,0,0,0|3,0,0]=3 57 B15R2.2195 c1ccc(NCc2cccnc2)cc1 Amb6356070 [0,0,0,0,0,0|3,0,0]=3 58 B15R2.2195 c1ccc(NCc2cccnc2)nc1 Amb2694194 [0,0,0,0,0,0|4,0,0]=4 59 B15R2.2195 c1ccc(NCc2ccncc2)cc1 Amb6356071 [0,0,0,0,0,0|3,0,0]=3 60 B15R2.2195 c1ccc(NCc2ccncc2)nc1 Amb6609621 [0,0,0,0,0,0|4,0,0]=4 61 B15R2.2195 c1ccc(NCc2cncnc2)cc1 Amb18996444 [0,0,0,0,0,0|4,0,0]=4 62 B15R2.2195 c1ccc(NNc2ccccc2)cc1 Amb28990937 [0,0,0,0,0,0|2,0,0]=2 63 B15R2.2195 c1ccc(NNc2ccccc2)cc1 Amb4000296 [0,0,0,0,0,0|2,0,0]=2 64 B15R2.2195 c1ccc(OCc2cccnc2)cc1 Amb27465872 [0,0,0,0,0,0|2,1,0]=3 65 B15R2.2195 c1ccc(OCc2ccncc2)cc1 Amb27217814 [0,0,0,0,0,0|2,1,0]=3 66 B15R2.2195 c1ccc(OCc2cnccn2)cc1 Amb35700555 [0,0,0,0,0,0|3,1,0]=4 67 B15R2.2195 c1ccc(OCc2ncccn2)cc1 Amb27181427 [0,0,0,0,0,0|3,1,0]=4 68 B15R2.2195 c1ccc(SC[n+]2ccccc2)cc1 Amb10568955 [0,0,0,0,0,0|2,0,0]=2 69 B15R2.2195 c1ccc(SCc2cccnc2)cc1 Amb10632429 [0,0,0,0,0,0|2,0,0]=2 70 B15R2.2195 c1ccc(SCc2cccnc2)nc1 Amb10710736 [0,0,0,0,0,0|3,0,0]=3 71 B15R2.2195 c1ccc(SCc2ccncc2)nc1 Amb25776849 [0,0,0,0,0,0|3,0,0]=3 72 B15R2.2195 c1ccc(SSc2ccccc2)cc1 Amb2687663 [0,0,0,0,0,0|0,0,0]=0 73 B15R2.2195 c1ccc(SSc2ccccn2)nc1 Amb2573305 [0,0,0,0,0,0|2,0,0]=2 74 B15R2.2195 c1ccc([Se][Se]c2ccccc2)cc1 Amb4138616 [0,0,0,0,0,0|0,2,0]=2 75 B15R2.2195 c1ccc([Te][Te]c2ccccc2)cc1 Amb6366598 [0,0,0,0,0,0|0,2,0]=2 76 B15R2.2195 c1ccc(\N=N/c2ccccc2)cc1 Amb10843899 [0,0,0,0,0,0|2,0,0]=2 77 B15R2.2195 c1ccc(\N=N\c2ccccc2)cc1 Amb4408423 [0,0,0,0,0,0|2,0,0]=2 78 B15R2.2195 c1ccc(\N=N\c2ccccn2)nc1 Amb4324698 [0,0,0,0,0,0|4,0,0]=4 79 B15R2.2195 c1cnc(SCc2ccncc2)nc1 Amb9824898 [0,0,0,0,0,0|4,0,0]=4 80 B15R2.2195 c1cncc(CNc2cccnc2)c1 Amb6686503 [0,0,0,0,0,0|4,0,0]=4 81 B15R2.2195 c1cncc(CNc2ccncc2)c1 Amb6614340 [0,0,0,0,0,0|4,0,0]=4 82 B15R2.2195 c1cncc(NCc2ccncc2)c1 Amb6686507 [0,0,0,0,0,0|4,0,0]=4 83 B15R2.2195 c1cncc(SSc2cccnc2)c1 Amb22002419 [0,0,0,0,0,0|2,0,0]=2 84 B16R2.71 Brc1ccccc1C#Cc2ccccc2 Amb8394446 [0,1,0,0,0,0|2,0,0]=3 85 B16R2.71 Brc1ccccc1CNc2cccnc2 Amb6686658 [0,1,0,0,0,0|3,0,0]=4 86 B16R2.71 Brc1ccccc1COc2ccccc2 Amb2724080 [0,1,0,0,0,0|1,1,0]=3 87 B16R2.71 Brc1ccccc1CSc2ccccc2 Amb22265930 [0,1,0,0,0,0|1,0,0]=2 88 B16R2.71 Brc1ccccc1NCc2ccccc2 Amb6696457 [0,1,0,0,0,0|2,0,0]=3 89 B16R2.71 Brc1ccccc1NCc2ccccn2 Amb6696465 [0,1,0,0,0,0|3,0,0]=4 90 B16R2.71 Brc1ccccc1NCc2cccnc2 Amb6696374 [0,1,0,0,0,0|3,0,0]=4 91 B16R2.71 Brc1ccccc1NCc2ccncc2 Amb4002542 [0,1,0,0,0,0|3,0,0]=4 92 B16R2.71 Brc1ccccc1OCc2ccccc2 Amb6665080 [0,1,0,0,0,0|1,1,0]=3 93 B16R2.71 Brc1ccccc1OCc2ccccn2 Amb6256204 [0,1,0,0,0,0|2,1,0]=4 94 B16R2.71 Brc1ccccc1OCc2cccnc2 Amb6273762 [0,1,0,0,0,0|2,1,0]=4 95 B16R2.71 Brc1cccnc1OCc2ccccc2 Amb21856407 [0,1,0,0,0,0|2,1,0]=4 96 B16R2.71 Brc1cccnc1SCc2ccccc2 Amb27152053 [0,1,0,0,0,0|2,0,0]=3 97 B16R2.71 Brc1ccncc1OCc2ccccc2 Amb27209054 [0,1,0,0,0,0|2,1,0]=4 98 B16R2.71 Brc1cnccc1OCc2ccccc2 Amb27230531 [0,1,0,0,0,0|2,1,0]=4 99 B16R2.71 Brc1cnccc1SCc2ccccc2 Amb27976296 [0,1,0,0,0,0|2,0,0]=3 100 B16R2.71 Brc1ncccc1OCc2ccccc2 Amb13889959 [0,1,0,0,0,0|2,1,0]=4 101 B16R2.71 C[n+]1ccccc1OCc2ccccc2 Amb10601695 [0,1,0,0,0,0|2,1,0]=4 102 B16R2.71 Cc1ccccc1CNc2ccccc2 Amb4313317 [0,1,0,0,0,0|2,0,0]=3 103 B16R2.71 Cc1ccccc1CNc2cccnc2 Amb6686478 [0,1,0,0,0,0|3,0,0]=4 104 B16R2.71 Cc1ccccc1NCc2ccccc2 Amb11014339 [0,1,0,0,0,0|2,0,0]=3 105 B16R2.71 Cc1ccccc1NCc2ccccc2 Amb838871 [0,1,0,0,0,0|2,0,0]=3 106 B16R2.71 Cc1ccccc1NCc2ccccn2 Amb6701235 [0,1,0,0,0,0|3,0,0]=4 107 B16R2.71 Cc1ccccc1NCc2cccnc2 Amb6701128 [0,1,0,0,0,0|3,0,0]=4 108 B16R2.71 Cc1ccccc1NCc2ccncc2 Amb6286265 [0,1,0,0,0,0|3,0,0]=4 109 B16R2.71 Cc1ccccc1OCc2ccccc2 Amb2447370 [0,1,0,0,0,0|1,1,0]=3 110 B16R2.71 Cc1ccccc1\C=C\c2ccncc2 Amb32667395 [0,1,0,0,0,0|3,0,0]=4 111 B16R2.71 Cc1ccncc1NCc2ccccc2 Amb25170961 [0,1,0,0,0,0|3,0,0]=4 112 B16R2.71 Cc1ncccc1NCc2ccccc2 Amb26642123 [0,1,0,0,0,0|3,0,0]=4 113 B16R2.71 Clc1ccccc1CNc2ccccc2 Amb4313409 [0,1,0,0,0,0|2,0,0]=3 114 B16R2.71 Clc1ccccc1CNc2ccccn2 Amb2382990 [0,1,0,0,0,0|3,0,0]=4 115 B16R2.71 Clc1ccccc1CNc2cccnc2 Amb2383003 [0,1,0,0,0,0|3,0,0]=4 116 B16R2.71 Clc1ccccc1CNc2cccnc2 Amb24079952 [0,1,0,0,0,0|3,0,0]=4 117 B16R2.71 Clc1ccccc1CNc2ccncc2 Amb24079953 [0,1,0,0,0,0|3,0,0]=4 118 B16R2.71 Clc1ccccc1NCc2ccccc2 Amb4313268 [0,1,0,0,0,0|2,0,0]=3 119 B16R2.71 Clc1ccccc1NCc2ccccn2 Amb6696917 [0,1,0,0,0,0|3,0,0]=4 120 B16R2.71 Clc1ccccc1NCc2cccnc2 Amb6696851 [0,1,0,0,0,0|3,0,0]=4 121 B16R2.71 Clc1ccccc1NCc2ccncc2 Amb6696855 [0,1,0,0,0,0|3,0,0]=4 122 B16R2.71 Clc1ccccc1OCc2ccccc2 Amb28141643 [0,1,0,0,0,0|1,1,0]=3 123 B16R2.71 Clc1cccnc1NCc2ccccc2 Amb6638612 [0,1,0,0,0,0|3,0,0]=4 124 B16R2.71 Clc1ncccc1CNc2ccccc2 Amb16691142 [0,1,0,0,0,0|3,0,0]=4 125 B16R2.71 Clc1ncccc1CSc2ccncc2 Amb27173398 [0,1,0,0,0,0|3,0,0]=4 126 B16R2.71 Clc1ncccc1NCc2ccccc2 Amb9555488 [0,1,0,0,0,0|3,0,0]=4 127 B16R2.71 Clc1ncccc1OCc2ccccc2 Amb2611987 [0,1,0,0,0,0|2,1,0]=4 128 B16R2.71 Fc1ccccc1CNc2ccccc2 Amb4304157 [0,1,0,0,0,0|2,0,0]=3 129 B16R2.71 Fc1ccccc1CNc2ccccn2 Amb6648620 [0,1,0,0,0,0|3,0,0]=4 130 B16R2.71 Fc1ccccc1CNc2ccncc2 Amb33545756 [0,1,0,0,0,0|3,0,0]=4 131 B16R2.71 Fc1ccccc1NCc2ccccc2 Amb33527612 [0,1,0,0,0,0|2,0,0]=3 132 B16R2.71 Fc1ccccc1NCc2ccccc2 Amb6697374 [0,1,0,0,0,0|2,0,0]=3 133 B16R2.71 Fc1ccccc1NCc2ccccn2 Amb6697384 [0,1,0,0,0,0|3,0,0]=4 134 B16R2.71 Fc1ccccc1NCc2cccnc2 Amb6697270 [0,1,0,0,0,0|3,0,0]=4 135 B16R2.71 Fc1ccccc1NCc2ccncc2 Amb6697275 [0,1,0,0,0,0|3,0,0]=4 136 B16R2.71 Fc1ccccc1OCc2ccccc2 Amb8392535 [0,1,0,0,0,0|1,1,0]=3 137 B16R2.71 Fc1cccnc1NCc2ccccc2 Amb18300631 [0,1,0,0,0,0|3,0,0]=4 138 B16R2.71 Fc1ncccc1NCc2ccccc2 Amb35693144 [0,1,0,0,0,0|3,0,0]=4 139 B16R2.71 Fc1ncccc1OCc2ccccc2 Amb27452907 [0,1,0,0,0,0|2,1,0]=4 140 B16R2.71 Fc1nccnc1SCc2ccccc2 Amb35714691 [0,1,0,0,0,0|3,0,0]=4 141 B16R2.71 Ic1ccccc1COc2ccccc2 Amb32410434 [0,1,0,0,0,0|1,1,0]=3 142 B16R2.71 Ic1ccccc1NCc2ccccc2 Amb7760756 [0,1,0,0,0,0|2,0,0]=3 143 B16R2.71 Ic1ccccc1NCc2ccccn2 Amb9208194 [0,1,0,0,0,0|3,0,0]=4 144 B16R2.71 Ic1ccccc1NCc2cccnc2 Amb9208198 [0,1,0,0,0,0|3,0,0]=4 145 B16R2.71 Ic1ccccc1NCc2ccncc2 Amb9203694 [0,1,0,0,0,0|3,0,0]=4 146 B16R2.71 Ic1ccccc1OCc2ccccc2 Amb22232803 [0,1,0,0,0,0|1,1,0]=3 147 B16R2.71 Ic1ccccc1OCc2cccnc2 Amb27773280 [0,1,0,0,0,0|2,1,0]=4 148 B16R2.71 Ic1ccccc1OCc2ccncc2 Amb27486174 [0,1,0,0,0,0|2,1,0]=4 149 B16R2.71 Nc1ccccc1C#Cc2ccccc2 Amb1772819 [0,1,0,0,0,0|2,0,0]=3 150 B16R2.71 Nc1ccccc1CCc2ccccc2 Amb17843031 [0,1,0,0,0,0|2,0,0]=3 151 B16R2.71 Nc1ccccc1CCc2ccccc2 Amb21954211 [0,1,0,0,0,0|2,0,0]=3 152 B16R2.71 Nc1ccccc1CCc2ccccn2 Amb1092119 [0,1,0,0,0,0|3,0,0]=4 153 B16R2.71 Nc1ccccc1CCc2cccnc2 Amb22011444 [0,1,0,0,0,0|3,0,0]=4 154 B16R2.71 Nc1ccccc1CCc2ccncc2 Amb1087951 [0,1,0,0,0,0|3,0,0]=4 155 B16R2.71 Nc1ccccc1CNc2ccccc2 Amb18973315 [0,1,0,0,0,0|2,0,0]=3 156 B16R2.71 Nc1ccccc1CNc2ccccn2 Amb17100062 [0,1,0,0,0,0|3,0,0]=4 157 B16R2.71 Nc1ccccc1CNc2ccncc2 Amb18984737 [0,1,0,0,0,0|3,0,0]=4 158 B16R2.71 Nc1ccccc1COc2ccccc2 Amb2724081 [0,1,0,0,0,0|1,1,0]=3 159 B16R2.71 Nc1ccccc1CSc2ncccn2 Amb6680320 [0,1,0,0,0,0|3,0,0]=4 160 B16R2.71 Nc1ccccc1NCc2ccccc2 Amb7764683 [0,1,0,0,0,0|2,0,0]=3 161 B16R2.71 Nc1ccccc1NCc2ccccn2 Amb9205292 [0,1,0,0,0,0|3,0,0]=4 162 B16R2.71 Nc1ccccc1NCc2cccnc2 Amb7768126 [0,1,0,0,0,0|3,0,0]=4 163 B16R2.71 Nc1ccccc1NCc2ccncc2 Amb7768116 [0,1,0,0,0,0|3,0,0]=4 164 B16R2.71 Nc1ccccc1NNc2ccccc2 Amb17777429 [0,1,0,0,0,0|2,0,0]=3 165 B16R2.71 Nc1ccccc1OCc2ccccc2 Amb1119599 [0,1,0,0,0,0|1,1,0]=3 166 B16R2.71 Nc1ccccc1OCc2ccccc2 Amb18369109 [0,1,0,0,0,0|1,1,0]=3 167 B16R2.71 Nc1ccccc1OCc2ccccn2 Amb1084282 [0,1,0,0,0,0|2,1,0]=4 168 B16R2.71 Nc1ccccc1OCc2ccccn2 Amb8503355 [0,1,0,0,0,0|2,1,0]=4 169 B16R2.71 Nc1ccccc1OCc2cccnc2 Amb22282186 [0,1,0,0,0,0|2,1,0]=4 170 B16R2.71 Nc1ccccc1OCc2cccnc2 Amb33536530 [0,1,0,0,0,0|2,1,0]=4 171 B16R2.71 Nc1ccccc1SCc2ccccc2 Amb1216619 [0,1,0,0,0,0|1,0,0]=2 172 B16R2.71 Nc1ccccc1SCc2ccccn2 Amb2889101 [0,1,0,0,0,0|2,0,0]=3 173 B16R2.71 Nc1ccccc1\C=C\c2ccccc2 Amb21947815 [0,1,0,0,0,0|2,0,0]=3 174 B16R2.71 Nc1cccnc1C#Cc2ccccc2 Amb22496072 [0,1,0,0,0,0|3,0,0]=4 175 B16R2.71 Nc1cccnc1NCc2ccccc2 Amb7172721 [0,1,0,0,0,0|3,0,0]=4 176 B16R2.71 Nc1cccnc1OCc2ccccc2 Amb1136051 [0,1,0,0,0,0|2,1,0]=4 177 B16R2.71 Nc1cccnc1\C=C\c2ccccc2 Amb24082929 [0,1,0,0,0,0|3,0,0]=4 178 B16R2.71 Nc1ccncc1NCc2ccccc2 Amb17933223 [0,1,0,0,0,0|3,0,0]=4 179 B16R2.71 Nc1ccncc1OCc2ccccc2 Amb25184191 [0,1,0,0,0,0|2,1,0]=4 180 B16R2.71 Nc1cnccc1NCc2ccccc2 Amb7767649 [0,1,0,0,0,0|3,0,0]=4 181 B16R2.71 Nc1cnccc1OCc2ccccc2 Amb7765080 [0,1,0,0,0,0|2,1,0]=4 182 B16R2.71 Nc1ncccc1NCc2ccccc2 Amb15701551 [0,1,0,0,0,0|3,0,0]=4 183 B16R2.71 Nc1ncccc1OCc2ccccc2 Amb2719821 [0,1,0,0,0,0|2,1,0]=4 184 B16R2.71 Nc1ncccc1\N=C\c2ccccc2 Amb16186861 [0,1,0,0,0,0|3,0,0]=4 185 B16R2.71 O=C1C=CC=CN1CCc2ccccc2 Amb33330037 [0,1,0,0,0,0|3,0,0]=4 186 B16R2.71 O=C1C=CC=CN1OCc2ccccc2 Amb21994776 [0,1,0,0,0,0|2,1,0]=4 187 B16R2.71 O=C1C=COC=C1OCc2ccccc2 Amb21962788 [0,1,0,0,0,0|2,1,0]=4 188 B16R2.71 O=C1NC=CC=C1OCc2ccccc2 Amb18537465 [0,1,0,0,0,0|2,1,0]=4 189 B16R2.71 O=c1ccocc1OCc2ccccc2 Amb22270207 [0,1,0,0,0,0|2,1,0]=4 190 B16R2.71 Oc1ccccc1CCc2ccccc2 Amb17843033 [0,1,0,0,0,0|2,0,0]=3 191 B16R2.71 Oc1ccccc1CNc2ccccc2 Amb2720827 [0,1,0,0,0,0|2,0,0]=3 192 B16R2.71 Oc1ccccc1CNc2ccccn2 Amb33276251 [0,1,0,0,0,0|3,0,0]=4 193 B16R2.71 Oc1ccccc1CNc2cccnc2 Amb2692216 [0,1,0,0,0,0|3,0,0]=4 194 B16R2.71 Oc1ccccc1NCc2ccccc2 Amb1076536 [0,1,0,0,0,0|2,0,0]=3 195 B16R2.71 Oc1ccccc1NCc2ccccn2 Amb22901094 [0,1,0,0,0,0|3,0,0]=4 196 B16R2.71 Oc1ccccc1OCc2ccccc2 Amb2583282 [0,1,0,0,0,0|1,1,0]=3 197 B16R2.71 Oc1ccccc1\C=C\c2ccccc2 Amb17920449 [0,1,0,0,0,0|2,0,0]=3 198 B16R2.71 Oc1ccccc1\C=C\c2ccccn2 Amb534209 [0,1,0,0,0,0|3,0,0]=4 199 B16R2.71 Oc1ccccc1\C=C\c2ccncc2 Amb2525845 [0,1,0,0,0,0|3,0,0]=4 200 B16R2.71 Oc1ccccc1\C=N\c2ccccc2 Amb2386606 [0,1,0,0,0,0|2,0,0]=3 201 B16R2.71 Oc1ccccc1\C=N\c2ccccn2 Amb1020156 [0,1,0,0,0,0|3,0,0]=4 202 B16R2.71 Oc1ccccc1\N=N\c2ccccc2 Amb21812043 [0,1,0,0,0,0|2,0,0]=3 203 B16R2.71 Oc1cccnc1OCc2ccccc2 Amb2699423 [0,1,0,0,0,0|2,1,0]=4 204 B16R2.71 Oc1ccncc1OCc2ccccc2 Amb26457014 [0,1,0,0,0,0|2,1,0]=4 205 B16R2.71 Oc1cnccc1OCc2ccccc2 Amb25184181 [0,1,0,0,0,0|2,1,0]=4 206 B16R2.71 Sc1ccccc1NCc2ccccc2 Amb27643633 [0,1,0,0,0,0|2,0,0]=3 207 B16R2.71 Sc1ccccc1OCc2ccccc2 Amb26321985 [0,1,0,0,0,0|1,1,0]=3 208 B16R2.71 [NH3+]c1ccccc1\C=C/c2ccccc2 Amb31302363 [0,1,0,0,0,0|2,0,0]=3 209 B16R2.71 [NH3+]c1ccccc1\C=C\c2ccccc2 Amb17777295 [0,1,0,0,0,0|2,0,0]=3 210 B16R2.71 [O-]c1ccccc1CNc2cccc[nH+]2 Amb4229463 [0,1,0,0,0,0|3,0,0]=4 211 B16R2.88 BrC(Cc1ccccc1)c2ccccc2 Amb9210661 [0,1,0,0,0,0|2,0,0]=3 212 B16R2.88 BrC(Cc1ccccc1)c2ccccn2 Amb29845392 [0,1,0,0,0,0|3,0,0]=4 213 B16R2.88 BrC(Cc1ccccc1)c2cccnc2 Amb29845394 [0,1,0,0,0,0|3,0,0]=4 214 B16R2.88 BrC(Cc1ccccc1)c2ccncc2 Amb29845396 [0,1,0,0,0,0|3,0,0]=4 215 B16R2.88 BrC(Cc1ccncc1)c2ccccc2 Amb28040756 [0,1,0,0,0,0|3,0,0]=4 216 B16R2.88 CC(Nc1ccccc1)c2ccccc2 Amb4017037 [0,1,0,0,0,0|2,0,0]=3 217 B16R2.88 CC(Nc1ccccc1)c2ccccn2 Amb534556 [0,1,0,0,0,0|3,0,0]=4 218 B16R2.88 CC(Nc1ccccc1)c2cccnc2 Amb9739106 [0,1,0,0,0,0|3,0,0]=4 219 B16R2.88 CC(Nc1ccccc1)c2ccncc2 Amb6356068 [0,1,0,0,0,0|3,0,0]=4 220 B16R2.88 CC(Nc1ccccn1)c2ccccc2 Amb6645085 [0,1,0,0,0,0|3,0,0]=4 221 B16R2.88 CN(Cc1ccccc1)c2ccccc2 Amb9787584 [0,1,0,0,0,0|2,0,0]=3 222 B16R2.88 CN(Cc1ccccc1)c2ccccn2 Amb17967451 [0,1,0,0,0,0|3,0,0]=4 223 B16R2.88 CN(Cc1ccccc1)c2cccnc2 Amb17967452 [0,1,0,0,0,0|3,0,0]=4 224 B16R2.88 C\C(=N/c1ccccc1)c2ccccc2 Amb17779517 [0,1,0,0,0,0|2,0,0]=3 225 B16R2.88 ClC(Cc1ccccc1)c2ccccc2 Amb9749535 [0,1,0,0,0,0|2,0,0]=3 226 B16R2.88 ClC(Cc1ccccn1)c2ccccc2 Amb27989133 [0,1,0,0,0,0|3,0,0]=4 227 B16R2.88 Cl\C(=N/c1cccnc1)c2ccccc2 Amb32668811 [0,1,0,0,0,0|3,0,0]=4 228 B16R2.88 N=C(Nc1ccccc1)c2ccccc2 Amb1644481 [0,1,0,0,0,0|2,0,0]=3 229 B16R2.88 NC(Cc1ccccc1)c2ccccc2 Amb1657727 [0,1,0,0,0,0|2,0,0]=3 230 B16R2.88 NC(Cc1ccccc1)c2ccccc2 Amb3431767 [0,1,0,0,0,0|2,0,0]=3 231 B16R2.88 NC(Cc1ccccc1)c2ccccn2 Amb10610594 [0,1,0,0,0,0|3,0,0]=4 232 B16R2.88 NC(Cc1ccccc1)c2cccnc2 Amb18289054 [0,1,0,0,0,0|3,0,0]=4 233 B16R2.88 NC(Cc1ccccc1)c2ccncc2 Amb18289050 [0,1,0,0,0,0|3,0,0]=4 234 B16R2.88 NC(Cc1ccccn1)c2ccccc2 Amb32666135 [0,1,0,0,0,0|3,0,0]=4 235 B16R2.88 NC(Cc1ccccn1)c2ccccc2 Amb7772122 [0,1,0,0,0,0|3,0,0]=4 236 B16R2.88 NN(Cc1ccccc1)c2ccccc2 Amb3620838 [0,1,0,0,0,0|2,0,0]=3 237 B16R2.88 NN(Cc1ccccc1)c2ccccc2 Amb4397512 [0,1,0,0,0,0|2,0,0]=3 238 B16R2.88 N[C@@H](Cc1ccccn1)c2ccccc2 Amb26304416 [0,1,0,0,0,0|3,0,0]=4 239 B16R2.88 N[C@@H](Cc1ccccn1)c2ccccc2 Amb33140984 [0,1,0,0,0,0|3,0,0]=4 240 B16R2.88 N\C(=N/c1cccnc1)c2ccccc2 Amb33362314 [0,1,0,0,0,0|3,0,0]=4 241 B16R2.88 N\C(=N\c1ccccc1)c2ccccc2 Amb3318637 [0,1,0,0,0,0|2,0,0]=3 242 B16R2.88 O=C(C[n+]1ccccc1)c2ccccc2 Amb2228102 [0,1,0,0,0,0|3,0,0]=4 243 B16R2.88 O=C(Cc1ccccc1)c2ccccc2 Amb1205838 [0,1,0,0,0,0|2,0,0]=3 244 B16R2.88 O=C(Cc1ccccc1)c2ccccn2 Amb10554500 [0,1,0,0,0,0|3,0,0]=4 245 B16R2.88 O=C(Cc1ccccc1)c2cccnc2 Amb5720532 [0,1,0,0,0,0|3,0,0]=4 246 B16R2.88 O=C(Cc1ccccc1)c2ccncc2 Amb33534977 [0,1,0,0,0,0|3,0,0]=4 247 B16R2.88 O=C(Cc1ccccn1)c2ccccc2 Amb33529218 [0,1,0,0,0,0|3,0,0]=4 248 B16R2.88 O=C(Cc1ccncc1)c2ccccc2 Amb33530368 [0,1,0,0,0,0|3,0,0]=4 249 B16R2.88 O=C(Nc1ccccc1)c2ccccc2 Amb6346347 [0,1,0,0,0,0|2,0,0]=3 250 B16R2.88 O=C(Nc1ccccc1)c2ccccn2 Amb2617913 [0,1,0,0,0,0|3,0,0]=4 251 B16R2.88 O=C(Nc1ccccc1)c2cccnc2 Amb1195992 [0,1,0,0,0,0|3,0,0]=4 252 B16R2.88 O=C(Nc1ccccc1)c2ccncc2 Amb6443347 [0,1,0,0,0,0|3,0,0]=4 253 B16R2.88 O=C(Nc1ccccn1)c2ccccc2 Amb491228 [0,1,0,0,0,0|3,0,0]=4 254 B16R2.88 O=C(Nc1ccccn1)c2ccccc2 Amb7966466 [0,1,0,0,0,0|3,0,0]=4 255 B16R2.88 O=C(Nc1cccnc1)c2ccccc2 Amb3368143 [0,1,0,0,0,0|3,0,0]=4 256 B16R2.88 O=C(Nc1ccncc1)c2ccccc2 Amb2674634 [0,1,0,0,0,0|3,0,0]=4 257 B16R2.88 O=C(Oc1ccccc1)c2ccccc2 Amb2389283 [0,1,0,0,0,0|1,1,0]=3 258 B16R2.88 O=C(Oc1ccccc1)c2cccnc2 Amb4017594 [0,1,0,0,0,0|2,1,0]=4 259 B16R2.88 O=C(Oc1ccccc1)c2ccncc2 Amb4081020 [0,1,0,0,0,0|2,1,0]=4 260 B16R2.88 O=C(Oc1ccccn1)c2ccccc2 Amb2609898 [0,1,0,0,0,0|2,1,0]=4 261 B16R2.88 O=C(Oc1cccnc1)c2ccccc2 Amb2609761 [0,1,0,0,0,0|2,1,0]=4 262 B16R2.88 O=C(Sc1ccccc1)c2cnccn2 Amb2447236 [0,1,0,0,0,0|3,0,0]=4 263 B16R2.88 O=S(Cc1ccccc1)c2ccccc2 Amb2754572 [0,1,0,0,0,0|1,0,1]=3 264 B16R2.88 OC(C[n+]1ccccc1)c2ccccc2 Amb2613503 [0,1,0,0,0,0|3,0,0]=4 265 B16R2.88 OC(Cc1ccccc1)c2ccccc2 Amb9704347 [0,1,0,0,0,0|2,0,0]=3 266 B16R2.88 OC(Cc1ccccc1)c2ccccn2 Amb10567656 [0,1,0,0,0,0|3,0,0]=4 267 B16R2.88 OC(Cc1ccccc1)c2cccnc2 Amb17236934 [0,1,0,0,0,0|3,0,0]=4 268 B16R2.88 OC(Cc1ccccc1)c2ccncc2 Amb8439792 [0,1,0,0,0,0|3,0,0]=4 269 B16R2.88 OC(Cc1ccccn1)c2ccccc2 Amb10554546 [0,1,0,0,0,0|3,0,0]=4 270 B16R2.88 ON(Cc1ccccc1)c2cccnc2 Amb27641916 [0,1,0,0,0,0|3,0,0]=4 271 B16R2.88 O[C@@H](Cc1ccccn1)c2ccccc2 Amb33249664 [0,1,0,0,0,0|3,0,0]=4 272 B16R2.88 S=C(Nc1ccccc1)c2ccccc2 Amb6337484 [0,1,0,0,0,0|2,0,0]=3 273 B16R2.88 SC(Cc1ccccc1)c2ccccc2 Amb7784738 [0,1,0,0,0,0|2,0,0]=3 274 B16R2.88 [NH2+]=C(Nc1ccccc1)c2ccccc2 Amb33513293 [0,1,0,0,0,0|2,0,0]=3 275 B16R2.88 [NH3+]C(Cc1ccccc1)c2ccccc2 Amb33513302 [0,1,0,0,0,0|2,0,0]=3 276 B16R2.88 [NH3+]N(Cc1ccccc1)c2ccccc2 Amb24113854 [0,1,0,0,0,0|2,0,0]=3 277 B16R2.132 Brc1ccc(C#Cc2ccccc2)cc1 Amb8447578 [0,1,0,0,0,0|2,0,0]=3 278 B16R2.132 Brc1ccc(CNc2ccccc2)cc1 Amb838971 [0,1,0,0,0,0|2,0,0]=3 279 B16R2.132 Brc1ccc(CNc2ccccn2)cc1 Amb3360975 [0,1,0,0,0,0|3,0,0]=4 280 B16R2.132 Brc1ccc(CNc2cccnc2)cc1 Amb6686461 [0,1,0,0,0,0|3,0,0]=4 281 B16R2.132 Brc1ccc(COc2ccccc2)cc1 Amb2710379 [0,1,0,0,0,0|1,1,0]=3 282 B16R2.132 Brc1ccc(COc2ccccc2)nc1 Amb28457102 [0,1,0,0,0,0|2,1,0]=4 283 B16R2.132 Brc1ccc(CSc2ccccc2)cc1 Amb22482416 [0,1,0,0,0,0|1,0,0]=2 284 B16R2.132 Brc1ccc(CSc2ccccc2)nc1 Amb27475623 [0,1,0,0,0,0|2,0,0]=3 285 B16R2.132 Brc1ccc(CSc2ccccn2)nc1 Amb28318698 [0,1,0,0,0,0|3,0,0]=4 286 B16R2.132 Brc1ccc(CSc2ccncc2)cc1 Amb27975232 [0,1,0,0,0,0|2,0,0]=3 287 B16R2.132 Brc1ccc(NCc2ccccc2)cc1 Amb33328969 [0,1,0,0,0,0|2,0,0]=3 288 B16R2.132 Brc1ccc(NCc2ccccc2)cc1 Amb839003 [0,1,0,0,0,0|2,0,0]=3 289 B16R2.132 Brc1ccc(NCc2ccccc2)nc1 Amb2618039 [0,1,0,0,0,0|3,0,0]=4 290 B16R2.132 Brc1ccc(NCc2ccccn2)cc1 Amb1897865 [0,1,0,0,0,0|3,0,0]=4 291 B16R2.132 Brc1ccc(NCc2cccnc2)cc1 Amb837638 [0,1,0,0,0,0|3,0,0]=4 292 B16R2.132 Brc1ccc(NCc2ccncc2)cc1 Amb837732 [0,1,0,0,0,0|3,0,0]=4 293 B16R2.132 Brc1ccc(OCc2ccccc2)cc1 Amb2447239 [0,1,0,0,0,0|1,1,0]=3 294 B16R2.132 Brc1ccc(OCc2ccccc2)cn1 Amb22498131 [0,1,0,0,0,0|2,1,0]=4 295 B16R2.132 Brc1ccc(OCc2ccccc2)nc1 Amb20241254 [0,1,0,0,0,0|2,1,0]=4 296 B16R2.132 Brc1ccc(OCc2ccncc2)cc1 Amb6270902 [0,1,0,0,0,0|2,1,0]=4 297 B16R2.132 Brc1ccc(SCc2ccccc2)cc1 Amb4012831 [0,1,0,0,0,0|1,0,0]=2 298 B16R2.132 Brc1ccc(SCc2ccccc2)nc1 Amb27610829 [0,1,0,0,0,0|2,0,0]=3 299 B16R2.132 Brc1ccc(\C=C\c2ccccc2)cc1 Amb4035121 [0,1,0,0,0,0|2,0,0]=3 300 B16R2.132 Brc1ccc(\N=C\c2ccccc2)cc1 Amb3725287 [0,1,0,0,0,0|2,0,0]=3 301 B16R2.132 Brc1ccc(\N=C\c2ccncc2)cc1 Amb3727221 [0,1,0,0,0,0|3,0,0]=4 302 B16R2.132 Brc1ccc(\N=N\c2ccccc2)cc1 Amb21811992 [0,1,0,0,0,0|2,0,0]=3 303 B16R2.132 Brc1cnc(SCc2ccccc2)cn1 Amb28292794 [0,1,0,0,0,0|3,0,0]=4 304 B16R2.132 Brc1cnc(SCc2ccccc2)nc1 Amb21856640 [0,1,0,0,0,0|3,0,0]=4 305 B16R2.132 C[n+]1ccc(OCc2ccccc2)cc1 Amb28204063 [0,1,0,0,0,0|2,1,0]=4 306 B16R2.132 Cc1ccc(C#Cc2ccccc2)cc1 Amb8392048 [0,1,0,0,0,0|2,0,0]=3 307 B16R2.132 Cc1ccc(C#Cc2ccccc2)nc1 Amb22274623 [0,1,0,0,0,0|3,0,0]=4 308 B16R2.132 Cc1ccc(CCc2ccccc2)cc1 Amb26640344 [0,1,0,0,0,0|2,0,0]=3 309 B16R2.132 Cc1ccc(CNc2ccccc2)cc1 Amb3725174 [0,1,0,0,0,0|2,0,0]=3 310 B16R2.132 Cc1ccc(CNc2ccccn2)cc1 Amb2577761 [0,1,0,0,0,0|3,0,0]=4 311 B16R2.132 Cc1ccc(CNc2cccnc2)cc1 Amb2762686 [0,1,0,0,0,0|3,0,0]=4 312 B16R2.132 Cc1ccc(NCc2ccccc2)cc1 Amb1651808 [0,1,0,0,0,0|2,0,0]=3 313 B16R2.132 Cc1ccc(NCc2ccccc2)cn1 Amb25089853 [0,1,0,0,0,0|3,0,0]=4 314 B16R2.132 Cc1ccc(NCc2ccccn2)cc1 Amb6700874 [0,1,0,0,0,0|3,0,0]=4 315 B16R2.132 Cc1ccc(NCc2cccnc2)cc1 Amb837787 [0,1,0,0,0,0|3,0,0]=4 316 B16R2.132 Cc1ccc(NCc2ccncc2)cc1 Amb837947 [0,1,0,0,0,0|3,0,0]=4 317 B16R2.132 Cc1ccc(OCc2ccccc2)cc1 Amb4018566 [0,1,0,0,0,0|1,1,0]=3 318 B16R2.132 Cc1ccc(OCc2ccccc2)cn1 Amb26873852 [0,1,0,0,0,0|2,1,0]=4 319 B16R2.132 Cc1ccc(SCc2ccccc2)cn1 Amb32924644 [0,1,0,0,0,0|2,0,0]=3 320 B16R2.132 Cc1ccc(\C=C\c2ccccc2)cc1 Amb24323238 [0,1,0,0,0,0|2,0,0]=3 321 B16R2.132 Cc1ccc(\N=C\c2ccccn2)cc1 Amb24072437 [0,1,0,0,0,0|3,0,0]=4 322 B16R2.132 Clc1ccc(C#Cc2ccccc2)cc1 Amb10554672 [0,1,0,0,0,0|2,0,0]=3 323 B16R2.132 Clc1ccc(CNc2ccccc2)cc1 Amb839008 [0,1,0,0,0,0|2,0,0]=3 324 B16R2.132 Clc1ccc(CNc2ccccn2)cc1 Amb1839885 [0,1,0,0,0,0|3,0,0]=4 325 B16R2.132 Clc1ccc(CNc2cccnc2)cc1 Amb22489636 [0,1,0,0,0,0|3,0,0]=4 326 B16R2.132 Clc1ccc(CNc2cccnc2)cc1 Amb2383001 [0,1,0,0,0,0|3,0,0]=4 327 B16R2.132 Clc1ccc(CNc2ccncc2)cc1 Amb22489637 [0,1,0,0,0,0|3,0,0]=4 328 B16R2.132 Clc1ccc(COc2ccccc2)cn1 Amb6247442 [0,1,0,0,0,0|2,1,0]=4 329 B16R2.132 Clc1ccc(COc2ccccn2)cc1 Amb10766366 [0,1,0,0,0,0|2,1,0]=4 330 B16R2.132 Clc1ccc(CSc2ccccc2)cc1 Amb2610191 [0,1,0,0,0,0|1,0,0]=2 331 B16R2.132 Clc1ccc(CSc2ccccc2)cn1 Amb6675873 [0,1,0,0,0,0|2,0,0]=3 332 B16R2.132 Clc1ccc(CSc2ccccn2)cn1 Amb6675885 [0,1,0,0,0,0|3,0,0]=4 333 B16R2.132 Clc1ccc(NCc2ccccc2)cc1 Amb3765690 [0,1,0,0,0,0|2,0,0]=3 334 B16R2.132 Clc1ccc(NCc2ccccc2)cn1 Amb25831247 [0,1,0,0,0,0|3,0,0]=4 335 B16R2.132 Clc1ccc(NCc2ccccn2)cc1 Amb6695987 [0,1,0,0,0,0|3,0,0]=4 336 B16R2.132 Clc1ccc(NCc2cccnc2)cc1 Amb2222641 [0,1,0,0,0,0|3,0,0]=4 337 B16R2.132 Clc1ccc(NCc2ccncc2)cc1 Amb838090 [0,1,0,0,0,0|3,0,0]=4 338 B16R2.132 Clc1ccc(OCc2ccccc2)cc1 Amb2684651 [0,1,0,0,0,0|1,1,0]=3 339 B16R2.132 Clc1ccc(OCc2ccccc2)cn1 Amb22498130 [0,1,0,0,0,0|2,1,0]=4 340 B16R2.132 Clc1ccc(OCc2ccccc2)nc1 Amb24082317 [0,1,0,0,0,0|2,1,0]=4 341 B16R2.132 Clc1ccc(SCc2ccccc2)nn1 Amb8873141 [0,1,0,0,0,0|3,0,0]=4 342 B16R2.132 Clc1ccc(\C=C\c2ccccc2)cc1 Amb10568579 [0,1,0,0,0,0|2,0,0]=3 343 B16R2.132 Clc1ccc(\C=N\c2ccccc2)cc1 Amb2227970 [0,1,0,0,0,0|2,0,0]=3 344 B16R2.132 Clc1ccc(\N=N\c2ccccc2)cc1 Amb21811991 [0,1,0,0,0,0|2,0,0]=3 345 B16R2.132 Clc1cnc(SCc2ccccc2)cn1 Amb27640374 [0,1,0,0,0,0|3,0,0]=4 346 B16R2.132 Fc1ccc(C#Cc2ccccc2)cn1 Amb32412711 [0,1,0,0,0,0|3,0,0]=4 347 B16R2.132 Fc1ccc(CNc2ccccc2)cc1 Amb3725460 [0,1,0,0,0,0|2,0,0]=3 348 B16R2.132 Fc1ccc(CNc2ccccn2)cc1 Amb22489870 [0,1,0,0,0,0|3,0,0]=4 349 B16R2.132 Fc1ccc(CNc2ccccn2)cc1 Amb2382993 [0,1,0,0,0,0|3,0,0]=4 350 B16R2.132 Fc1ccc(NCc2ccccc2)cc1 Amb3726374 [0,1,0,0,0,0|2,0,0]=3 351 B16R2.132 Fc1ccc(NCc2ccccc2)nc1 Amb18975390 [0,1,0,0,0,0|3,0,0]=4 352 B16R2.132 Fc1ccc(NCc2ccccn2)cc1 Amb6696824 [0,1,0,0,0,0|3,0,0]=4 353 B16R2.132 Fc1ccc(NCc2cccnc2)cc1 Amb6336198 [0,1,0,0,0,0|3,0,0]=4 354 B16R2.132 Fc1ccc(NCc2ccncc2)cc1 Amb6351906 [0,1,0,0,0,0|3,0,0]=4 355 B16R2.132 Fc1ccc(OCc2ccccc2)cc1 Amb2684652 [0,1,0,0,0,0|1,1,0]=3 356 B16R2.132 Fc1ccc(OCc2ccccc2)cn1 Amb27774067 [0,1,0,0,0,0|2,1,0]=4 357 B16R2.132 Fc1ccc(OCc2ccccc2)nc1 Amb19959570 [0,1,0,0,0,0|2,1,0]=4 358 B16R2.132 Fc1ccc(\C=N\c2ccccc2)cc1 Amb2227967 [0,1,0,0,0,0|2,0,0]=3 359 B16R2.132 Fc1ccc(\N=N\c2ccccc2)cc1 Amb2390018 [0,1,0,0,0,0|2,0,0]=3 360 B16R2.132 Ic1ccc(C#Cc2ccccc2)cc1 Amb34914086 [0,1,0,0,0,0|2,0,0]=3 361 B16R2.132 Ic1ccc(CSc2ccccn2)cc1 Amb28341089 [0,1,0,0,0,0|2,0,0]=3 362 B16R2.132 Ic1ccc(CSc2ccncc2)cc1 Amb28076032 [0,1,0,0,0,0|2,0,0]=3 363 B16R2.132 Ic1ccc(CSc2ccncn2)cc1 Amb27794185 [0,1,0,0,0,0|3,0,0]=4 364 B16R2.132 Ic1ccc(CSc2cnccn2)cc1 Amb27403430 [0,1,0,0,0,0|3,0,0]=4 365 B16R2.132 Ic1ccc(NCc2ccccc2)cc1 Amb7760853 [0,1,0,0,0,0|2,0,0]=3 366 B16R2.132 Ic1ccc(NCc2ccccn2)cc1 Amb9208146 [0,1,0,0,0,0|3,0,0]=4 367 B16R2.132 Ic1ccc(NCc2cccnc2)cc1 Amb9204453 [0,1,0,0,0,0|3,0,0]=4 368 B16R2.132 Ic1ccc(NCc2ccncc2)cc1 Amb9203698 [0,1,0,0,0,0|3,0,0]=4 369 B16R2.132 Ic1ccc(OCc2ccccc2)cc1 Amb2684653 [0,1,0,0,0,0|1,1,0]=3 370 B16R2.132 Ic1ccc(OCc2ccccc2)cn1 Amb26380391 [0,1,0,0,0,0|2,1,0]=4 371 B16R2.132 Ic1ccc(OCc2ccccn2)cc1 Amb20627464 [0,1,0,0,0,0|2,1,0]=4 372 B16R2.132 Ic1ccc(OCc2cccnc2)cc1 Amb20626245 [0,1,0,0,0,0|2,1,0]=4 373 B16R2.132 Ic1ccc(OCc2ccncc2)cc1 Amb20627465 [0,1,0,0,0,0|2,1,0]=4 374 B16R2.132 Nc1ccc(C#Cc2ccccc2)cc1 Amb2416700 [0,1,0,0,0,0|2,0,0]=3 375 B16R2.132 Nc1ccc(CCc2ccccc2)cc1 Amb17101879 [0,1,0,0,0,0|2,0,0]=3 376 B16R2.132 Nc1ccc(CCc2ccccc2)cc1 Amb21954210 [0,1,0,0,0,0|2,0,0]=3 377 B16R2.132 Nc1ccc(CCc2ccccn2)cc1 Amb1102660 [0,1,0,0,0,0|3,0,0]=4 378 B16R2.132 Nc1ccc(CCc2ccccn2)cc1 Amb17622183 [0,1,0,0,0,0|3,0,0]=4 379 B16R2.132 Nc1ccc(CCc2ccncc2)cc1 Amb6335843 [0,1,0,0,0,0|3,0,0]=4 380 B16R2.132 Nc1ccc(CNc2ccccc2)cc1 Amb18972361 [0,1,0,0,0,0|2,0,0]=3 381 B16R2.132 Nc1ccc(CNc2ccccn2)cc1 Amb17100060 [0,1,0,0,0,0|3,0,0]=4 382 B16R2.132 Nc1ccc(COc2ccccc2)cc1 Amb1136463 [0,1,0,0,0,0|1,1,0]=3 383 B16R2.132 Nc1ccc(CSc2ccccc2)cc1 Amb2608452 [0,1,0,0,0,0|1,0,0]=2 384 B16R2.132 Nc1ccc(CSc2ccccn2)cc1 Amb6676759 [0,1,0,0,0,0|2,0,0]=3 385 B16R2.132 Nc1ccc(NCc2ccccc2)cc1 Amb4008914 [0,1,0,0,0,0|2,0,0]=3 386 B16R2.132 Nc1ccc(NCc2ccccc2)cc1 Amb836918 [0,1,0,0,0,0|2,0,0]=3 387 B16R2.132 Nc1ccc(NCc2ccccc2)cn1 Amb7767650 [0,1,0,0,0,0|3,0,0]=4 388 B16R2.132 Nc1ccc(NCc2ccccc2)nc1 Amb836910 [0,1,0,0,0,0|3,0,0]=4 389 B16R2.132 Nc1ccc(NCc2ccccn2)cc1 Amb9205291 [0,1,0,0,0,0|3,0,0]=4 390 B16R2.132 Nc1ccc(NCc2cccnc2)cc1 Amb7768123 [0,1,0,0,0,0|3,0,0]=4 391 B16R2.132 Nc1ccc(NCc2ccncc2)cc1 Amb9205306 [0,1,0,0,0,0|3,0,0]=4 392 B16R2.132 Nc1ccc(OCc2ccccc2)cc1 Amb22489506 [0,1,0,0,0,0|1,1,0]=3 393 B16R2.132 Nc1ccc(OCc2ccccc2)cc1 Amb2719847 [0,1,0,0,0,0|1,1,0]=3 394 B16R2.132 Nc1ccc(OCc2ccccc2)cc1 Amb6315574 [0,1,0,0,0,0|1,1,0]=3 395 B16R2.132 Nc1ccc(OCc2ccccc2)cn1 Amb30625649 [0,1,0,0,0,0|2,1,0]=4 396 B16R2.132 Nc1ccc(OCc2ccccc2)cn1 Amb6679789 [0,1,0,0,0,0|2,1,0]=4 397 B16R2.132 Nc1ccc(OCc2ccccc2)nc1 Amb1124881 [0,1,0,0,0,0|2,1,0]=4 398 B16R2.132 Nc1ccc(OCc2ccccn2)cc1 Amb1099016 [0,1,0,0,0,0|2,1,0]=4 399 B16R2.132 Nc1ccc(OCc2ccccn2)cc1 Amb22279532 [0,1,0,0,0,0|2,1,0]=4 400 B16R2.132 Nc1ccc(OCc2cccnc2)cc1 Amb1114707 [0,1,0,0,0,0|2,1,0]=4 401 B16R2.132 Nc1ccc(OCc2cccnc2)cc1 Amb24053231 [0,1,0,0,0,0|2,1,0]=4 402 B16R2.132 Nc1ccc(OCc2ccncc2)cc1 Amb1133349 [0,1,0,0,0,0|2,1,0]=4 403 B16R2.132 Nc1ccc(SCc2ccccc2)cc1 Amb6675929 [0,1,0,0,0,0|1,0,0]=2 404 B16R2.132 Nc1ccc(SCc2ccccc2)cn1 Amb6680021 [0,1,0,0,0,0|2,0,0]=3 405 B16R2.132 Nc1ccc(SCc2cccnc2)cc1 Amb86685 [0,1,0,0,0,0|2,0,0]=3 406 B16R2.132 Nc1ccc(\C=C\c2ccccc2)cc1 Amb33513281 [0,1,0,0,0,0|2,0,0]=3 407 B16R2.132 Nc1ccc(\C=C\c2ccccn2)cc1 Amb22587642 [0,1,0,0,0,0|3,0,0]=4 408 B16R2.132 Nc1ccc(\C=C\c2ccncc2)cc1 Amb2369841 [0,1,0,0,0,0|3,0,0]=4 409 B16R2.132 Nc1ccc(\N=N\c2ccccc2)cc1 Amb1348283 [0,1,0,0,0,0|2,0,0]=3 410 B16R2.132 Nc1cnc(CSc2ccccc2)nc1 Amb17486579 [0,1,0,0,0,0|3,0,0]=4 411 B16R2.132 O=C1C=CC(NCc2ccccc2)=CN1 Amb27851180 [0,1,0,0,0,0|3,0,0]=4 412 B16R2.132 O=C1N=CC(SCc2ccccc2)=CN1 Amb33038297 [0,1,0,0,0,0|3,0,0]=4 413 B16R2.132 Oc1ccc(C#Cc2ccccc2)cc1 Amb10610495 [0,1,0,0,0,0|2,0,0]=3 414 B16R2.132 Oc1ccc(CNc2ccccc2)cc1 Amb10609692 [0,1,0,0,0,0|2,0,0]=3 415 B16R2.132 Oc1ccc(CNc2ccccc2)cc1 Amb3544585 [0,1,0,0,0,0|2,0,0]=3 416 B16R2.132 Oc1ccc(CNc2ccccn2)cc1 Amb15694898 [0,1,0,0,0,0|3,0,0]=4 417 B16R2.132 Oc1ccc(NCc2ccccc2)cc1 Amb837935 [0,1,0,0,0,0|2,0,0]=3 418 B16R2.132 Oc1ccc(OCc2ccccc2)cc1 Amb1228378 [0,1,0,0,0,0|1,1,0]=3 419 B16R2.132 Oc1ccc(OCc2ccccc2)nc1 Amb2699422 [0,1,0,0,0,0|2,1,0]=4 420 B16R2.132 Oc1ccc(OCc2cccnc2)cc1 Amb33528796 [0,1,0,0,0,0|2,1,0]=4 421 B16R2.132 Oc1ccc(OCc2ccncc2)cc1 Amb9210957 [0,1,0,0,0,0|2,1,0]=4 422 B16R2.132 Oc1ccc(SCc2ccccc2)cc1 Amb30594452 [0,1,0,0,0,0|1,0,0]=2 423 B16R2.132 Oc1ccc(\C=C\c2ccccc2)cc1 Amb6357380 [0,1,0,0,0,0|2,0,0]=3 424 B16R2.132 Oc1ccc(\C=C\c2ccccn2)cc1 Amb1273313 [0,1,0,0,0,0|3,0,0]=4 425 B16R2.132 Oc1ccc(\C=C\c2ccncc2)cc1 Amb1156036 [0,1,0,0,0,0|3,0,0]=4 426 B16R2.132 Oc1ccc(\N=C\c2ccccc2)cc1 Amb2778379 [0,1,0,0,0,0|2,0,0]=3 427 B16R2.132 Oc1ccc(\N=C\c2cccnc2)cc1 Amb6344039 [0,1,0,0,0,0|3,0,0]=4 428 B16R2.132 Oc1ccc(\N=N\c2ccccc2)cc1 Amb8516757 [0,1,0,0,0,0|2,0,0]=3 429 B16R2.132 Sc1ccc(OCc2ccccc2)cc1 Amb27767077 [0,1,0,0,0,0|1,1,0]=3 430 B16R2.132 [NH3+]c1ccc(OCc2ccccc2)cc1 Amb24113829 [0,1,0,0,0,0|1,1,0]=3 431 B16R2.132 [O-][n+]1ccc(OCc2ccccc2)cc1 Amb2631918 [0,1,0,0,0,0|2,1,0]=4 432 B16R2.252 Brc1cc(NCc2ccccc2)ccn1 Amb27484913 [0,1,0,0,0,0|3,0,0]=4 433 B16R2.252 Brc1cc(OCc2ccccc2)ccn1 Amb23401282 [0,1,0,0,0,0|2,1,0]=4 434 B16R2.252 Brc1cccc(CNc2ccccc2)c1 Amb838042 [0,1,0,0,0,0|2,0,0]=3 435 B16R2.252 Brc1cccc(CNc2ccccn2)c1 Amb17100055 [0,1,0,0,0,0|3,0,0]=4 436 B16R2.252 Brc1cccc(CNc2cccnc2)c1 Amb6686464 [0,1,0,0,0,0|3,0,0]=4 437 B16R2.252 Brc1cccc(COc2ccccc2)c1 Amb2724116 [0,1,0,0,0,0|1,1,0]=3 438 B16R2.252 Brc1cccc(CSc2ccccc2)c1 Amb5221073 [0,1,0,0,0,0|1,0,0]=2 439 B16R2.252 Brc1cccc(CSc2ccccc2)n1 Amb27196920 [0,1,0,0,0,0|2,0,0]=3 440 B16R2.252 Brc1cccc(CSc2ccccn2)n1 Amb28293468 [0,1,0,0,0,0|3,0,0]=4 441 B16R2.252 Brc1cccc(CSc2ncccn2)c1 Amb5110851 [0,1,0,0,0,0|3,0,0]=4 442 B16R2.252 Brc1cccc(NCc2ccccc2)c1 Amb838939 [0,1,0,0,0,0|2,0,0]=3 443 B16R2.252 Brc1cccc(NCc2ccccc2)n1 Amb19959441 [0,1,0,0,0,0|3,0,0]=4 444 B16R2.252 Brc1cccc(NCc2ccccn2)c1 Amb6696685 [0,1,0,0,0,0|3,0,0]=4 445 B16R2.252 Brc1cccc(NCc2cccnc2)c1 Amb6696594 [0,1,0,0,0,0|3,0,0]=4 446 B16R2.252 Brc1cccc(NCc2ccncc2)c1 Amb6696599 [0,1,0,0,0,0|3,0,0]=4 447 B16R2.252 Brc1cccc(OCc2ccccc2)c1 Amb2684648 [0,1,0,0,0,0|1,1,0]=3 448 B16R2.252 Brc1cccc(OCc2ccccc2)n1 Amb8388596 [0,1,0,0,0,0|2,1,0]=4 449 B16R2.252 Brc1cccc(OCc2ccccn2)c1 Amb6257056 [0,1,0,0,0,0|2,1,0]=4 450 B16R2.252 Brc1cccc(OCc2cccnc2)c1 Amb6272400 [0,1,0,0,0,0|2,1,0]=4 451 B16R2.252 Brc1cccc(OCc2ccncc2)c1 Amb6260467 [0,1,0,0,0,0|2,1,0]=4 452 B16R2.252 Brc1ccnc(NCc2ccccc2)c1 Amb19959554 [0,1,0,0,0,0|3,0,0]=4 453 B16R2.252 Brc1ccnc(OCc2ccccc2)c1 Amb19959540 [0,1,0,0,0,0|2,1,0]=4 454 B16R2.252 Brc1cncc(CNc2ccccc2)c1 Amb22276864 [0,1,0,0,0,0|3,0,0]=4 455 B16R2.252 Brc1cncc(NCc2ccccc2)c1 Amb24079791 [0,1,0,0,0,0|3,0,0]=4 456 B16R2.252 Brc1cncc(OCc2ccccc2)c1 Amb10067157 [0,1,0,0,0,0|2,1,0]=4 457 B16R2.252 Brc1cncc(SCc2ccccc2)c1 Amb28906204 [0,1,0,0,0,0|2,0,0]=3 458 B16R2.252 C[n+]1cccc(OCc2ccccc2)c1 Amb2609786 [0,1,0,0,0,0|2,1,0]=4 459 B16R2.252 Cc1cc(OCc2ccccc2)ccn1 Amb28291370 [0,1,0,0,0,0|2,1,0]=4 460 B16R2.252 Cc1cccc(C#Cc2ccccc2)n1 Amb19650931 [0,1,0,0,0,0|3,0,0]=4 461 B16R2.252 Cc1cccc(C#Cc2ccccc2)n1 Amb6296409 [0,1,0,0,0,0|3,0,0]=4 462 B16R2.252 Cc1cccc(CNc2ccccc2)c1 Amb4313246 [0,1,0,0,0,0|2,0,0]=3 463 B16R2.252 Cc1cccc(CNc2cccnc2)c1 Amb6686481 [0,1,0,0,0,0|3,0,0]=4 464 B16R2.252 Cc1cccc(NCc2ccccc2)c1 Amb419993 [0,1,0,0,0,0|2,0,0]=3 465 B16R2.252 Cc1cccc(NCc2ccccc2)c1 Amb6891897 [0,1,0,0,0,0|2,0,0]=3 466 B16R2.252 Cc1cccc(NCc2ccccc2)n1 Amb2221691 [0,1,0,0,0,0|3,0,0]=4 467 B16R2.252 Cc1cccc(NCc2ccccn2)c1 Amb6684530 [0,1,0,0,0,0|3,0,0]=4 468 B16R2.252 Cc1cccc(NCc2cccnc2)c1 Amb6684424 [0,1,0,0,0,0|3,0,0]=4 469 B16R2.252 Cc1cccc(NCc2ccncc2)c1 Amb6411080 [0,1,0,0,0,0|3,0,0]=4 470 B16R2.252 Cc1cccc(OCc2ccccc2)c1 Amb20622231 [0,1,0,0,0,0|1,1,0]=3 471 B16R2.252 Cc1cccc(OCc2ccccc2)n1 Amb26873289 [0,1,0,0,0,0|2,1,0]=4 472 B16R2.252 Cc1cccc(\C=C\c2ccccc2)n1 Amb24065785 [0,1,0,0,0,0|3,0,0]=4 473 B16R2.252 Cc1ccnc(NCc2ccccc2)c1 Amb3940048 [0,1,0,0,0,0|3,0,0]=4 474 B16R2.252 Cc1ccnc(OCc2ccccc2)c1 Amb25369515 [0,1,0,0,0,0|2,1,0]=4 475 B16R2.252 Cc1cncc(OCc2ccccc2)c1 Amb22043749 [0,1,0,0,0,0|2,1,0]=4 476 B16R2.252 Cc1cncc(SCc2ccccc2)c1 Amb32405893 [0,1,0,0,0,0|2,0,0]=3 477 B16R2.252 Clc1cc(CSc2ccccn2)ccn1 Amb27389528 [0,1,0,0,0,0|3,0,0]=4 478 B16R2.252 Clc1cc(NCc2ccccc2)ccn1 Amb23673540 [0,1,0,0,0,0|3,0,0]=4 479 B16R2.252 Clc1cc(OCc2ccccc2)ccn1 Amb20623632 [0,1,0,0,0,0|2,1,0]=4 480 B16R2.252 Clc1cc(SCc2ccccc2)ccn1 Amb9154883 [0,1,0,0,0,0|2,0,0]=3 481 B16R2.252 Clc1cc(SCc2ccccc2)ncn1 Amb19373369 [0,1,0,0,0,0|3,0,0]=4 482 B16R2.252 Clc1cccc(CNc2ccccc2)c1 Amb4304160 [0,1,0,0,0,0|2,0,0]=3 483 B16R2.252 Clc1cccc(CNc2ccccn2)c1 Amb1761673 [0,1,0,0,0,0|3,0,0]=4 484 B16R2.252 Clc1cccc(CNc2cccnc2)c1 Amb2383002 [0,1,0,0,0,0|3,0,0]=4 485 B16R2.252 Clc1cccc(CNc2ccncc2)c1 Amb24093907 [0,1,0,0,0,0|3,0,0]=4 486 B16R2.252 Clc1cccc(NCc2ccccc2)c1 Amb33328994 [0,1,0,0,0,0|2,0,0]=3 487 B16R2.252 Clc1cccc(NCc2ccccc2)c1 Amb838903 [0,1,0,0,0,0|2,0,0]=3 488 B16R2.252 Clc1cccc(NCc2ccccn2)c1 Amb6695737 [0,1,0,0,0,0|3,0,0]=4 489 B16R2.252 Clc1cccc(NCc2cccnc2)c1 Amb6695669 [0,1,0,0,0,0|3,0,0]=4 490 B16R2.252 Clc1cccc(NCc2ccncc2)c1 Amb4419812 [0,1,0,0,0,0|3,0,0]=4 491 B16R2.252 Clc1cccc(OCc2ccccc2)c1 Amb2610190 [0,1,0,0,0,0|1,1,0]=3 492 B16R2.252 Clc1cccc(OCc2ccccc2)n1 Amb22432532 [0,1,0,0,0,0|2,1,0]=4 493 B16R2.252 Clc1cccc(\C=C\c2ccncc2)c1 Amb22410783 [0,1,0,0,0,0|3,0,0]=4 494 B16R2.252 Clc1ccnc(CSc2ccccc2)n1 Amb26466183 [0,1,0,0,0,0|3,0,0]=4 495 B16R2.252 Clc1ccnc(NCc2ccccc2)c1 Amb27774226 [0,1,0,0,0,0|3,0,0]=4 496 B16R2.252 Clc1ccnc(OCc2ccccc2)c1 Amb22236357 [0,1,0,0,0,0|2,1,0]=4 497 B16R2.252 Clc1ccnc(SCc2ccccc2)c1 Amb22236362 [0,1,0,0,0,0|2,0,0]=3 498 B16R2.252 Clc1ccnc(SCc2ccccn2)c1 Amb22236278 [0,1,0,0,0,0|3,0,0]=4 499 B16R2.252 Clc1ccnc(SCc2cccnc2)c1 Amb22276250 [0,1,0,0,0,0|3,0,0]=4 500 B16R2.252 Clc1ccnc(SCc2ccncc2)c1 Amb22276420 [0,1,0,0,0,0|3,0,0]=4 501 B16R2.252 Clc1cncc(NCc2ccccc2)c1 Amb29864985 [0,1,0,0,0,0|3,0,0]=4 502 B16R2.252 Clc1cncc(SCc2ccccc2)n1 Amb8873489 [0,1,0,0,0,0|3,0,0]=4 503 B16R2.252 Clc1nccc(SCc2ccccc2)n1 Amb20669323 [0,1,0,0,0,0|3,0,0]=4 504 B16R2.252 Fc1cc(OCc2ccccc2)ccn1 Amb22235139 [0,1,0,0,0,0|2,1,0]=4 505 B16R2.252 Fc1cc(SCc2ccccc2)ccn1 Amb27447085 [0,1,0,0,0,0|2,0,0]=3 506 B16R2.252 Fc1cccc(CNc2ccccc2)c1 Amb6685070 [0,1,0,0,0,0|2,0,0]=3 507 B16R2.252 Fc1cccc(CNc2ccccn2)c1 Amb7762026 [0,1,0,0,0,0|3,0,0]=4 508 B16R2.252 Fc1cccc(COc2ccccc2)c1 Amb2691208 [0,1,0,0,0,0|1,1,0]=3 509 B16R2.252 Fc1cccc(NCc2ccccc2)c1 Amb33328760 [0,1,0,0,0,0|2,0,0]=3 510 B16R2.252 Fc1cccc(NCc2ccccc2)c1 Amb6695891 [0,1,0,0,0,0|2,0,0]=3 511 B16R2.252 Fc1cccc(NCc2ccccc2)n1 Amb23606138 [0,1,0,0,0,0|3,0,0]=4 512 B16R2.252 Fc1cccc(NCc2ccccn2)c1 Amb6695901 [0,1,0,0,0,0|3,0,0]=4 513 B16R2.252 Fc1cccc(NCc2cccnc2)c1 Amb6695785 [0,1,0,0,0,0|3,0,0]=4 514 B16R2.252 Fc1cccc(NCc2ccncc2)c1 Amb6695790 [0,1,0,0,0,0|3,0,0]=4 515 B16R2.252 Fc1cccc(OCc2ccccc2)c1 Amb8392534 [0,1,0,0,0,0|1,1,0]=3 516 B16R2.252 Fc1cccc(SCc2ccccc2)n1 Amb27610813 [0,1,0,0,0,0|2,0,0]=3 517 B16R2.252 Fc1cccc(\C=C\c2ccncc2)c1 Amb9901755 [0,1,0,0,0,0|3,0,0]=4 518 B16R2.252 Fc1ccnc(CSc2ccccc2)n1 Amb29883299 [0,1,0,0,0,0|3,0,0]=4 519 B16R2.252 Fc1cncc(OCc2ccccc2)c1 Amb27825548 [0,1,0,0,0,0|2,1,0]=4 520 B16R2.252 Fc1cncc(SCc2ccccc2)n1 Amb35712142 [0,1,0,0,0,0|3,0,0]=4 521 B16R2.252 Fc1nccc(SCc2ccccc2)n1 Amb29855472 [0,1,0,0,0,0|3,0,0]=4 522 B16R2.252 Ic1cccc(NCc2ccccc2)c1 Amb7761234 [0,1,0,0,0,0|2,0,0]=3 523 B16R2.252 Ic1cccc(NCc2ccccn2)c1 Amb9208170 [0,1,0,0,0,0|3,0,0]=4 524 B16R2.252 Ic1cccc(NCc2cccnc2)c1 Amb9204454 [0,1,0,0,0,0|3,0,0]=4 525 B16R2.252 Ic1cccc(NCc2ccncc2)c1 Amb9203727 [0,1,0,0,0,0|3,0,0]=4 526 B16R2.252 Ic1cccc(OCc2cccnc2)c1 Amb27861648 [0,1,0,0,0,0|2,1,0]=4 527 B16R2.252 Ic1ccnc(OCc2ccccc2)c1 Amb22498332 [0,1,0,0,0,0|2,1,0]=4 528 B16R2.252 Ic1cncc(OCc2ccccc2)c1 Amb24329390 [0,1,0,0,0,0|2,1,0]=4 529 B16R2.252 Nc1cc(CCc2ccccc2)ccn1 Amb18652925 [0,1,0,0,0,0|3,0,0]=4 530 B16R2.252 Nc1cc(CCc2ccccc2)ccn1 Amb20622591 [0,1,0,0,0,0|3,0,0]=4 531 B16R2.252 Nc1cc(OCc2ccccc2)ccn1 Amb16233369 [0,1,0,0,0,0|2,1,0]=4 532 B16R2.252 Nc1cc(\C=C\c2ccccc2)ccn1 Amb17217398 [0,1,0,0,0,0|3,0,0]=4 533 B16R2.252 Nc1cccc(C#Cc2ccccc2)c1 Amb1106348 [0,1,0,0,0,0|2,0,0]=3 534 B16R2.252 Nc1cccc(C#Cc2ccccn2)c1 Amb1106339 [0,1,0,0,0,0|3,0,0]=4 535 B16R2.252 Nc1cccc(CCc2ccccn2)c1 Amb17762893 [0,1,0,0,0,0|3,0,0]=4 536 B16R2.252 Nc1cccc(CCc2ccncc2)c1 Amb6315608 [0,1,0,0,0,0|3,0,0]=4 537 B16R2.252 Nc1cccc(COc2ccccc2)c1 Amb2724117 [0,1,0,0,0,0|1,1,0]=3 538 B16R2.252 Nc1cccc(COc2ccccc2)c1 Amb33164191 [0,1,0,0,0,0|1,1,0]=3 539 B16R2.252 Nc1cccc(COc2cccnc2)c1 Amb21965018 [0,1,0,0,0,0|2,1,0]=4 540 B16R2.252 Nc1cccc(CSc2ccccn2)c1 Amb6676721 [0,1,0,0,0,0|2,0,0]=3 541 B16R2.252 Nc1cccc(OCc2ccccc2)c1 Amb1119757 [0,1,0,0,0,0|1,1,0]=3 542 B16R2.252 Nc1cccc(OCc2ccccc2)n1 Amb26954004 [0,1,0,0,0,0|2,1,0]=4 543 B16R2.252 Nc1cccc(OCc2ccccn2)c1 Amb1119053 [0,1,0,0,0,0|2,1,0]=4 544 B16R2.252 Nc1cccc(OCc2ccccn2)c1 Amb6893101 [0,1,0,0,0,0|2,1,0]=4 545 B16R2.252 Nc1cccc(OCc2cccnc2)c1 Amb1116746 [0,1,0,0,0,0|2,1,0]=4 546 B16R2.252 Nc1cccc(OCc2ccncc2)c1 Amb1125338 [0,1,0,0,0,0|2,1,0]=4 547 B16R2.252 Nc1cccc(\C=C\c2ccccc2)c1 Amb18137668 [0,1,0,0,0,0|2,0,0]=3 548 B16R2.252 Nc1cccc(\C=C\c2ccccn2)c1 Amb405316 [0,1,0,0,0,0|3,0,0]=4 549 B16R2.252 Nc1cccc(\C=C\c2ccncc2)c1 Amb6333517 [0,1,0,0,0,0|3,0,0]=4 550 B16R2.252 Nc1cccc(\N=N\c2ccccc2)c1 Amb17595232 [0,1,0,0,0,0|2,0,0]=3 551 B16R2.252 Nc1ccnc(NCc2ccccc2)c1 Amb17337415 [0,1,0,0,0,0|3,0,0]=4 552 B16R2.252 Nc1ccnc(OCc2ccccc2)c1 Amb18981531 [0,1,0,0,0,0|2,1,0]=4 553 B16R2.252 Nc1ccnc(SCc2ccccc2)c1 Amb18981546 [0,1,0,0,0,0|2,0,0]=3 554 B16R2.252 Nc1cncc(OCc2ccccc2)c1 Amb21857185 [0,1,0,0,0,0|2,1,0]=4 555 B16R2.252 O=C1C=C(CCc2ccccc2)C=CN1 Amb35744393 [0,1,0,0,0,0|3,0,0]=4 556 B16R2.252 O=C1C=C(NCc2ccccc2)C=CN1 Amb22276456 [0,1,0,0,0,0|3,0,0]=4 557 B16R2.252 O=C1C=C(OCc2ccccc2)C=CN1 Amb19892336 [0,1,0,0,0,0|2,1,0]=4 558 B16R2.252 O=C1C=CC=C(OCc2ccccc2)N1 Amb27222379 [0,1,0,0,0,0|2,1,0]=4 559 B16R2.252 O=C1C=CN=C(SCc2ccccc2)N1 Amb17997525 [0,1,0,0,0,0|3,0,0]=4 560 B16R2.252 Oc1cccc(CCc2ccccc2)c1 Amb8388641 [0,1,0,0,0,0|2,0,0]=3 561 B16R2.252 Oc1cccc(CNc2ccccc2)c1 Amb3546319 [0,1,0,0,0,0|2,0,0]=3 562 B16R2.252 Oc1cccc(CNc2ccccn2)c1 Amb17100057 [0,1,0,0,0,0|3,0,0]=4 563 B16R2.252 Oc1cccc(CNc2cccnc2)c1 Amb6686630 [0,1,0,0,0,0|3,0,0]=4 564 B16R2.252 Oc1cccc(COc2ccccc2)c1 Amb23443322 [0,1,0,0,0,0|1,1,0]=3 565 B16R2.252 Oc1cccc(NCc2ccccc2)c1 Amb6734931 [0,1,0,0,0,0|2,0,0]=3 566 B16R2.252 Oc1cccc(NCc2ccccc2)n1 Amb27767162 [0,1,0,0,0,0|3,0,0]=4 567 B16R2.252 Oc1cccc(OCc2ccccc2)c1 Amb33528500 [0,1,0,0,0,0|1,1,0]=3 568 B16R2.252 Oc1cccc(\C=C\c2ccccc2)c1 Amb6296671 [0,1,0,0,0,0|2,0,0]=3 569 B16R2.252 Oc1cccc(\N=N\c2ccccc2)c1 Amb21812045 [0,1,0,0,0,0|2,0,0]=3 570 B16R2.252 Oc1cncc(OCc2ccccc2)c1 Amb25903369 [0,1,0,0,0,0|2,1,0]=4 571 B16R2.252 Sc1cccc(OCc2ccccc2)c1 Amb22723410 [0,1,0,0,0,0|1,1,0]=3 572 B16R2.252 [O-][n+]1cccc(OCc2ccccc2)c1 Amb27169161 [0,1,0,0,0,0|2,1,0]=4 573 B14R1.123 O=C\C=C\C=C/C#Cc1ccccc1 Amb27797263 [0,0,1,0,0,0|3,0,0]=4 574 B14R1.123 O=C\C=C\C=C\C#Cc1ccccc1 Amb28133401 [0,0,1,0,0,0|3,0,0]=4 575 B14R1.123 O=C\C=C\C=C\NCc1ccccc1 Amb27632389 [0,0,1,0,0,0|3,0,0]=4 576 B16R3.9 c1ccc-2c(c1)CCc3ccccc32 Amb17672017 [0,0,0,1,0,0|2,0,0]=3 577 B16R3.9 c1ccc-2c(c1)CCc3ncccc32 Amb27402349 [0,0,0,1,0,0|3,0,0]=4 578 B16R3.9 c1ccc-2c(c1)CNc3ccccc32 Amb32665195 [0,0,0,1,0,0|2,0,0]=3 579 B16R3.9 c1ccc-2c(c1)CNc3ccccc32 Amb9201095 [0,0,0,1,0,0|2,0,0]=3 580 B16R3.9 c1ccc-2c(c1)NCc3cnccc32 Amb27412036 [0,0,0,1,0,0|3,0,0]=4 581 B16R3.9 c1ccc-2c(c1)SSc3ccccc32 Amb27756332 [0,0,0,1,0,0|0,0,0]=1 582 B16R3.9 c1ccc2c(c1)ccc3ccccc32 Amb6297759 [0,0,0,1,0,0|2,0,0]=3 583 B16R3.9 c1ccc2c(c1)ccc3cccnc32 Amb8513497 [0,0,0,1,0,0|3,0,0]=4 584 B16R3.9 c1ccc2c(c1)ccc3cnccc32 Amb27752422 [0,0,0,1,0,0|3,0,0]=4 585 B16R3.9 c1ccc2c(c1)ccc3ncccc32 Amb6358050 [0,0,0,1,0,0|3,0,0]=4 586 B16R3.9 c1ccc2c(c1)cnc3ccccc32 Amb2609985 [0,0,0,1,0,0|2,0,0]=3 587 B16R3.9 c1ccc2c(c1)nnc3ccccc32 Amb2746830 [0,0,0,1,0,0|2,0,0]=3 588 B16R3.9 c1cnc-2c(c1)COc3ccccc32 Amb28347446 [0,0,0,1,0,0|2,1,0]=4 589 B16R3.1783 c1ccc(C2Cc3ccccc32)cc1 Amb17778867 [0,0,0,1,0,0|2,0,0]=3 590 B16R3.1783 c1ccc(C2Cc3ccccc32)nc1 Amb17778880 [0,0,0,1,0,0|3,0,0]=4 591 B14R2.6 c1cc(Cc2ccncc2)ccn1 Amb25336509 [0,0,0,0,1,0|3,0,0]=4 592 B14R2.6 c1cc(Nc2ccncc2)ccn1 Amb2732578 [0,0,0,0,1,0|3,0,0]=4 593 B14R2.6 c1cc(Sc2ccncc2)ccn1 Amb19930179 [0,0,0,0,1,0|2,0,0]=3 594 B14R2.6 c1cc[n+](Cc2ccccn2)cc1 Amb2613484 [0,0,0,0,1,0|3,0,0]=4 595 B14R2.6 c1cc[n+](Cc2ccccn2)cc1 Amb4005979 [0,0,0,0,1,0|3,0,0]=4 596 B14R2.6 c1cc[n+]([IH2-][n+]2ccccc2)cc1 Amb8517011 [0,0,0,0,1,0|3,0,0]=4 597 B14R2.6 c1ccc(C[n+]2ccccc2)cc1 Amb4009585 [0,0,0,0,1,0|2,0,0]=3 598 B14R2.6 c1ccc(Cc2cc[nH+]cc2)cc1 Amb4027559 [0,0,0,0,1,0|2,0,0]=3 599 B14R2.6 c1ccc(Cc2ccccc2)cc1 Amb6357390 [0,0,0,0,1,0|1,0,0]=2 600 B14R2.6 c1ccc(Cc2ccccn2)cc1 Amb2610000 [0,0,0,0,1,0|2,0,0]=3 601 B14R2.6 c1ccc(Cc2cccnc2)cc1 Amb5718939 [0,0,0,0,1,0|2,0,0]=3 602 B14R2.6 c1ccc(Cc2ccncc2)cc1 Amb2609983 [0,0,0,0,1,0|2,0,0]=3 603 B14R2.6 c1ccc(Cc2cnccn2)cc1 Amb22263670 [0,0,0,0,1,0|3,0,0]=4 604 B14R2.6 c1ccc(Nc2ccccc2)cc1 Amb1215248 [0,0,0,0,1,0|1,0,0]=2 605 B14R2.6 c1ccc(Nc2ccccc2)cc1 Amb6365657 [0,0,0,0,1,0|1,0,0]=2 606 B14R2.6 c1ccc(Nc2ccccn2)cc1 Amb1151333 [0,0,0,0,1,0|2,0,0]=3 607 B14R2.6 c1ccc(Nc2ccccn2)nc1 Amb6456603 [0,0,0,0,1,0|3,0,0]=4 608 B14R2.6 c1ccc(Nc2cccnc2)nc1 Amb18932030 [0,0,0,0,1,0|3,0,0]=4 609 B14R2.6 c1ccc(Nc2ccncc2)cc1 Amb6296876 [0,0,0,0,1,0|2,0,0]=3 610 B14R2.6 c1ccc(Nc2ccncn2)cc1 Amb26899716 [0,0,0,0,1,0|3,0,0]=4 611 B14R2.6 c1ccc(Nc2cnccn2)cc1 Amb26537959 [0,0,0,0,1,0|3,0,0]=4 612 B14R2.6 c1ccc(Nc2ncccn2)cc1 Amb8630964 [0,0,0,0,1,0|3,0,0]=4 613 B14R2.6 c1ccc(Oc2ccccc2)cc1 Amb6355877 [0,0,0,0,1,0|0,1,0]=2 614 B14R2.6 c1ccc(Oc2ccccc2)cc1 Amb8516759 [0,0,0,0,1,0|0,1,0]=2 615 B14R2.6 c1ccc(Oc2ccccn2)cc1 Amb10553559 [0,0,0,0,1,0|1,1,0]=3 616 B14R2.6 c1ccc(Oc2ccccn2)nc1 Amb27945988 [0,0,0,0,1,0|2,1,0]=4 617 B14R2.6 c1ccc(Oc2cccnc2)cc1 Amb8394912 [0,0,0,0,1,0|1,1,0]=3 618 B14R2.6 c1ccc(Oc2cccnn2)cc1 Amb24441314 [0,0,0,0,1,0|2,1,0]=4 619 B14R2.6 c1ccc(Oc2ccncc2)cc1 Amb2610105 [0,0,0,0,1,0|1,1,0]=3 620 B14R2.6 c1ccc(Oc2ccnnc2)cc1 Amb23592135 [0,0,0,0,1,0|2,1,0]=4 621 B14R2.6 c1ccc(Oc2cncnc2)cc1 Amb24098659 [0,0,0,0,1,0|2,1,0]=4 622 B14R2.6 c1ccc(Oc2ncccn2)cc1 Amb10671160 [0,0,0,0,1,0|2,1,0]=4 623 B14R2.6 c1ccc(Pc2ccccc2)cc1 Amb6365840 [0,0,0,0,1,0|1,0,0]=2 624 B14R2.6 c1ccc(Pc2ccccn2)cc1 Amb27254129 [0,0,0,0,1,0|2,0,0]=3 625 B14R2.6 c1ccc(Sc2ccccc2)cc1 Amb6608801 [0,0,0,0,1,0|0,0,0]=1 626 B14R2.6 c1ccc(Sc2ccccn2)cc1 Amb2610106 [0,0,0,0,1,0|1,0,0]=2 627 B14R2.6 c1ccc(Sc2cccnc2)cc1 Amb10573261 [0,0,0,0,1,0|1,0,0]=2 628 B14R2.6 c1ccc(Sc2ncccn2)nc1 Amb3836136 [0,0,0,0,1,0|3,0,0]=4 629 B14R2.6 c1ccc([I+]c2ccccc2)cc1 Amb10601891 [0,0,0,0,1,0|1,0,0]=2 630 B14R2.6 c1ccc([I+]c2ccccc2)cc1 Amb10840230 [0,0,0,0,1,0|1,0,0]=2 631 B14R2.6 c1ccc([I+]c2ccccc2)cc1 Amb10841525 [0,0,0,0,1,0|1,0,0]=2 632 B14R2.6 c1ccc([I+]c2ccccc2)cc1 Amb22263754 [0,0,0,0,1,0|1,0,0]=2 633 B14R2.6 c1ccc([I+]c2ccccc2)cc1 Amb32620366 [0,0,0,0,1,0|1,0,0]=2 634 B14R2.6 c1ccc([I+]c2ccccc2)cc1 Amb4006513 [0,0,0,0,1,0|1,0,0]=2 635 B14R2.6 c1ccc([I+]c2ccccc2)cc1 Amb6296651 [0,0,0,0,1,0|1,0,0]=2 636 B14R2.6 c1ccc([I+]c2ccccc2)cc1 Amb6366850 [0,0,0,0,1,0|1,0,0]=2 637 B14R2.6 c1ccc([Pt]c2ccccc2)cc1 Amb22234096 [0,0,0,0,1,0|1,0,0]=2 638 B14R2.6 c1ccc([Se]c2ccccc2)cc1 Amb8515146 [0,0,0,0,1,0|0,1,0]=2 639 B14R2.6 c1ccc([SiH2]c2ccccc2)cc1 Amb8515711 [0,0,0,0,1,0|1,0,0]=2 640 B14R2.6 c1cncc(Nc2cccnc2)c1 Amb18930867 [0,0,0,0,1,0|3,0,0]=4 641 B14R2.6 c1cncc(Nc2ccncc2)c1 Amb2609706 [0,0,0,0,1,0|3,0,0]=4 642 B14R2.6 c1cnnc(Sc2ccncc2)c1 Amb27406594 [0,0,0,0,1,0|3,0,0]=4 643 B14R2.101 C(#Cc1cccs1)c2ccccc2 Amb1017421 [0,0,0,0,1,0|3,0,0]=4 644 B14R2.101 C(=C\c1ccco1)/c2ccccc2 Amb26498528 [0,0,0,0,1,0|3,0,0]=4 645 B14R2.101 C(=C\c1cccs1)/c2ccccc2 Amb1060407 [0,0,0,0,1,0|3,0,0]=4 646 B14R2.101 C(=C\c1ccsc1)/c2ccccc2 Amb2642856 [0,0,0,0,1,0|3,0,0]=4 647 B14R2.101 C(=N\c1ccccc1)/c2cccs2 Amb2425844 [0,0,0,0,1,0|3,0,0]=4 648 B14R2.101 c1ccc(CCn2cccc2)cc1 Amb1067085 [0,0,0,0,1,0|3,0,0]=4 649 B14R2.101 c1ccc(CNc2ccco2)cc1 Amb25380740 [0,0,0,0,1,0|3,0,0]=4 650 B14R2.101 c1ccc(CSc2cccs2)cc1 Amb27753630 [0,0,0,0,1,0|2,0,0]=3 651 B14R2.101 c1ccc(CSc2ccno2)cc1 Amb27412825 [0,0,0,0,1,0|3,0,0]=4 652 B14R2.101 c1ccc(CSc2ccsc2)cc1 Amb8444986 [0,0,0,0,1,0|2,0,0]=3 653 B14R2.101 c1ccc(NCc2ccco2)cc1 Amb1669289 [0,0,0,0,1,0|3,0,0]=4 654 B14R2.101 c1ccc(NCc2cccs2)cc1 Amb4399614 [0,0,0,0,1,0|3,0,0]=4 655 B14R2.101 c1ccc(NCc2ccsc2)cc1 Amb13952328 [0,0,0,0,1,0|3,0,0]=4 656 B14R2.101 c1ccc(NCc2ccsc2)cc1 Amb6685084 [0,0,0,0,1,0|3,0,0]=4 657 B14R2.101 c1ccc(OCc2ccco2)cc1 Amb1352023 [0,0,0,0,1,0|2,1,0]=4 658 B14R2.101 c1ccc(OCc2ccsc2)cc1 Amb27263375 [0,0,0,0,1,0|2,1,0]=4 659 B14R2.101 c1ccc(SCc2cccs2)cc1 Amb26436043 [0,0,0,0,1,0|2,0,0]=3 660 B14R2.101 c1ccc(SCc2ccno2)cc1 Amb27163326 [0,0,0,0,1,0|3,0,0]=4 661 B14R2.101 c1ccc(SCc2ccon2)cc1 Amb27443456 [0,0,0,0,1,0|3,0,0]=4 662 B14R2.101 c1cncc(CSc2cccs2)c1 Amb27652815 [0,0,0,0,1,0|3,0,0]=4 663 B14R2.101 c1csc(SCc2ccncc2)c1 Amb27591092 [0,0,0,0,1,0|3,0,0]=4 664 B16R2.2256 C(#Cc1ccccc1)Nc2ccccc2 Amb24081250 [0,0,0,0,0,1|2,0,0]=3 665 B16R2.2256 C(=N/c1ccccc1)/Nc2ccccc2 Amb22350571 [0,0,0,0,0,1|2,0,0]=3 666 B16R2.2256 C(=N\Cc1ccccc1)/c2ccccc2 Amb33513282 [0,0,0,0,0,1|2,0,0]=3 667 B16R2.2256 C(=N\Nc1ccccc1)/c2ccccc2 Amb5720542 [0,0,0,0,0,1|2,0,0]=3 668 B16R2.2256 C(=N\c1ccccc1)/Nc2ccccc2 Amb6298318 [0,0,0,0,0,1|2,0,0]=3 669 B16R2.2256 c1ccc(CCCc2ccccc2)cc1 Amb2721029 [0,0,0,0,0,1|2,0,0]=3 670 B16R2.2256 c1ccc(CCCc2ccccn2)cc1 Amb5718975 [0,0,0,0,0,1|3,0,0]=4 671 B16R2.2256 c1ccc(CCNc2ccccc2)cc1 Amb2693183 [0,0,0,0,0,1|2,0,0]=3 672 B16R2.2256 c1ccc(CCOc2ccccc2)cc1 Amb2720867 [0,0,0,0,0,1|1,1,0]=3 673 B16R2.2256 c1ccc(CNCc2ccccc2)cc1 Amb17743700 [0,0,0,0,0,1|2,0,0]=3 674 B16R2.2256 c1ccc(CNCc2ccccn2)cc1 Amb6356033 [0,0,0,0,0,1|3,0,0]=4 675 B16R2.2256 c1ccc(CNCc2cccnc2)cc1 Amb6356030 [0,0,0,0,0,1|3,0,0]=4 676 B16R2.2256 c1ccc(CNCc2ccncc2)cc1 Amb6356034 [0,0,0,0,0,1|3,0,0]=4 677 B16R2.2256 c1ccc(NCCc2ccccn2)cc1 Amb4020684 [0,0,0,0,0,1|3,0,0]=4 678 B16R2.2256 c1ccc(SCCc2ccncc2)cc1 Amb583020 [0,0,0,0,0,1|2,0,0]=3 679 B16R2.2256 c1ccc(SCSc2ccccc2)cc1 Amb2684782 [0,0,0,0,0,1|0,0,0]=1 680 B16R2.2256 c1ccc(\N=N\Nc2ccccc2)cc1 Amb7809237 [0,0,0,0,0,1|2,0,0]=3 681 B13R1.28 Cl\C=C\C=C\C=C\c1ccccc1 Amb28385717 [1,0,1,0,0,0|2,0,0]=4 682 B13R1.28 O=C\C=C\C=C\Nc1ccccc1 Amb27667120 [1,0,1,0,0,0|2,0,0]=4 683 B13R1.28 O\C=C\C=C\C=N\c1ccccc1 Amb27397060 [1,0,1,0,0,0|2,0,0]=4 684 B15R2.29 Brc1ccc(Cc2ccccc2)cc1 Amb2685151 [0,1,0,0,1,0|1,0,0]=3 685 B15R2.29 Brc1ccc(Cc2ccccc2)cn1 Amb26504906 [0,1,0,0,1,0|2,0,0]=4 686 B15R2.29 Brc1ccc(Cc2ccccc2)nc1 Amb25673195 [0,1,0,0,1,0|2,0,0]=4 687 B15R2.29 Brc1ccc(Cc2ccccn2)cc1 Amb25168108 [0,1,0,0,1,0|2,0,0]=4 688 B15R2.29 Brc1ccc(Nc2ccccc2)cc1 Amb8392748 [0,1,0,0,1,0|1,0,0]=3 689 B15R2.29 Brc1ccc(Nc2ccccc2)nc1 Amb20618853 [0,1,0,0,1,0|2,0,0]=4 690 B15R2.29 Brc1ccc(Nc2ccccn2)cc1 Amb24072330 [0,1,0,0,1,0|2,0,0]=4 691 B15R2.29 Brc1ccc(Nc2cccnc2)cc1 Amb26576940 [0,1,0,0,1,0|2,0,0]=4 692 B15R2.29 Brc1ccc(Oc2ccccc2)cc1 Amb3939305 [0,1,0,0,1,0|0,1,0]=3 693 B15R2.29 Brc1ccc(Oc2ccccc2)nc1 Amb10601410 [0,1,0,0,1,0|1,1,0]=4 694 B15R2.29 Brc1ccc(Oc2ccccn2)cc1 Amb33532779 [0,1,0,0,1,0|1,1,0]=4 695 B15R2.29 Brc1ccc(Oc2cccnc2)cc1 Amb25692611 [0,1,0,0,1,0|1,1,0]=4 696 B15R2.29 Brc1ccc(Oc2ccncc2)cc1 Amb6268396 [0,1,0,0,1,0|1,1,0]=4 697 B15R2.29 Brc1ccc(Sc2ccccc2)cc1 Amb4021424 [0,1,0,0,1,0|0,0,0]=2 698 B15R2.29 Brc1ccc(Sc2ccccc2)cn1 Amb27749674 [0,1,0,0,1,0|1,0,0]=3 699 B15R2.29 Brc1ccc(Sc2ccccc2)nc1 Amb24076008 [0,1,0,0,1,0|1,0,0]=3 700 B15R2.29 Brc1ccc(Sc2ccccn2)nc1 Amb28320994 [0,1,0,0,1,0|2,0,0]=4 701 B15R2.29 Brc1cnc(Sc2ccccc2)nc1 Amb28363924 [0,1,0,0,1,0|2,0,0]=4 702 B15R2.29 C[n+]1ccc(Sc2ccccc2)cc1 Amb2778892 [0,1,0,0,1,0|1,0,0]=3 703 B15R2.29 Cc1cc[n+](Cc2ccccc2)cc1 Amb2694549 [0,1,0,0,1,0|2,0,0]=4 704 B15R2.29 Cc1ccc(Nc2ccccc2)cc1 Amb2617130 [0,1,0,0,1,0|1,0,0]=3 705 B15R2.29 Cc1ccc(Nc2ccccc2)cn1 Amb27828069 [0,1,0,0,1,0|2,0,0]=4 706 B15R2.29 Cc1ccc(Nc2ccccc2)nc1 Amb10573738 [0,1,0,0,1,0|2,0,0]=4 707 B15R2.29 Cc1ccc(Nc2ccccn2)cc1 Amb24335974 [0,1,0,0,1,0|2,0,0]=4 708 B15R2.29 Cc1ccc(Nc2cccnc2)cc1 Amb27956988 [0,1,0,0,1,0|2,0,0]=4 709 B15R2.29 Cc1ccc(Nc2ccncc2)cc1 Amb26856006 [0,1,0,0,1,0|2,0,0]=4 710 B15R2.29 Cc1ccc(Oc2ccccc2)cc1 Amb17689430 [0,1,0,0,1,0|0,1,0]=3 711 B15R2.29 Cc1ccc(Sc2ccccc2)cc1 Amb4010046 [0,1,0,0,1,0|0,0,0]=2 712 B15R2.29 Cc1ccc(Sc2ccccn2)nc1 Amb25668404 [0,1,0,0,1,0|2,0,0]=4 713 B15R2.29 Clc1ccc(C[n+]2ccccc2)cc1 Amb10554478 [0,1,0,0,1,0|2,0,0]=4 714 B15R2.29 Clc1ccc(Cc2ccccc2)cc1 Amb2685895 [0,1,0,0,1,0|1,0,0]=3 715 B15R2.29 Clc1ccc(Cc2ccccc2)cn1 Amb21927408 [0,1,0,0,1,0|2,0,0]=4 716 B15R2.29 Clc1ccc(Cc2ccccn2)cc1 Amb4018998 [0,1,0,0,1,0|2,0,0]=4 717 B15R2.29 Clc1ccc(Cc2ccncc2)cc1 Amb4018997 [0,1,0,0,1,0|2,0,0]=4 718 B15R2.29 Clc1ccc(Nc2ccccc2)cc1 Amb3583470 [0,1,0,0,1,0|1,0,0]=3 719 B15R2.29 Clc1ccc(Nc2ccccn2)cc1 Amb4465817 [0,1,0,0,1,0|2,0,0]=4 720 B15R2.29 Clc1ccc(Nc2cccnc2)cc1 Amb18932003 [0,1,0,0,1,0|2,0,0]=4 721 B15R2.29 Clc1ccc(Nc2ccncc2)cc1 Amb18269087 [0,1,0,0,1,0|2,0,0]=4 722 B15R2.29 Clc1ccc(Oc2ccccc2)cc1 Amb2685893 [0,1,0,0,1,0|0,1,0]=3 723 B15R2.29 Clc1ccc(Oc2ccccc2)cn1 Amb27452497 [0,1,0,0,1,0|1,1,0]=4 724 B15R2.29 Clc1ccc(Oc2ccccc2)nc1 Amb23401093 [0,1,0,0,1,0|1,1,0]=4 725 B15R2.29 Clc1ccc(Oc2ccncc2)cc1 Amb24336261 [0,1,0,0,1,0|1,1,0]=4 726 B15R2.29 Clc1ccc(Sc2ccccc2)cc1 Amb20242737 [0,1,0,0,1,0|0,0,0]=2 727 B15R2.29 Clc1ccc(Sc2ccccc2)nn1 Amb8873146 [0,1,0,0,1,0|2,0,0]=4 728 B15R2.29 Clc1ccc([SiH2]c2ccccc2)cc1 Amb4008789 [0,1,0,0,1,0|1,0,0]=3 729 B15R2.29 Fc1ccc(Cc2ccccc2)cc1 Amb2688097 [0,1,0,0,1,0|1,0,0]=3 730 B15R2.29 Fc1ccc(Cc2ccccc2)nc1 Amb24517032 [0,1,0,0,1,0|2,0,0]=4 731 B15R2.29 Fc1ccc(Nc2ccccc2)cc1 Amb10576197 [0,1,0,0,1,0|1,0,0]=3 732 B15R2.29 Fc1ccc(Nc2ccccn2)cc1 Amb4014342 [0,1,0,0,1,0|2,0,0]=4 733 B15R2.29 Fc1ccc(Nc2ccncc2)cc1 Amb18269110 [0,1,0,0,1,0|2,0,0]=4 734 B15R2.29 Fc1ccc(Oc2ccccc2)cc1 Amb2688095 [0,1,0,0,1,0|0,1,0]=3 735 B15R2.29 Fc1ccc(Oc2ccccc2)cn1 Amb33330901 [0,1,0,0,1,0|1,1,0]=4 736 B15R2.29 Fc1ccc(Oc2cccnc2)cc1 Amb28409887 [0,1,0,0,1,0|1,1,0]=4 737 B15R2.29 Ic1ccc(Cc2ccncc2)cc1 Amb27845577 [0,1,0,0,1,0|2,0,0]=4 738 B15R2.29 Ic1ccc(Nc2ccccc2)cc1 Amb4017462 [0,1,0,0,1,0|1,0,0]=3 739 B15R2.29 Ic1ccc(Nc2ccccc2)nc1 Amb23556454 [0,1,0,0,1,0|2,0,0]=4 740 B15R2.29 Ic1ccc(Oc2ccccc2)cc1 Amb2688846 [0,1,0,0,1,0|0,1,0]=3 741 B15R2.29 Ic1ccc(Oc2ccccn2)cc1 Amb25761477 [0,1,0,0,1,0|1,1,0]=4 742 B15R2.29 Ic1ccc(Oc2ccncc2)cc1 Amb25127225 [0,1,0,0,1,0|1,1,0]=4 743 B15R2.29 Ic1ccc(Sc2ccccc2)cc1 Amb27494645 [0,1,0,0,1,0|0,0,0]=2 744 B15R2.29 N=C1C=CN(Cc2ccccc2)C=C1 Amb21950201 [0,1,0,0,1,0|2,0,0]=4 745 B15R2.29 Nc1ccc(C[n+]2ccccc2)cc1 Amb31127654 [0,1,0,0,1,0|2,0,0]=4 746 B15R2.29 Nc1ccc(Cc2ccccc2)cc1 Amb19960014 [0,1,0,0,1,0|1,0,0]=3 747 B15R2.29 Nc1ccc(Cc2ccccc2)cc1 Amb2684621 [0,1,0,0,1,0|1,0,0]=3 748 B15R2.29 Nc1ccc(Cc2ccccc2)cn1 Amb18648928 [0,1,0,0,1,0|2,0,0]=4 749 B15R2.29 Nc1ccc(Cc2ccccc2)nc1 Amb18191583 [0,1,0,0,1,0|2,0,0]=4 750 B15R2.29 Nc1ccc(Cc2ccccn2)cc1 Amb1071165 [0,1,0,0,1,0|2,0,0]=4 751 B15R2.29 Nc1ccc(Cc2ccccn2)cc1 Amb2100015 [0,1,0,0,1,0|2,0,0]=4 752 B15R2.29 Nc1ccc(Cc2ccncc2)cc1 Amb6333057 [0,1,0,0,1,0|2,0,0]=4 753 B15R2.29 Nc1ccc(Nc2ccccc2)cc1 Amb2720052 [0,1,0,0,1,0|1,0,0]=3 754 B15R2.29 Nc1ccc(Nc2ccccc2)cc1 Amb836911 [0,1,0,0,1,0|1,0,0]=3 755 B15R2.29 Nc1ccc(Nc2ccccc2)cn1 Amb32666575 [0,1,0,0,1,0|2,0,0]=4 756 B15R2.29 Nc1ccc(Nc2ccccc2)cn1 Amb7802315 [0,1,0,0,1,0|2,0,0]=4 757 B15R2.29 Nc1ccc(Nc2ccccc2)nc1 Amb1112205 [0,1,0,0,1,0|2,0,0]=4 758 B15R2.29 Nc1ccc(Nc2ccccc2)nc1 Amb24081335 [0,1,0,0,1,0|2,0,0]=4 759 B15R2.29 Nc1ccc(Nc2ccccn2)cc1 Amb32882483 [0,1,0,0,1,0|2,0,0]=4 760 B15R2.29 Nc1ccc(Nc2ccccn2)cc1 Amb6260377 [0,1,0,0,1,0|2,0,0]=4 761 B15R2.29 Nc1ccc(Nc2ccncc2)cc1 Amb32664447 [0,1,0,0,1,0|2,0,0]=4 762 B15R2.29 Nc1ccc(Nc2ccncc2)cc1 Amb32664470 [0,1,0,0,1,0|2,0,0]=4 763 B15R2.29 Nc1ccc(Nc2ccncc2)cc1 Amb33532825 [0,1,0,0,1,0|2,0,0]=4 764 B15R2.29 Nc1ccc(Oc2ccccc2)cc1 Amb1790314 [0,1,0,0,1,0|0,1,0]=3 765 B15R2.29 Nc1ccc(Oc2ccccc2)cn1 Amb6679874 [0,1,0,0,1,0|1,1,0]=4 766 B15R2.29 Nc1ccc(Oc2ccccc2)nc1 Amb1134353 [0,1,0,0,1,0|1,1,0]=4 767 B15R2.29 Nc1ccc(Oc2ccccc2)nc1 Amb33550198 [0,1,0,0,1,0|1,1,0]=4 768 B15R2.29 Nc1ccc(Oc2ccccn2)cc1 Amb33545992 [0,1,0,0,1,0|1,1,0]=4 769 B15R2.29 Nc1ccc(Oc2cccnc2)cc1 Amb1098994 [0,1,0,0,1,0|1,1,0]=4 770 B15R2.29 Nc1ccc(Oc2ccncc2)cc1 Amb3319277 [0,1,0,0,1,0|1,1,0]=4 771 B15R2.29 Nc1ccc(Sc2ccccc2)cc1 Amb6358058 [0,1,0,0,1,0|0,0,0]=2 772 B15R2.29 Nc1ccc(Sc2ccccc2)nc1 Amb1799470 [0,1,0,0,1,0|1,0,0]=3 773 B15R2.29 Nc1ccc(Sc2ccccn2)nc1 Amb2731295 [0,1,0,0,1,0|2,0,0]=4 774 B15R2.29 Nc1ccc(Sc2cccnc2)cc1 Amb27622183 [0,1,0,0,1,0|1,0,0]=3 775 B15R2.29 Nc1ccc(Sc2ccncc2)cc1 Amb7172526 [0,1,0,0,1,0|1,0,0]=3 776 B15R2.29 Nc1ccc(Sc2ccncc2)cn1 Amb27182426 [0,1,0,0,1,0|2,0,0]=4 777 B15R2.29 Nc1ccc(Sc2ccncc2)nc1 Amb27391810 [0,1,0,0,1,0|2,0,0]=4 778 B15R2.29 Nc1ccc(Sc2ccncn2)cc1 Amb18954109 [0,1,0,0,1,0|2,0,0]=4 779 B15R2.29 Nc1ccc(Sc2cncnc2)cc1 Amb19882234 [0,1,0,0,1,0|2,0,0]=4 780 B15R2.29 Nc1ccc([SH2]c2ccccc2)cc1 Amb18540788 [0,1,0,0,1,0|0,0,1]=3 781 B15R2.29 Nc1cnc(Sc2ccccc2)cn1 Amb28184589 [0,1,0,0,1,0|2,0,0]=4 782 B15R2.29 Nc1cnc(Sc2ccccc2)nc1 Amb18951554 [0,1,0,0,1,0|2,0,0]=4 783 B15R2.29 O=C1C=CC(Cc2ccccc2)=CO1 Amb27755369 [0,1,0,0,1,0|2,0,0]=4 784 B15R2.29 O=C1C=CN(Cc2ccccc2)C=C1 Amb27860209 [0,1,0,0,1,0|2,0,0]=4 785 B15R2.29 Oc1ccc(Cc2ccccc2)cc1 Amb2041131 [0,1,0,0,1,0|1,0,0]=3 786 B15R2.29 Oc1ccc(Cc2ccccc2)nc1 Amb18649107 [0,1,0,0,1,0|2,0,0]=4 787 B15R2.29 Oc1ccc(Cc2ccccn2)cc1 Amb18649106 [0,1,0,0,1,0|2,0,0]=4 788 B15R2.29 Oc1ccc(Cc2cccnc2)cc1 Amb25320180 [0,1,0,0,1,0|2,0,0]=4 789 B15R2.29 Oc1ccc(Cc2ccncc2)cc1 Amb4362720 [0,1,0,0,1,0|2,0,0]=4 790 B15R2.29 Oc1ccc(Nc2ccccc2)cc1 Amb1332212 [0,1,0,0,1,0|1,0,0]=3 791 B15R2.29 Oc1ccc(Nc2cccnc2)cc1 Amb18931861 [0,1,0,0,1,0|2,0,0]=4 792 B15R2.29 Oc1ccc(Nc2ccncc2)cc1 Amb17594816 [0,1,0,0,1,0|2,0,0]=4 793 B15R2.29 Oc1ccc(Oc2ccccc2)cc1 Amb2609982 [0,1,0,0,1,0|0,1,0]=3 794 B15R2.29 Oc1ccc(Oc2ccccc2)nc1 Amb25132881 [0,1,0,0,1,0|1,1,0]=4 795 B15R2.29 Oc1ccc(Oc2ccccn2)cc1 Amb6892137 [0,1,0,0,1,0|1,1,0]=4 796 B15R2.29 Oc1ccc(Oc2cccnc2)cc1 Amb27612561 [0,1,0,0,1,0|1,1,0]=4 797 B15R2.29 Oc1ccc(Oc2ccncc2)cc1 Amb19059040 [0,1,0,0,1,0|1,1,0]=4 798 B15R2.29 Oc1ccc(Sc2ccccc2)cc1 Amb24079606 [0,1,0,0,1,0|0,0,0]=2 799 B15R2.29 Oc1ccc(Sc2ccccn2)cc1 Amb27615714 [0,1,0,0,1,0|1,0,0]=3 800 B15R2.29 Oc1ccc(Sc2ccncc2)cc1 Amb13952130 [0,1,0,0,1,0|1,0,0]=3 801 B15R2.29 S=C1C=CN(Cc2ccccc2)C=C1 Amb27189988 [0,1,0,0,1,0|2,0,0]=4 802 B15R2.29 Sc1ccc(Cc2ccccc2)cc1 Amb27483640 [0,1,0,0,1,0|1,0,0]=3 803 B15R2.29 Sc1ccc(Oc2ccccc2)cc1 Amb2690257 [0,1,0,0,1,0|0,1,0]=3 804 B15R2.29 Sc1ccc(Oc2ccncc2)cc1 Amb27229403 [0,1,0,0,1,0|1,1,0]=4 805 B15R2.29 [O-][n+]1ccc(Oc2ccccc2)cc1 Amb22451386 [0,1,0,0,1,0|1,1,0]=4 806 B15R2.31 Brc1cc(Cc2ccccc2)ccn1 Amb28200138 [0,1,0,0,1,0|2,0,0]=4 807 B15R2.31 Brc1cc(Nc2ccccc2)ccn1 Amb28437239 [0,1,0,0,1,0|2,0,0]=4 808 B15R2.31 Brc1cc(Oc2ccccc2)ccn1 Amb23401415 [0,1,0,0,1,0|1,1,0]=4 809 B15R2.31 Brc1cc(Sc2ccccc2)ncn1 Amb27855376 [0,1,0,0,1,0|2,0,0]=4 810 B15R2.31 Brc1ccc[n+](Cc2ccccc2)c1 Amb13887014 [0,1,0,0,1,0|2,0,0]=4 811 B15R2.31 Brc1cccc(Cc2ccccc2)c1 Amb22234434 [0,1,0,0,1,0|1,0,0]=3 812 B15R2.31 Brc1cccc(Cc2ccccc2)n1 Amb26068735 [0,1,0,0,1,0|2,0,0]=4 813 B15R2.31 Brc1cccc(Nc2ccccc2)c1 Amb33548822 [0,1,0,0,1,0|1,0,0]=3 814 B15R2.31 Brc1cccc(Oc2ccccc2)c1 Amb2227541 [0,1,0,0,1,0|0,1,0]=3 815 B15R2.31 Brc1cccc(Oc2ccccn2)c1 Amb2723973 [0,1,0,0,1,0|1,1,0]=4 816 B15R2.31 Brc1cccc(Oc2ccncc2)c1 Amb6260266 [0,1,0,0,1,0|1,1,0]=4 817 B15R2.31 Brc1cccc(Sc2ccccc2)c1 Amb27267295 [0,1,0,0,1,0|0,0,0]=2 818 B15R2.31 Brc1cccc(Sc2ccccc2)n1 Amb2615416 [0,1,0,0,1,0|1,0,0]=3 819 B15R2.31 Brc1cccc(Sc2ccccn2)n1 Amb28244540 [0,1,0,0,1,0|2,0,0]=4 820 B15R2.31 Brc1cncc(Cc2ccccc2)c1 Amb25104327 [0,1,0,0,1,0|2,0,0]=4 821 B15R2.31 Brc1cncc(Nc2ccccc2)c1 Amb28323079 [0,1,0,0,1,0|2,0,0]=4 822 B15R2.31 Brc1cncc(Oc2ccccc2)c1 Amb20241431 [0,1,0,0,1,0|1,1,0]=4 823 B15R2.31 Brc1cncc(Sc2ccccc2)c1 Amb27945853 [0,1,0,0,1,0|1,0,0]=3 824 B15R2.31 Cc1cc(Nc2ccccc2)ccn1 Amb28202611 [0,1,0,0,1,0|2,0,0]=4 825 B15R2.31 Cc1ccc[n+](Cc2ccccc2)c1 Amb6337489 [0,1,0,0,1,0|2,0,0]=4 826 B15R2.31 Cc1cccc(Cc2ccccc2)c1 Amb22641538 [0,1,0,0,1,0|1,0,0]=3 827 B15R2.31 Cc1cccc(Nc2ccccc2)c1 Amb1649099 [0,1,0,0,1,0|1,0,0]=3 828 B15R2.31 Cc1cccc(Nc2ccncc2)c1 Amb27182459 [0,1,0,0,1,0|2,0,0]=4 829 B15R2.31 Cc1cccc(Oc2ccccc2)c1 Amb4037036 [0,1,0,0,1,0|0,1,0]=3 830 B15R2.31 Cc1cccc(Oc2ccccc2)n1 Amb27749712 [0,1,0,0,1,0|1,1,0]=4 831 B15R2.31 Cc1cccc(Oc2ccncc2)c1 Amb26641998 [0,1,0,0,1,0|1,1,0]=4 832 B15R2.31 Cc1cccc(Sc2ccccn2)n1 Amb25812839 [0,1,0,0,1,0|2,0,0]=4 833 B15R2.31 Cc1cccc(Sc2ccncc2)c1 Amb27977858 [0,1,0,0,1,0|1,0,0]=3 834 B15R2.31 Cc1cccc(Sc2ncccn2)c1 Amb27756466 [0,1,0,0,1,0|2,0,0]=4 835 B15R2.31 Cc1ccnc(Sc2ccccn2)c1 Amb27157063 [0,1,0,0,1,0|2,0,0]=4 836 B15R2.31 Cc1cncc(Oc2ccccc2)c1 Amb28192451 [0,1,0,0,1,0|1,1,0]=4 837 B15R2.31 Cc1nccc(Sc2ccccc2)n1 Amb2609746 [0,1,0,0,1,0|2,0,0]=4 838 B15R2.31 Clc1cc(Cc2ccccc2)ccn1 Amb27865747 [0,1,0,0,1,0|2,0,0]=4 839 B15R2.31 Clc1cc(Sc2ccccn2)ccn1 Amb28125313 [0,1,0,0,1,0|2,0,0]=4 840 B15R2.31 Clc1cccc(C[n+]2ccccc2)c1 Amb24309099 [0,1,0,0,1,0|2,0,0]=4 841 B15R2.31 Clc1cccc(Cc2ccccc2)n1 Amb2424371 [0,1,0,0,1,0|2,0,0]=4 842 B15R2.31 Clc1cccc(Nc2ccccc2)c1 Amb4065351 [0,1,0,0,1,0|1,0,0]=3 843 B15R2.31 Clc1cccc(Nc2ccccc2)n1 Amb21958898 [0,1,0,0,1,0|2,0,0]=4 844 B15R2.31 Clc1cccc(Nc2ccccn2)c1 Amb18269162 [0,1,0,0,1,0|2,0,0]=4 845 B15R2.31 Clc1cccc(Nc2ccncc2)c1 Amb18269100 [0,1,0,0,1,0|2,0,0]=4 846 B15R2.31 Clc1cccc(Oc2ccccc2)c1 Amb25181727 [0,1,0,0,1,0|0,1,0]=3 847 B15R2.31 Clc1cccc(Oc2ccccc2)n1 Amb2609998 [0,1,0,0,1,0|1,1,0]=4 848 B15R2.31 Clc1cccc(Sc2ccccc2)c1 Amb10555878 [0,1,0,0,1,0|0,0,0]=2 849 B15R2.31 Clc1cccc(Sc2ccccc2)n1 Amb27469285 [0,1,0,0,1,0|1,0,0]=3 850 B15R2.31 Clc1cccc(Sc2ccccn2)n1 Amb25164373 [0,1,0,0,1,0|2,0,0]=4 851 B15R2.31 Clc1ccnc(Oc2ccccc2)c1 Amb25906113 [0,1,0,0,1,0|1,1,0]=4 852 B15R2.31 Clc1ccnc(Sc2ccccn2)c1 Amb25125962 [0,1,0,0,1,0|2,0,0]=4 853 B15R2.31 Clc1cncc(Oc2ccccc2)c1 Amb27589761 [0,1,0,0,1,0|1,1,0]=4 854 B15R2.31 Clc1nccc(Sc2ccccc2)n1 Amb21864566 [0,1,0,0,1,0|2,0,0]=4 855 B15R2.31 Fc1cccc(Cc2ccccc2)c1 Amb26444152 [0,1,0,0,1,0|1,0,0]=3 856 B15R2.31 Fc1cccc(Cc2cccnc2)c1 Amb28409962 [0,1,0,0,1,0|2,0,0]=4 857 B15R2.31 Fc1cccc(Nc2ccccc2)c1 Amb10839326 [0,1,0,0,1,0|1,0,0]=3 858 B15R2.31 Fc1cccc(Nc2ccccn2)c1 Amb18269167 [0,1,0,0,1,0|2,0,0]=4 859 B15R2.31 Fc1cccc(Nc2cccnc2)c1 Amb18269150 [0,1,0,0,1,0|2,0,0]=4 860 B15R2.31 Fc1cccc(Nc2ccncc2)c1 Amb18931987 [0,1,0,0,1,0|2,0,0]=4 861 B15R2.31 Fc1cccc(Oc2ccccc2)c1 Amb21856676 [0,1,0,0,1,0|0,1,0]=3 862 B15R2.31 Fc1cccc(Sc2ccccc2)c1 Amb27181992 [0,1,0,0,1,0|0,0,0]=2 863 B15R2.31 Fc1cccc(Sc2ccccc2)n1 Amb27593045 [0,1,0,0,1,0|1,0,0]=3 864 B15R2.31 Fc1cncc(Sc2ccccc2)n1 Amb35712117 [0,1,0,0,1,0|2,0,0]=4 865 B15R2.31 Fc1nccc(Sc2ccccc2)n1 Amb29855446 [0,1,0,0,1,0|2,0,0]=4 866 B15R2.31 Ic1cccc(Cc2ccccc2)c1 Amb35751028 [0,1,0,0,1,0|1,0,0]=3 867 B15R2.31 Ic1cccc(Oc2ccccc2)c1 Amb28139096 [0,1,0,0,1,0|0,1,0]=3 868 B15R2.31 Ic1cccc(Oc2ccncc2)c1 Amb19373107 [0,1,0,0,1,0|1,1,0]=4 869 B15R2.31 Ic1ccnc(Oc2ccccc2)c1 Amb27167707 [0,1,0,0,1,0|1,1,0]=4 870 B15R2.31 Nc1cc(Cc2ccccc2)ccn1 Amb18191588 [0,1,0,0,1,0|2,0,0]=4 871 B15R2.31 Nc1cc(Nc2ccccc2)ccn1 Amb1052798 [0,1,0,0,1,0|2,0,0]=4 872 B15R2.31 Nc1cc(Nc2ccccc2)ccn1 Amb19960007 [0,1,0,0,1,0|2,0,0]=4 873 B15R2.31 Nc1cc(Sc2ccccc2)ccn1 Amb18130865 [0,1,0,0,1,0|1,0,0]=3 874 B15R2.31 Nc1cccc(C[n+]2ccccc2)c1 Amb31127659 [0,1,0,0,1,0|2,0,0]=4 875 B15R2.31 Nc1cccc(Cc2ccccc2)c1 Amb2684620 [0,1,0,0,1,0|1,0,0]=3 876 B15R2.31 Nc1cccc(Cc2ccccc2)c1 Amb33999408 [0,1,0,0,1,0|1,0,0]=3 877 B15R2.31 Nc1cccc(Cc2ccccc2)n1 Amb8630259 [0,1,0,0,1,0|2,0,0]=4 878 B15R2.31 Nc1cccc(Nc2ccccc2)c1 Amb1033077 [0,1,0,0,1,0|1,0,0]=3 879 B15R2.31 Nc1cccc(Nc2ccccc2)c1 Amb19478 [0,1,0,0,1,0|1,0,0]=3 880 B15R2.31 Nc1cccc(Nc2ccccc2)n1 Amb26856622 [0,1,0,0,1,0|2,0,0]=4 881 B15R2.31 Nc1cccc(Nc2ccccn2)c1 Amb6263319 [0,1,0,0,1,0|2,0,0]=4 882 B15R2.31 Nc1cccc(Nc2cccnc2)c1 Amb25053851 [0,1,0,0,1,0|2,0,0]=4 883 B15R2.31 Nc1cccc(Nc2ccncc2)c1 Amb10609511 [0,1,0,0,1,0|2,0,0]=4 884 B15R2.31 Nc1cccc(Nc2ccncc2)c1 Amb6264530 [0,1,0,0,1,0|2,0,0]=4 885 B15R2.31 Nc1cccc(Oc2ccccc2)c1 Amb3940158 [0,1,0,0,1,0|0,1,0]=3 886 B15R2.31 Nc1cccc(Oc2ccccc2)n1 Amb27407139 [0,1,0,0,1,0|1,1,0]=4 887 B15R2.31 Nc1cccc(Oc2ccccn2)c1 Amb2723974 [0,1,0,0,1,0|1,1,0]=4 888 B15R2.31 Nc1cccc(Oc2cccnc2)c1 Amb23597483 [0,1,0,0,1,0|1,1,0]=4 889 B15R2.31 Nc1cccc(Oc2ccncc2)c1 Amb3963693 [0,1,0,0,1,0|1,1,0]=4 890 B15R2.31 Nc1cccc(Pc2ccccc2)c1 Amb28190640 [0,1,0,0,1,0|1,0,0]=3 891 B15R2.31 Nc1cccc(Sc2ccccc2)c1 Amb13953200 [0,1,0,0,1,0|0,0,0]=2 892 B15R2.31 Nc1cccc(Sc2ccccc2)c1 Amb32667321 [0,1,0,0,1,0|0,0,0]=2 893 B15R2.31 Nc1cccc(Sc2ccccc2)n1 Amb18654051 [0,1,0,0,1,0|1,0,0]=3 894 B15R2.31 Nc1cccc(Sc2cccnn2)c1 Amb28396757 [0,1,0,0,1,0|2,0,0]=4 895 B15R2.31 Nc1cccc(Sc2ccncc2)c1 Amb27419606 [0,1,0,0,1,0|1,0,0]=3 896 B15R2.31 Nc1cccc(Sc2cnccn2)c1 Amb27753815 [0,1,0,0,1,0|2,0,0]=4 897 B15R2.31 Nc1cccc(Sc2cncnc2)c1 Amb19882236 [0,1,0,0,1,0|2,0,0]=4 898 B15R2.31 Nc1cccc(Sc2ncccn2)c1 Amb18950174 [0,1,0,0,1,0|2,0,0]=4 899 B15R2.31 Nc1ccnc(Nc2ccccc2)c1 Amb17335751 [0,1,0,0,1,0|2,0,0]=4 900 B15R2.31 Nc1ccnc(Oc2ccccc2)c1 Amb18956422 [0,1,0,0,1,0|1,1,0]=4 901 B15R2.31 Nc1ccnc(Sc2ccccc2)c1 Amb4057223 [0,1,0,0,1,0|1,0,0]=3 902 B15R2.31 Nc1ccnc(Sc2ccccc2)n1 Amb27263492 [0,1,0,0,1,0|2,0,0]=4 903 B15R2.31 Nc1ccnc(Sc2ccccn2)c1 Amb13952207 [0,1,0,0,1,0|2,0,0]=4 904 B15R2.31 Nc1cncc(Cc2ccccc2)c1 Amb18191581 [0,1,0,0,1,0|2,0,0]=4 905 B15R2.31 Nc1cncc(Oc2ccccc2)c1 Amb27425484 [0,1,0,0,1,0|1,1,0]=4 906 B15R2.31 Nc1nccc(Sc2ccccc2)n1 Amb21984147 [0,1,0,0,1,0|2,0,0]=4 907 B15R2.31 O=C1C=C(Cc2ccccc2)C=CN1 Amb26560310 [0,1,0,0,1,0|2,0,0]=4 908 B15R2.31 O=C1C=C(Nc2ccccc2)C=CN1 Amb20417741 [0,1,0,0,1,0|2,0,0]=4 909 B15R2.31 O=C1C=CC=C(Nc2ccccc2)N1 Amb28364951 [0,1,0,0,1,0|2,0,0]=4 910 B15R2.31 O=C1C=CN=C(Sc2ccccc2)N1 Amb28053928 [0,1,0,0,1,0|2,0,0]=4 911 B15R2.31 Oc1ccc[n+](Cc2ccccc2)c1 Amb9809789 [0,1,0,0,1,0|2,0,0]=4 912 B15R2.31 Oc1cccc(Cc2ccccc2)c1 Amb10602238 [0,1,0,0,1,0|1,0,0]=3 913 B15R2.31 Oc1cccc(Cc2ccccc2)n1 Amb4450119 [0,1,0,0,1,0|2,0,0]=4 914 B15R2.31 Oc1cccc(Nc2ccccc2)c1 Amb3940309 [0,1,0,0,1,0|1,0,0]=3 915 B15R2.31 Oc1cccc(Nc2ccccn2)c1 Amb18931893 [0,1,0,0,1,0|2,0,0]=4 916 B15R2.31 Oc1cccc(Nc2cccnc2)c1 Amb18268941 [0,1,0,0,1,0|2,0,0]=4 917 B15R2.31 Oc1cccc(Nc2ccncc2)c1 Amb18931901 [0,1,0,0,1,0|2,0,0]=4 918 B15R2.31 Oc1cccc(Oc2ccccc2)c1 Amb1154174 [0,1,0,0,1,0|0,1,0]=3 919 B15R2.31 Oc1cccc(Oc2ccccn2)c1 Amb6892167 [0,1,0,0,1,0|1,1,0]=4 920 B15R2.31 Oc1cccc(Oc2cccnc2)c1 Amb25782172 [0,1,0,0,1,0|1,1,0]=4 921 B15R2.31 Oc1cccc(Oc2ccncc2)c1 Amb18323830 [0,1,0,0,1,0|1,1,0]=4 922 B15R2.31 Oc1cccc(Sc2ccccc2)c1 Amb26554645 [0,1,0,0,1,0|0,0,0]=2 923 B15R2.31 Oc1cccc(Sc2ccccn2)c1 Amb27198433 [0,1,0,0,1,0|1,0,0]=3 924 B15R2.31 Oc1cccc(Sc2ccccn2)n1 Amb28364428 [0,1,0,0,1,0|2,0,0]=4 925 B15R2.31 Oc1cccc(Sc2cnccn2)c1 Amb27399222 [0,1,0,0,1,0|2,0,0]=4 926 B15R2.31 Oc1cncc(Cc2ccccc2)c1 Amb4466318 [0,1,0,0,1,0|2,0,0]=4 927 B15R2.31 Sc1cccc(Oc2ccccc2)c1 Amb25970587 [0,1,0,0,1,0|0,1,0]=3 928 B15R2.31 [O-][n+]1cccc(Oc2ccccc2)c1 Amb27241213 [0,1,0,0,1,0|1,1,0]=4 929 B15R2.38 Brc1ccccc1Cc2ccccc2 Amb2685150 [0,1,0,0,1,0|1,0,0]=3 930 B15R2.38 Brc1ccccc1Nc2ccccc2 Amb24104087 [0,1,0,0,1,0|1,0,0]=3 931 B15R2.38 Brc1ccccc1Oc2ccccc2 Amb1818840 [0,1,0,0,1,0|0,1,0]=3 932 B15R2.38 Brc1ccccc1Oc2ccccn2 Amb6260671 [0,1,0,0,1,0|1,1,0]=4 933 B15R2.38 Brc1ccccc1Oc2ccncc2 Amb33532813 [0,1,0,0,1,0|1,1,0]=4 934 B15R2.38 Brc1ccccc1Sc2ccccc2 Amb25047292 [0,1,0,0,1,0|0,0,0]=2 935 B15R2.38 Brc1cccnc1Nc2ccccc2 Amb22058944 [0,1,0,0,1,0|2,0,0]=4 936 B15R2.38 Brc1cccnc1Oc2ccccc2 Amb23401091 [0,1,0,0,1,0|1,1,0]=4 937 B15R2.38 Brc1cccnc1Sc2ccccn2 Amb2612052 [0,1,0,0,1,0|2,0,0]=4 938 B15R2.38 Brc1ncccc1Sc2ccccc2 Amb28191217 [0,1,0,0,1,0|1,0,0]=3 939 B15R2.38 C=C1C=CC=CC1Nc2ccccc2 Amb27875096 [0,1,0,0,1,0|1,0,1]=4 940 B15R2.38 CN1C=CC=C\C1=N/c2ccccc2 Amb25324339 [0,1,0,0,1,0|2,0,0]=4 941 B15R2.38 C[n+]1ccccc1Cc2ccccc2 Amb4014180 [0,1,0,0,1,0|2,0,0]=4 942 B15R2.38 Cc1cccc[n+]1Cc2ccccc2 Amb1147302 [0,1,0,0,1,0|2,0,0]=4 943 B15R2.38 Cc1ccccc1Nc2ccccc2 Amb22228899 [0,1,0,0,1,0|1,0,0]=3 944 B15R2.38 Cc1ccccc1Nc2ccccn2 Amb24444380 [0,1,0,0,1,0|2,0,0]=4 945 B15R2.38 Cc1ccccc1Nc2cccnc2 Amb26658596 [0,1,0,0,1,0|2,0,0]=4 946 B15R2.38 Cc1ccccc1Sc2ncccn2 Amb27391486 [0,1,0,0,1,0|2,0,0]=4 947 B15R2.38 Cc1ccccc1[SiH2]c2ccccc2 Amb22366579 [0,1,0,0,1,0|1,0,0]=3 948 B15R2.38 Cc1cccnc1Nc2ccccc2 Amb10573517 [0,1,0,0,1,0|2,0,0]=4 949 B15R2.38 Cc1cccnc1Sc2ccccc2 Amb25369510 [0,1,0,0,1,0|1,0,0]=3 950 B15R2.38 Cc1cccnc1Sc2ccccn2 Amb24642639 [0,1,0,0,1,0|2,0,0]=4 951 B15R2.38 Cc1ccncc1Sc2ccccc2 Amb27986257 [0,1,0,0,1,0|1,0,0]=3 952 B15R2.38 Cc1ncccc1Cc2ccccc2 Amb27749713 [0,1,0,0,1,0|2,0,0]=4 953 B15R2.38 Clc1ccccc1Nc2ccccc2 Amb8392089 [0,1,0,0,1,0|1,0,0]=3 954 B15R2.38 Clc1ccccc1Nc2ccccn2 Amb18269170 [0,1,0,0,1,0|2,0,0]=4 955 B15R2.38 Clc1ccccc1Nc2cccnc2 Amb18269089 [0,1,0,0,1,0|2,0,0]=4 956 B15R2.38 Clc1ccccc1Nc2ccncc2 Amb18269103 [0,1,0,0,1,0|2,0,0]=4 957 B15R2.38 Clc1ccccc1Oc2ccccc2 Amb15692539 [0,1,0,0,1,0|0,1,0]=3 958 B15R2.38 Clc1ccccc1Sc2ccccc2 Amb22451340 [0,1,0,0,1,0|0,0,0]=2 959 B15R2.38 Clc1cccnc1Nc2ccccc2 Amb27592965 [0,1,0,0,1,0|2,0,0]=4 960 B15R2.38 Clc1cccnc1Oc2ccccc2 Amb23401094 [0,1,0,0,1,0|1,1,0]=4 961 B15R2.38 Clc1cccnc1Sc2ccccn2 Amb24309114 [0,1,0,0,1,0|2,0,0]=4 962 B15R2.38 Clc1ccncc1Oc2ccccc2 Amb23412253 [0,1,0,0,1,0|1,1,0]=4 963 B15R2.38 Clc1cnccc1Sc2ccccc2 Amb27655013 [0,1,0,0,1,0|1,0,0]=3 964 B15R2.38 Clc1ncccc1Nc2ccccc2 Amb22750111 [0,1,0,0,1,0|2,0,0]=4 965 B15R2.38 Clc1nccnc1Sc2ccccc2 Amb19747261 [0,1,0,0,1,0|2,0,0]=4 966 B15R2.38 Fc1ccccc1Cc2ccccc2 Amb2688096 [0,1,0,0,1,0|1,0,0]=3 967 B15R2.38 Fc1ccccc1Nc2ccccc2 Amb33544278 [0,1,0,0,1,0|1,0,0]=3 968 B15R2.38 Fc1ccccc1Nc2ccccn2 Amb18932029 [0,1,0,0,1,0|2,0,0]=4 969 B15R2.38 Fc1ccccc1Nc2cccnc2 Amb18269151 [0,1,0,0,1,0|2,0,0]=4 970 B15R2.38 Fc1ccccc1Nc2ccncc2 Amb18269108 [0,1,0,0,1,0|2,0,0]=4 971 B15R2.38 Fc1ccccc1Sc2ccccc2 Amb27951645 [0,1,0,0,1,0|0,0,0]=2 972 B15R2.38 Fc1ncccc1Cc2ccccc2 Amb28369922 [0,1,0,0,1,0|2,0,0]=4 973 B15R2.38 Fc1nccnc1Sc2ccccc2 Amb29850571 [0,1,0,0,1,0|2,0,0]=4 974 B15R2.38 Ic1ccccc1Oc2ccccc2 Amb8392772 [0,1,0,0,1,0|0,1,0]=3 975 B15R2.38 Ic1cccnc1Oc2ccccc2 Amb23401092 [0,1,0,0,1,0|1,1,0]=4 976 B15R2.38 Ic1cncnc1Sc2ccccc2 Amb27747774 [0,1,0,0,1,0|2,0,0]=4 977 B15R2.38 N=C1C=CC=CN1Cc2ccccc2 Amb19372454 [0,1,0,0,1,0|2,0,0]=4 978 B15R2.38 Nc1ccccc1Cc2ccccc2 Amb1233198 [0,1,0,0,1,0|1,0,0]=3 979 B15R2.38 Nc1ccccc1Cc2ccccn2 Amb18648930 [0,1,0,0,1,0|2,0,0]=4 980 B15R2.38 Nc1ccccc1Cc2cccnc2 Amb18648933 [0,1,0,0,1,0|2,0,0]=4 981 B15R2.38 Nc1ccccc1Cc2cccnc2 Amb32916287 [0,1,0,0,1,0|2,0,0]=4 982 B15R2.38 Nc1ccccc1Cc2ccncc2 Amb18648931 [0,1,0,0,1,0|2,0,0]=4 983 B15R2.38 Nc1ccccc1Nc2ccccc2 Amb6334845 [0,1,0,0,1,0|1,0,0]=3 984 B15R2.38 Nc1ccccc1Nc2ccccc2 Amb6876351 [0,1,0,0,1,0|1,0,0]=3 985 B15R2.38 Nc1ccccc1Nc2ccccn2 Amb2556136 [0,1,0,0,1,0|2,0,0]=4 986 B15R2.38 Nc1ccccc1Nc2cccnc2 Amb25710815 [0,1,0,0,1,0|2,0,0]=4 987 B15R2.38 Nc1ccccc1Nc2ccncc2 Amb17607878 [0,1,0,0,1,0|2,0,0]=4 988 B15R2.38 Nc1ccccc1Oc2ccccc2 Amb1201281 [0,1,0,0,1,0|0,1,0]=3 989 B15R2.38 Nc1ccccc1Oc2ccccn2 Amb33529466 [0,1,0,0,1,0|1,1,0]=4 990 B15R2.38 Nc1ccccc1Oc2cccnc2 Amb2783831 [0,1,0,0,1,0|1,1,0]=4 991 B15R2.38 Nc1ccccc1Oc2ccncc2 Amb8867023 [0,1,0,0,1,0|1,1,0]=4 992 B15R2.38 Nc1ccccc1Sc2ccccc2 Amb5722135 [0,1,0,0,1,0|0,0,0]=2 993 B15R2.38 Nc1ccccc1Sc2cccnc2 Amb27169483 [0,1,0,0,1,0|1,0,0]=3 994 B15R2.38 Nc1ccccc1Sc2ccncn2 Amb18282781 [0,1,0,0,1,0|2,0,0]=4 995 B15R2.38 Nc1ccccc1Sc2cnccn2 Amb2446191 [0,1,0,0,1,0|2,0,0]=4 996 B15R2.38 Nc1ccccc1Sc2cncnc2 Amb19882238 [0,1,0,0,1,0|2,0,0]=4 997 B15R2.38 Nc1ccccc1Sc2ncccn2 Amb6680270 [0,1,0,0,1,0|2,0,0]=4 998 B15R2.38 Nc1ccccc1Sc2ncccn2 Amb6760556 [0,1,0,0,1,0|2,0,0]=4 999 B15R2.38 Nc1ccccc1[SH2]c2ccccc2 Amb18540789 [0,1,0,0,1,0|0,0,1]=3 1000 B15R2.38 Nc1cccnc1Nc2ccccc2 Amb17772571 [0,1,0,0,1,0|2,0,0]=4 1001 B15R2.38 Nc1cccnc1Oc2ccccc2 Amb1136542 [0,1,0,0,1,0|1,1,0]=4 1002 B15R2.38 Nc1cccnc1Sc2ccccc2 Amb2611968 [0,1,0,0,1,0|1,0,0]=3 1003 B15R2.38 Nc1cccnc1Sc2ccncc2 Amb18954096 [0,1,0,0,1,0|2,0,0]=4 1004 B15R2.38 Nc1ccncc1Cc2ccccc2 Amb25671149 [0,1,0,0,1,0|2,0,0]=4 1005 B15R2.38 Nc1ccncc1Nc2ccccc2 Amb17933171 [0,1,0,0,1,0|2,0,0]=4 1006 B15R2.38 Nc1ccncc1Oc2ccccc2 Amb22886506 [0,1,0,0,1,0|1,1,0]=4 1007 B15R2.38 Nc1ccncc1Sc2ccncc2 Amb27968559 [0,1,0,0,1,0|2,0,0]=4 1008 B15R2.38 Nc1cnccc1Cc2ccccc2 Amb18191590 [0,1,0,0,1,0|2,0,0]=4 1009 B15R2.38 Nc1cnccc1Nc2ccccc2 Amb33532065 [0,1,0,0,1,0|2,0,0]=4 1010 B15R2.38 Nc1cnccc1Oc2ccccc2 Amb33528864 [0,1,0,0,1,0|1,1,0]=4 1011 B15R2.38 Nc1cnccc1Sc2ccccc2 Amb2611962 [0,1,0,0,1,0|1,0,0]=3 1012 B15R2.38 Nc1cnccc1Sc2ccncc2 Amb18958985 [0,1,0,0,1,0|2,0,0]=4 1013 B15R2.38 Nc1ncccc1Nc2ccccc2 Amb26576731 [0,1,0,0,1,0|2,0,0]=4 1014 B15R2.38 Nc1ncccc1Oc2ccccc2 Amb22886505 [0,1,0,0,1,0|1,1,0]=4 1015 B15R2.38 Nc1ncccc1Sc2ccccc2 Amb18654050 [0,1,0,0,1,0|1,0,0]=3 1016 B15R2.38 O=C1C=CC=CN1Cc2ccccc2 Amb21862599 [0,1,0,0,1,0|2,0,0]=4 1017 B15R2.38 Oc1ccccc1Cc2ccccc2 Amb3939545 [0,1,0,0,1,0|1,0,0]=3 1018 B15R2.38 Oc1ccccc1Cc2ccncc2 Amb28347528 [0,1,0,0,1,0|2,0,0]=4 1019 B15R2.38 Oc1ccccc1Nc2ccncc2 Amb18931935 [0,1,0,0,1,0|2,0,0]=4 1020 B15R2.38 Oc1ccccc1Oc2ccccc2 Amb2416831 [0,1,0,0,1,0|0,1,0]=3 1021 B15R2.38 Oc1ccccc1Oc2ccccn2 Amb13951927 [0,1,0,0,1,0|1,1,0]=4 1022 B15R2.38 Oc1ccccc1Oc2cccnc2 Amb26425548 [0,1,0,0,1,0|1,1,0]=4 1023 B15R2.38 Oc1ccccc1Oc2ccncc2 Amb19059041 [0,1,0,0,1,0|1,1,0]=4 1024 B15R2.38 Oc1ccccc1Sc2ccccc2 Amb17595381 [0,1,0,0,1,0|0,0,0]=2 1025 B15R2.38 Oc1ccccc1Sc2ncccn2 Amb27404392 [0,1,0,0,1,0|2,0,0]=4 1026 B15R2.38 S=C1C=CC=CN1Cc2ccccc2 Amb27441713 [0,1,0,0,1,0|2,0,0]=4 1027 B15R2.38 Sc1ccccc1Nc2ccccn2 Amb25797409 [0,1,0,0,1,0|2,0,0]=4 1028 B15R2.38 Sc1ccccc1Oc2ccccc2 Amb4012136 [0,1,0,0,1,0|0,1,0]=3 1029 B15R2.2226 BrC(c1ccccc1)c2ccccc2 Amb3939706 [0,1,0,0,1,0|1,0,0]=3 1030 B15R2.2226 BrC(c1ccccc1)c2ccccn2 Amb8835438 [0,1,0,0,1,0|2,0,0]=4 1031 B15R2.2226 BrP(c1ccccc1)c2ccccc2 Amb27597653 [0,1,0,0,1,0|1,0,0]=3 1032 B15R2.2226 C=C(c1ccccc1)[n+]2ccccc2 Amb2613473 [0,1,0,0,1,0|2,0,0]=4 1033 B15R2.2226 C=C(c1ccccc1)c2ccccc2 Amb2583298 [0,1,0,0,1,0|1,0,0]=3 1034 B15R2.2226 C=S(c1ccccc1)c2ccccc2 Amb25858897 [0,1,0,0,1,0|0,0,1]=3 1035 B15R2.2226 CC(c1ccccc1)c2cccnc2 Amb27946077 [0,1,0,0,1,0|2,0,0]=4 1036 B15R2.2226 CC(c1ccccc1)c2ccncc2 Amb27189791 [0,1,0,0,1,0|2,0,0]=4 1037 B15R2.2226 CN(c1ccccc1)c2ccccc2 Amb2227586 [0,1,0,0,1,0|1,0,0]=3 1038 B15R2.2226 CN(c1ccccc1)c2ccncc2 Amb18452400 [0,1,0,0,1,0|2,0,0]=4 1039 B15R2.2226 CP(c1ccccc1)c2ccccc2 Amb6365621 [0,1,0,0,1,0|1,0,0]=3 1040 B15R2.2226 C[S+](c1ccccc1)c2ccccc2 Amb6365953 [0,1,0,0,1,0|0,0,1]=3 1041 B15R2.2226 ClB(c1ccccc1)c2ccccc2 Amb27788360 [0,1,0,0,1,0|1,0,0]=3 1042 B15R2.2226 ClC(c1ccccc1)c2ccccc2 Amb2793025 [0,1,0,0,1,0|1,0,0]=3 1043 B15R2.2226 ClC(c1ccccc1)c2ccncc2 Amb9280624 [0,1,0,0,1,0|2,0,0]=4 1044 B15R2.2226 ClP(c1ccccc1)c2ccccc2 Amb6365767 [0,1,0,0,1,0|1,0,0]=3 1045 B15R2.2226 N=C(c1ccccc1)c2ccccc2 Amb22002426 [0,1,0,0,1,0|1,0,0]=3 1046 B15R2.2226 N=C(c1ccccc1)c2ccccc2 Amb6356324 [0,1,0,0,1,0|1,0,0]=3 1047 B15R2.2226 N=S(c1ccccc1)c2ccccc2 Amb3993376 [0,1,0,0,1,0|0,0,1]=3 1048 B15R2.2226 NC(c1ccccc1)c2ccccc2 Amb1195834 [0,1,0,0,1,0|1,0,0]=3 1049 B15R2.2226 NC(c1ccccc1)c2ccccc2 Amb534956 [0,1,0,0,1,0|1,0,0]=3 1050 B15R2.2226 NC(c1ccccc1)c2ccccn2 Amb2778511 [0,1,0,0,1,0|2,0,0]=4 1051 B15R2.2226 NC(c1ccccc1)c2ccccn2 Amb30449 [0,1,0,0,1,0|2,0,0]=4 1052 B15R2.2226 NC(c1ccccc1)c2ccccn2 Amb9703490 [0,1,0,0,1,0|2,0,0]=4 1053 B15R2.2226 NC(c1ccccc1)c2cccnc2 Amb9747746 [0,1,0,0,1,0|2,0,0]=4 1054 B15R2.2226 NC(c1ccccc1)c2ccncc2 Amb1107507 [0,1,0,0,1,0|2,0,0]=4 1055 B15R2.2226 NC(c1ccccc1)c2ccncc2 Amb6891902 [0,1,0,0,1,0|2,0,0]=4 1056 B15R2.2226 NN(c1ccccc1)c2ccccc2 Amb1154151 [0,1,0,0,1,0|1,0,0]=3 1057 B15R2.2226 NN(c1ccccc1)c2ccccc2 Amb534135 [0,1,0,0,1,0|1,0,0]=3 1058 B15R2.2226 N[C@H](c1ccccc1)c2cccnc2 Amb27265967 [0,1,0,0,1,0|2,0,0]=4 1059 B15R2.2226 N[NH+](c1ccccc1)c2ccccc2 Amb22269901 [0,1,0,0,1,0|1,0,0]=3 1060 B15R2.2226 O=C(c1ccccc1)c2ccccc2 Amb2793048 [0,1,0,0,1,0|1,0,0]=3 1061 B15R2.2226 O=C(c1ccccc1)c2ccccn2 Amb534526 [0,1,0,0,1,0|2,0,0]=4 1062 B15R2.2226 O=C(c1ccccc1)c2cccnc2 Amb1694828 [0,1,0,0,1,0|2,0,0]=4 1063 B15R2.2226 O=C(c1ccccc1)c2ccncc2 Amb1776544 [0,1,0,0,1,0|2,0,0]=4 1064 B15R2.2226 O=C(c1ccccc1)c2ccncc2 Amb22001635 [0,1,0,0,1,0|2,0,0]=4 1065 B15R2.2226 O=S(c1ccccc1)c2ccccc2 Amb2618723 [0,1,0,0,1,0|0,0,1]=3 1066 B15R2.2226 O=S(c1ccccc1)c2ccncc2 Amb28071606 [0,1,0,0,1,0|1,0,1]=4 1067 B15R2.2226 O=[P+](c1ccccc1)c2ccccc2 Amb15692810 [0,1,0,0,1,0|1,0,0]=3 1068 B15R2.2226 O=[PH](c1ccccc1)c2ccccc2 Amb2712941 [0,1,0,0,1,0|1,0,0]=3 1069 B15R2.2226 O=[Se](c1ccccc1)c2ccccc2 Amb2386871 [0,1,0,0,1,0|0,1,0]=3 1070 B15R2.2226 O=[Si](c1ccccc1)c2ccccc2 Amb28131409 [0,1,0,0,1,0|1,0,0]=3 1071 B15R2.2226 O=[Te](c1ccccc1)c2ccccc2 Amb2386875 [0,1,0,0,1,0|0,1,0]=3 1072 B15R2.2226 OC(c1ccccc1)c2ccccc2 Amb4605834 [0,1,0,0,1,0|1,0,0]=3 1073 B15R2.2226 OC(c1ccccc1)c2ccccn2 Amb1110809 [0,1,0,0,1,0|2,0,0]=4 1074 B15R2.2226 OC(c1ccccc1)c2cccnc2 Amb18538517 [0,1,0,0,1,0|2,0,0]=4 1075 B15R2.2226 OC(c1ccccc1)c2ccncc2 Amb9704440 [0,1,0,0,1,0|2,0,0]=4 1076 B15R2.2226 O[C@@H](c1ccccc1)c2ccccn2 Amb28321359 [0,1,0,0,1,0|2,0,0]=4 1077 B15R2.2226 O[C@@H](c1ccccc1)c2ccncc2 Amb28370062 [0,1,0,0,1,0|2,0,0]=4 1078 B15R2.2226 O[C@H](c1ccccc1)c2ccncc2 Amb28344673 [0,1,0,0,1,0|2,0,0]=4 1079 B15R2.2226 S=C(c1ccccc1)c2ccccc2 Amb17672303 [0,1,0,0,1,0|1,0,0]=3 1080 B15R2.2226 SC(c1ccccc1)c2ccccc2 Amb6660004 [0,1,0,0,1,0|1,0,0]=3 1081 B15R2.2226 SC(c1ccccc1)c2ccccn2 Amb7784762 [0,1,0,0,1,0|2,0,0]=4 1082 B15R2.2226 SC(c1ccccc1)c2ccncc2 Amb9472134 [0,1,0,0,1,0|2,0,0]=4 1083 B15R2.2226 [NH3+]C(c1ccccc1)c2ccccc2 Amb6365963 [0,1,0,0,1,0|1,0,0]=3 1084 B15R2.2226 [O-][S+](c1ccccc1)c2ccccn2 Amb2612926 [0,1,0,0,1,0|1,0,1]=4 1085 B15R2.55 Brc1sccc1CSc2ccccc2 Amb27266293 [0,1,0,0,1,0|2,0,0]=4 1086 B15R2.100 Brc1ccc(CSc2cccs2)cc1 Amb28132023 [0,1,0,0,1,0|2,0,0]=4 1087 B15R2.100 Clc1ccc(CSc2cccs2)cc1 Amb2749186 [0,1,0,0,1,0|2,0,0]=4 1088 B15R2.100 Nc1ccc(SCc2ccco2)cc1 Amb1099017 [0,1,0,0,1,0|2,0,0]=4 1089 B15R2.100 Nc1ccc(SCc2ccoc2)cc1 Amb27189298 [0,1,0,0,1,0|2,0,0]=4 1090 B15R2.100 Oc1ccc(SCc2ccco2)cc1 Amb28251737 [0,1,0,0,1,0|2,0,0]=4 1091 B15R2.100 Oc1ccc(SCc2cccs2)cc1 Amb13893514 [0,1,0,0,1,0|2,0,0]=4 1092 B15R2.283 Brc1cc(CSc2ccccc2)co1 Amb27768461 [0,1,0,0,1,0|2,0,0]=4 1093 B15R2.562 Brc1ccccc1CSc2cccs2 Amb28122592 [0,1,0,0,1,0|2,0,0]=4 1094 B15R2.562 Nc1ccccc1SCc2ccco2 Amb7786185 [0,1,0,0,1,0|2,0,0]=4 1095 B15R2.562 Nc1ccccc1SCc2ccoc2 Amb27172621 [0,1,0,0,1,0|2,0,0]=4 1096 B15R2.562 Nc1ccccc1SCc2ccsc2 Amb2362038 [0,1,0,0,1,0|2,0,0]=4 1097 B15R2.562 Oc1ccccc1SCc2ccco2 Amb27663910 [0,1,0,0,1,0|2,0,0]=4 1098 B15R2.562 Oc1ccccc1SCc2cccs2 Amb27971517 [0,1,0,0,1,0|2,0,0]=4 1099 B15R2.562 Oc1ccccc1SCc2ccsc2 Amb28131530 [0,1,0,0,1,0|2,0,0]=4 1100 B15R2.1117 Nc1cccc(CSc2cccs2)c1 Amb6717276 [0,1,0,0,1,0|2,0,0]=4 1101 B17R2.143 BrC(Cc1ccccc1)Cc2ccccc2 Amb17755302 [0,1,0,0,0,1|2,0,0]=4 1102 B17R2.143 CN(Cc1ccccc1)Cc2ccccc2 Amb1925683 [0,1,0,0,0,1|2,0,0]=4 1103 B17R2.143 C\C(=N/c1ccccc1)Nc2ccccc2 Amb8505021 [0,1,0,0,0,1|2,0,0]=4 1104 B17R2.143 ClP(Oc1ccccc1)Oc2ccccc2 Amb23496207 [0,1,0,0,0,1|0,2,0]=4 1105 B17R2.143 N=C(Nc1ccccc1)Nc2ccccc2 Amb1299410 [0,1,0,0,0,1|2,0,0]=4 1106 B17R2.143 N=C(Nc1ccccc1)Nc2ccccc2 Amb22002351 [0,1,0,0,0,1|2,0,0]=4 1107 B17R2.143 NC(Cc1ccccc1)Cc2ccccc2 Amb1114019 [0,1,0,0,0,1|2,0,0]=4 1108 B17R2.143 NC(Cc1ccccc1)Cc2ccccc2 Amb2816835 [0,1,0,0,0,1|2,0,0]=4 1109 B17R2.143 NN(Cc1ccccc1)Cc2ccccc2 Amb6608929 [0,1,0,0,0,1|2,0,0]=4 1110 B17R2.143 N\C(=N\c1ccccc1)Nc2ccccc2 Amb22330448 [0,1,0,0,0,1|2,0,0]=4 1111 B17R2.143 O=C(Cc1ccccc1)Cc2ccccc2 Amb6354516 [0,1,0,0,0,1|2,0,0]=4 1112 B17R2.143 O=C(Cc1ccccc1)Nc2ccccc2 Amb3099547 [0,1,0,0,0,1|2,0,0]=4 1113 B17R2.143 O=C(Nc1ccccc1)Nc2ccccc2 Amb1245995 [0,1,0,0,0,1|2,0,0]=4 1114 B17R2.143 O=C(Oc1ccccc1)Oc2ccccc2 Amb1260798 [0,1,0,0,0,1|0,2,0]=4 1115 B17R2.143 O=S(Cc1ccccc1)Cc2ccccc2 Amb8387527 [0,1,0,0,0,1|1,0,1]=4 1116 B17R2.143 O=[PH](Oc1ccccc1)Oc2ccccc2 Amb8513156 [0,1,0,0,0,1|0,2,0]=4 1117 B17R2.143 OC(Cc1ccccc1)Cc2ccccc2 Amb1110031 [0,1,0,0,0,1|2,0,0]=4 1118 B17R2.143 ON(Cc1ccccc1)Cc2ccccc2 Amb2226907 [0,1,0,0,0,1|2,0,0]=4 1119 B17R2.143 S=C(Nc1ccccc1)Nc2ccccc2 Amb534979 [0,1,0,0,0,1|2,0,0]=4 1120 B17R2.143 S=C(Oc1ccccc1)Oc2ccccc2 Amb2614902 [0,1,0,0,0,1|0,2,0]=4 1121 B17R2.143 S=C(Sc1ccccc1)Sc2ccccc2 Amb2609041 [0,1,0,0,0,1|0,0,0]=2 1122 B17R2.143 SC(Cc1ccccc1)Cc2ccccc2 Amb7784708 [0,1,0,0,0,1|2,0,0]=4 1123 B17R2.143 S\C(=N\c1ccccc1)Nc2ccccc2 Amb3467091 [0,1,0,0,0,1|2,0,0]=4 1124 B17R2.143 [O-]\C(=N/c1ccccc1)Nc2ccccc2 Amb8488212 [0,1,0,0,0,1|2,0,0]=4 1125 B17R2.143 [Se]=C(Nc1ccccc1)Nc2ccccc2 Amb2704342 [0,1,0,0,0,1|2,0,0]=4 1126 B17R2.216 Brc1ccc(CNCc2ccccc2)cc1 Amb22587996 [0,1,0,0,0,1|2,0,0]=4 1127 B17R2.216 Brc1ccc(CNCc2ccccc2)cc1 Amb838866 [0,1,0,0,0,1|2,0,0]=4 1128 B17R2.216 Brc1ccc(COCc2ccccc2)cc1 Amb19301961 [0,1,0,0,0,1|1,1,0]=4 1129 B17R2.216 Brc1ccc(NCCc2ccccc2)cc1 Amb6696485 [0,1,0,0,0,1|2,0,0]=4 1130 B17R2.216 Brc1ccc(OCCc2ccccc2)cc1 Amb6649169 [0,1,0,0,0,1|1,1,0]=4 1131 B17R2.216 Cc1ccc(CNCc2ccccc2)cc1 Amb6687346 [0,1,0,0,0,1|2,0,0]=4 1132 B17R2.216 Cc1ccc(NCCc2ccccc2)cc1 Amb4358611 [0,1,0,0,0,1|2,0,0]=4 1133 B17R2.216 Clc1ccc(CNCc2ccccc2)cc1 Amb6364679 [0,1,0,0,0,1|2,0,0]=4 1134 B17R2.216 Clc1ccc(CSCc2ccccc2)cn1 Amb6675876 [0,1,0,0,0,1|2,0,0]=4 1135 B17R2.216 Clc1ccc(NCCc2ccccc2)cc1 Amb6624606 [0,1,0,0,0,1|2,0,0]=4 1136 B17R2.216 Clc1ccc(\C=N\Nc2ccccc2)cc1 Amb2703784 [0,1,0,0,0,1|2,0,0]=4 1137 B17R2.216 Fc1ccc(CNCc2ccccc2)cc1 Amb6352461 [0,1,0,0,0,1|2,0,0]=4 1138 B17R2.216 Fc1ccc(CNCc2ccccc2)cc1 Amb8468188 [0,1,0,0,0,1|2,0,0]=4 1139 B17R2.216 Fc1ccc(NCCc2ccccc2)cc1 Amb6696718 [0,1,0,0,0,1|2,0,0]=4 1140 B17R2.216 Ic1ccc(CNCc2ccccc2)cc1 Amb27644269 [0,1,0,0,0,1|2,0,0]=4 1141 B17R2.216 Ic1ccc(COCc2ccccc2)cc1 Amb28381491 [0,1,0,0,0,1|1,1,0]=4 1142 B17R2.216 Ic1ccc(OCCc2ccccc2)cc1 Amb20669160 [0,1,0,0,0,1|1,1,0]=4 1143 B17R2.216 Nc1ccc(CCCc2ccccc2)cc1 Amb13952637 [0,1,0,0,0,1|2,0,0]=4 1144 B17R2.216 Nc1ccc(CCOc2ccccc2)cc1 Amb9380875 [0,1,0,0,0,1|1,1,0]=4 1145 B17R2.216 Nc1ccc(COCc2ccccc2)cc1 Amb1138750 [0,1,0,0,0,1|1,1,0]=4 1146 B17R2.216 Nc1ccc(NCCc2ccccc2)cc1 Amb1103721 [0,1,0,0,0,1|2,0,0]=4 1147 B17R2.216 Nc1ccc(OCCc2ccccc2)cc1 Amb1112778 [0,1,0,0,0,1|1,1,0]=4 1148 B17R2.216 Nc1ccc(SCCc2ccccn2)cc1 Amb8606761 [0,1,0,0,0,1|2,0,0]=4 1149 B17R2.216 Oc1ccc(CNCc2ccccc2)cc1 Amb6687336 [0,1,0,0,0,1|2,0,0]=4 1150 B17R2.216 Oc1ccc(NCCc2ccccc2)cc1 Amb33548437 [0,1,0,0,0,1|2,0,0]=4 1151 B17R2.216 Oc1ccc(NCCc2ccccc2)cc1 Amb9608650 [0,1,0,0,0,1|2,0,0]=4 1152 B17R2.216 Oc1ccc(OCCc2ccccc2)cc1 Amb9210954 [0,1,0,0,0,1|1,1,0]=4 1153 B17R2.216 Oc1ccc(\C=N\Cc2ccccc2)cc1 Amb4297814 [0,1,0,0,0,1|2,0,0]=4 1154 B17R2.2342 Br\C(=N/Nc1ccccc1)c2ccccc2 Amb10563287 [0,1,0,0,0,1|2,0,0]=4 1155 B17R2.2342 CC(CCc1ccccc1)c2ccccc2 Amb23437762 [0,1,0,0,0,1|2,0,0]=4 1156 B17R2.2342 CC(NCc1ccccc1)c2ccccc2 Amb21959684 [0,1,0,0,0,1|2,0,0]=4 1157 B17R2.2342 CC(NCc1ccccc1)c2ccccc2 Amb9743575 [0,1,0,0,0,1|2,0,0]=4 1158 B17R2.2342 CC(OCc1ccccc1)c2ccccc2 Amb28141227 [0,1,0,0,0,1|1,1,0]=4 1159 B17R2.2342 CC(\C=C\c1ccccc1)c2ccccc2 Amb17673649 [0,1,0,0,0,1|2,0,0]=4 1160 B17R2.2342 C[C@@H](NCc1ccccc1)c2ccccc2 Amb2719978 [0,1,0,0,0,1|2,0,0]=4 1161 B17R2.2342 C[C@@H](NCc1ccccc1)c2ccccc2 Amb3939870 [0,1,0,0,0,1|2,0,0]=4 1162 B17R2.2342 C[C@H](NCc1ccccc1)c2ccccc2 Amb2786750 [0,1,0,0,0,1|2,0,0]=4 1163 B17R2.2342 C[C@H](NCc1ccccc1)c2ccccc2 Amb32663250 [0,1,0,0,0,1|2,0,0]=4 1164 B17R2.2342 C\C(=N/Nc1ccccc1)c2ccccc2 Amb16225041 [0,1,0,0,0,1|2,0,0]=4 1165 B17R2.2342 ClC(\C=C\c1ccccc1)c2ccccc2 Amb24121369 [0,1,0,0,0,1|2,0,0]=4 1166 B17R2.2342 Cl\C(=N/Nc1ccccc1)c2ccccc2 Amb2780895 [0,1,0,0,0,1|2,0,0]=4 1167 B17R2.2342 Cl\C(=N\Cc1ccccc1)c2ccccc2 Amb28400953 [0,1,0,0,0,1|2,0,0]=4 1168 B17R2.2342 N=C(NCc1ccccc1)c2ccccc2 Amb23447124 [0,1,0,0,0,1|2,0,0]=4 1169 B17R2.2342 NC(CCc1ccccc1)c2ccccc2 Amb10609173 [0,1,0,0,0,1|2,0,0]=4 1170 B17R2.2342 NC(CCc1ccccc1)c2ccccc2 Amb5737005 [0,1,0,0,0,1|2,0,0]=4 1171 B17R2.2342 NC(CNc1ccccc1)c2ccccc2 Amb19009672 [0,1,0,0,0,1|2,0,0]=4 1172 B17R2.2342 NC(COc1ccccc1)c2ccccc2 Amb1139757 [0,1,0,0,0,1|1,1,0]=4 1173 B17R2.2342 NC(COc1ccccc1)c2ccccc2 Amb19341662 [0,1,0,0,0,1|1,1,0]=4 1174 B17R2.2342 NC(CSc1ccccc1)c2ccccc2 Amb21988447 [0,1,0,0,0,1|1,0,0]=3 1175 B17R2.2342 N[C@@H](CNc1ccccc1)c2ccccc2 Amb33838333 [0,1,0,0,0,1|2,0,0]=4 1176 B17R2.2342 O=C(C#Cc1ccccc1)c2ccccc2 Amb3941702 [0,1,0,0,0,1|2,0,0]=4 1177 B17R2.2342 O=C(CCc1ccccc1)c2ccccc2 Amb2228399 [0,1,0,0,0,1|2,0,0]=4 1178 B17R2.2342 O=C(CNc1ccccc1)c2ccccc2 Amb32929163 [0,1,0,0,0,1|2,0,0]=4 1179 B17R2.2342 O=C(CNc1ccccc1)c2ccccc2 Amb6543315 [0,1,0,0,0,1|2,0,0]=4 1180 B17R2.2342 O=C(COc1ccccc1)c2ccccc2 Amb6360737 [0,1,0,0,0,1|1,1,0]=4 1181 B17R2.2342 O=C(CSc1ccccc1)c2ccccc2 Amb2703541 [0,1,0,0,0,1|1,0,0]=3 1182 B17R2.2342 O=C(CSc1ccccn1)c2ccccc2 Amb3862209 [0,1,0,0,0,1|2,0,0]=4 1183 B17R2.2342 O=C(NCc1ccccc1)c2ccccc2 Amb6339622 [0,1,0,0,0,1|2,0,0]=4 1184 B17R2.2342 O=C(NNc1ccccc1)c2ccccc2 Amb1229298 [0,1,0,0,0,1|2,0,0]=4 1185 B17R2.2342 O=C(OCc1ccccc1)c2ccccc2 Amb4889094 [0,1,0,0,0,1|1,1,0]=4 1186 B17R2.2342 O=C(\C=C\c1ccccc1)c2ccccc2 Amb17777126 [0,1,0,0,0,1|2,0,0]=4 1187 B17R2.2342 O=C(\C=C\c1ccccc1)c2ccccc2 Amb33716481 [0,1,0,0,0,1|2,0,0]=4 1188 B17R2.2342 O=C(\C=C\c1ccccc1)c2ccccc2 Amb8513552 [0,1,0,0,0,1|2,0,0]=4 1189 B17R2.2342 O=C(\N=N\c1ccccc1)c2ccccc2 Amb16231118 [0,1,0,0,0,1|2,0,0]=4 1190 B17R2.2342 OC(CCc1ccccc1)c2ccccc2 Amb4019920 [0,1,0,0,0,1|2,0,0]=4 1191 B17R2.2342 OC(CNc1ccccc1)c2ccccc2 Amb17140784 [0,1,0,0,0,1|2,0,0]=4 1192 B17R2.2342 OC(COc1ccccc1)c2ccccc2 Amb22479800 [0,1,0,0,0,1|1,1,0]=4 1193 B17R2.2342 OC(CSc1ccccc1)c2ccccc2 Amb21988442 [0,1,0,0,0,1|1,0,0]=3 1194 B17R2.2342 OC(\C=C\c1ccccc1)c2ccccc2 Amb5493999 [0,1,0,0,0,1|2,0,0]=4 1195 B17R2.2342 ON(\C=C\c1ccccc1)c2ccccc2 Amb17778079 [0,1,0,0,0,1|2,0,0]=4 1196 B17R2.2342 O[C@@H](CNc1ccccc1)c2ccccc2 Amb29838296 [0,1,0,0,0,1|2,0,0]=4 1197 B17R2.2342 O[C@H](CNc1ccccc1)c2ccccc2 Amb28556777 [0,1,0,0,0,1|2,0,0]=4 1198 B17R2.2342 S=C(NCc1ccccc1)c2ccccc2 Amb1212595 [0,1,0,0,0,1|2,0,0]=4 1199 B17R2.3956 Brc1ccccc1NCCc2ccccc2 Amb6696373 [0,1,0,0,0,1|2,0,0]=4 1200 B17R2.3956 Brc1ccccc1OCCc2ccccc2 Amb6665082 [0,1,0,0,0,1|1,1,0]=4 1201 B17R2.3956 Brc1ccccc1\C=N\Nc2ccccc2 Amb24092518 [0,1,0,0,0,1|2,0,0]=4 1202 B17R2.3956 Cc1ccccc1CNCc2ccccc2 Amb6687345 [0,1,0,0,0,1|2,0,0]=4 1203 B17R2.3956 Cc1ccccc1NCCc2ccccc2 Amb4358612 [0,1,0,0,0,1|2,0,0]=4 1204 B17R2.3956 Clc1ccccc1CNCc2ccccc2 Amb6364680 [0,1,0,0,0,1|2,0,0]=4 1205 B17R2.3956 Clc1ccccc1NCCc2ccccc2 Amb6610978 [0,1,0,0,0,1|2,0,0]=4 1206 B17R2.3956 Fc1ccccc1CNCc2ccccc2 Amb6352459 [0,1,0,0,0,1|2,0,0]=4 1207 B17R2.3956 Fc1ccccc1NCCc2ccccc2 Amb6697268 [0,1,0,0,0,1|2,0,0]=4 1208 B17R2.3956 Nc1ccccc1CNCc2ccccc2 Amb19010879 [0,1,0,0,0,1|2,0,0]=4 1209 B17R2.3956 Nc1ccccc1COCc2ccccc2 Amb6244669 [0,1,0,0,0,1|1,1,0]=4 1210 B17R2.3956 Nc1ccccc1NCCc2ccccc2 Amb1103711 [0,1,0,0,0,1|2,0,0]=4 1211 B17R2.3956 Nc1ccccc1NCCc2ccccc2 Amb2603080 [0,1,0,0,0,1|2,0,0]=4 1212 B17R2.3956 Nc1ccccc1NNCc2ccccc2 Amb27248419 [0,1,0,0,0,1|2,0,0]=4 1213 B17R2.3956 Nc1ccccc1OCCc2ccccc2 Amb1112568 [0,1,0,0,0,1|1,1,0]=4 1214 B17R2.3956 Nc1ccccc1\C=N\Nc2ccccc2 Amb20665806 [0,1,0,0,0,1|2,0,0]=4 1215 B17R2.3956 Oc1ccccc1CNCc2ccccc2 Amb2781942 [0,1,0,0,0,1|2,0,0]=4 1216 B17R2.3956 Oc1ccccc1COCc2ccccc2 Amb27859423 [0,1,0,0,0,1|1,1,0]=4 1217 B17R2.3956 Oc1ccccc1C\C=C\c2ccccc2 Amb1806020 [0,1,0,0,0,1|2,0,0]=4 1218 B17R2.3956 Oc1ccccc1OCCc2ccccc2 Amb9210976 [0,1,0,0,0,1|1,1,0]=4 1219 B17R2.3956 Oc1ccccc1\C=N\Cc2ccccc2 Amb576127 [0,1,0,0,0,1|2,0,0]=4 1220 B17R2.3956 Oc1ccccc1\C=N\Nc2ccccc2 Amb6538801 [0,1,0,0,0,1|2,0,0]=4 1221 B17R2.5301 Brc1cccc(CNCc2ccccc2)c1 Amb22588026 [0,1,0,0,0,1|2,0,0]=4 1222 B17R2.5301 Brc1cccc(CNCc2ccccc2)c1 Amb6687338 [0,1,0,0,0,1|2,0,0]=4 1223 B17R2.5301 Brc1cccc(NCCc2ccccc2)c1 Amb6696593 [0,1,0,0,0,1|2,0,0]=4 1224 B17R2.5301 Brc1cccc(OCCc2ccccc2)c1 Amb6628830 [0,1,0,0,0,1|1,1,0]=4 1225 B17R2.5301 Cc1cccc(CNCc2ccccc2)c1 Amb1833778 [0,1,0,0,0,1|2,0,0]=4 1226 B17R2.5301 Cc1cccc(CNCc2ccccc2)c1 Amb6335361 [0,1,0,0,0,1|2,0,0]=4 1227 B17R2.5301 Cc1cccc(NCCc2ccccc2)c1 Amb6684422 [0,1,0,0,0,1|2,0,0]=4 1228 B17R2.5301 Clc1cccc(CNCc2ccccc2)c1 Amb1923462 [0,1,0,0,0,1|2,0,0]=4 1229 B17R2.5301 Clc1cccc(NCCc2ccccc2)c1 Amb6649485 [0,1,0,0,0,1|2,0,0]=4 1230 B17R2.5301 Fc1cccc(CNCc2ccccc2)c1 Amb6352465 [0,1,0,0,0,1|2,0,0]=4 1231 B17R2.5301 Fc1cccc(NCCc2ccccc2)c1 Amb6695783 [0,1,0,0,0,1|2,0,0]=4 1232 B17R2.5301 Ic1cccc(CNCc2ccccc2)c1 Amb26550498 [0,1,0,0,0,1|2,0,0]=4 1233 B17R2.5301 Nc1cccc(CCCc2ccccc2)c1 Amb13952732 [0,1,0,0,0,1|2,0,0]=4 1234 B17R2.5301 Nc1cccc(COCc2ccccc2)c1 Amb2699336 [0,1,0,0,0,1|1,1,0]=4 1235 B17R2.5301 Nc1cccc(CSCc2ccccc2)c1 Amb6676518 [0,1,0,0,0,1|1,0,0]=3 1236 B17R2.5301 Nc1cccc(OCCc2ccccc2)c1 Amb1119309 [0,1,0,0,0,1|1,1,0]=4 1237 B17R2.5301 Nc1cccc(OCCc2ccccc2)c1 Amb2111108 [0,1,0,0,0,1|1,1,0]=4 1238 B17R2.5301 Oc1cccc(CNCc2ccccc2)c1 Amb6687458 [0,1,0,0,0,1|2,0,0]=4 1239 B17R2.5301 Oc1cccc(OCCc2ccccc2)c1 Amb8837429 [0,1,0,0,0,1|1,1,0]=4 1240 B17R2.5301 Oc1cccc(\C=N\Cc2ccccc2)c1 Amb8485956 [0,1,0,0,0,1|2,0,0]=4 1241 B17R2.3395 O=C1C=CC=CC=C1NCc2ccccc2 Amb21913360 [0,1,0,0,0,1|2,0,0]=4 1242 B17R2.3395 S=C1C=CC=CC=C1NCc2ccccc2 Amb21867642 [0,1,0,0,0,1|2,0,0]=4 1243 B17R2.24159 O=C1C=CC=C(NCc2ccccc2)C=C1 Amb28192628 [0,1,0,0,0,1|2,0,0]=4 1244 B17R2.262 BrCc1ccccc1OCc2ccccc2 Amb2695510 [0,2,0,0,0,0|1,1,0]=4 1245 B17R2.262 C#Cc1ccccc1OCc2ccccc2 Amb33080652 [0,2,0,0,0,0|1,1,0]=4 1246 B17R2.262 C=Cc1ccccc1OCc2ccccc2 Amb33080692 [0,2,0,0,0,0|1,1,0]=4 1247 B17R2.262 CCc1ccccc1NCc2ccccc2 Amb6698997 [0,2,0,0,0,0|2,0,0]=4 1248 B17R2.262 CNc1ccccc1OCc2ccccc2 Amb20138963 [0,2,0,0,0,0|1,1,0]=4 1249 B17R2.262 CNc1ccccc1OCc2ccccc2 Amb32655949 [0,2,0,0,0,0|1,1,0]=4 1250 B17R2.262 COc1ccccc1C#Cc2ccccc2 Amb10608912 [0,2,0,0,0,0|2,0,0]=4 1251 B17R2.262 COc1ccccc1CNc2ccccc2 Amb1845980 [0,2,0,0,0,0|2,0,0]=4 1252 B17R2.262 COc1ccccc1CNc2ccccc2 Amb22291620 [0,2,0,0,0,0|2,0,0]=4 1253 B17R2.262 COc1ccccc1NCc2ccccc2 Amb838890 [0,2,0,0,0,0|2,0,0]=4 1254 B17R2.262 CSc1ccccc1NCc2ccccc2 Amb928267 [0,2,0,0,0,0|2,0,0]=4 1255 B17R2.262 ClCc1ccccc1OCc2ccccc2 Amb6659077 [0,2,0,0,0,0|1,1,0]=4 1256 B17R2.262 ClCc1ccccc1SCc2ccccc2 Amb32789705 [0,2,0,0,0,0|1,0,0]=3 1257 B17R2.262 N#Cc1ccccc1COc2ccccc2 Amb270391 [0,2,0,0,0,0|1,1,0]=4 1258 B17R2.262 N#Cc1ccccc1NCc2ccccc2 Amb6359194 [0,2,0,0,0,0|2,0,0]=4 1259 B17R2.262 N#Cc1ccccc1OCc2ccccc2 Amb3992454 [0,2,0,0,0,0|1,1,0]=4 1260 B17R2.262 N#Cc1cccnc1SCc2ccccc2 Amb6676932 [0,2,0,0,0,0|2,0,0]=4 1261 B17R2.262 NCc1ccccc1COc2ccccc2 Amb1230543 [0,2,0,0,0,0|1,1,0]=4 1262 B17R2.262 NCc1ccccc1COc2ccccc2 Amb6892759 [0,2,0,0,0,0|1,1,0]=4 1263 B17R2.262 NCc1ccccc1NCc2ccccc2 Amb5786769 [0,2,0,0,0,0|2,0,0]=4 1264 B17R2.262 NCc1ccccc1OCc2ccccc2 Amb10201449 [0,2,0,0,0,0|1,1,0]=4 1265 B17R2.262 NCc1ccccc1OCc2ccccc2 Amb1111634 [0,2,0,0,0,0|1,1,0]=4 1266 B17R2.262 NNc1ccccc1OCc2ccccc2 Amb1771530 [0,2,0,0,0,0|1,1,0]=4 1267 B17R2.262 NNc1ccccc1OCc2ccccc2 Amb2234786 [0,2,0,0,0,0|1,1,0]=4 1268 B17R2.262 O=Cc1ccccc1C#Cc2ccccc2 Amb8388861 [0,2,0,0,0,0|2,0,0]=4 1269 B17R2.262 O=Cc1ccccc1CCc2ccccc2 Amb24081218 [0,2,0,0,0,0|2,0,0]=4 1270 B17R2.262 O=Cc1ccccc1COc2ccccc2 Amb2724076 [0,2,0,0,0,0|1,1,0]=4 1271 B17R2.262 O=Cc1ccccc1NCc2ccccc2 Amb27257940 [0,2,0,0,0,0|2,0,0]=4 1272 B17R2.262 O=Cc1ccccc1OCc2ccccc2 Amb1207492 [0,2,0,0,0,0|1,1,0]=4 1273 B17R2.262 O=Cc1ccccc1SCc2ccccc2 Amb9767660 [0,2,0,0,0,0|1,0,0]=3 1274 B17R2.262 O=Cc1cccnc1SCc2ccccc2 Amb2610279 [0,2,0,0,0,0|2,0,0]=4 1275 B17R2.262 OCc1ccccc1C#Cc2ccccc2 Amb2610305 [0,2,0,0,0,0|2,0,0]=4 1276 B17R2.262 OCc1ccccc1CCc2ccccc2 Amb3939372 [0,2,0,0,0,0|2,0,0]=4 1277 B17R2.262 OCc1ccccc1COc2ccccc2 Amb2724079 [0,2,0,0,0,0|1,1,0]=4 1278 B17R2.262 OCc1ccccc1NCc2ccccc2 Amb4016425 [0,2,0,0,0,0|2,0,0]=4 1279 B17R2.262 OCc1ccccc1OCc2ccccc2 Amb1110001 [0,2,0,0,0,0|1,1,0]=4 1280 B17R2.262 OCc1ccccc1SCc2ccccc2 Amb32941823 [0,2,0,0,0,0|1,0,0]=3 1281 B17R2.262 OCc1ccccc1\C=C\c2ccccc2 Amb2609130 [0,2,0,0,0,0|2,0,0]=4 1282 B17R2.262 SCc1ccccc1OCc2ccccc2 Amb33080702 [0,2,0,0,0,0|1,1,0]=4 1283 B17R2.262 [C-]#[N+]c1ccccc1OCc2ccccc2 Amb3973091 [0,2,0,0,0,0|1,1,0]=4 1284 B17R2.496 Cc1ccc(C#Cc2ccccc2N)cc1 Amb30634164 [0,2,0,0,0,0|2,0,0]=4 1285 B17R2.496 Cc1ccc(CCc2ccccc2N)cc1 Amb31118103 [0,2,0,0,0,0|2,0,0]=4 1286 B17R2.496 Cc1ccc(CNc2ccccc2Br)cc1 Amb6696360 [0,2,0,0,0,0|2,0,0]=4 1287 B17R2.496 Cc1ccc(CNc2ccccc2C)cc1 Amb6701115 [0,2,0,0,0,0|2,0,0]=4 1288 B17R2.496 Cc1ccc(CNc2ccccc2Cl)cc1 Amb4313278 [0,2,0,0,0,0|2,0,0]=4 1289 B17R2.496 Cc1ccc(CNc2ccccc2F)cc1 Amb6697254 [0,2,0,0,0,0|2,0,0]=4 1290 B17R2.496 Cc1ccc(COc2ccccc2N)cc1 Amb1118655 [0,2,0,0,0,0|1,1,0]=4 1291 B17R2.496 Cc1ccc(CSc2ccccc2N)cc1 Amb2149342 [0,2,0,0,0,0|1,0,0]=3 1292 B17R2.496 Cc1ccc(CSc2ccccc2N)cc1 Amb6666827 [0,2,0,0,0,0|1,0,0]=3 1293 B17R2.496 Cc1ccc(NCc2ccccc2C)cc1 Amb4313315 [0,2,0,0,0,0|2,0,0]=4 1294 B17R2.496 Cc1ccc(NCc2ccccc2Cl)cc1 Amb4313407 [0,2,0,0,0,0|2,0,0]=4 1295 B17R2.496 Cc1ccc(NCc2ccccc2F)cc1 Amb6700864 [0,2,0,0,0,0|2,0,0]=4 1296 B17R2.496 Cc1ccc(NCc2ccccc2O)cc1 Amb3547080 [0,2,0,0,0,0|2,0,0]=4 1297 B17R2.496 Cc1ccc(OCc2ccccc2N)cc1 Amb6249936 [0,2,0,0,0,0|1,1,0]=4 1298 B17R2.496 Cc1ccc(\N=C\c2ccccc2O)cc1 Amb1040064 [0,2,0,0,0,0|2,0,0]=4 1299 B17R2.496 Cc1ccccc1CNc2ccc(Br)cc2 Amb4313324 [0,2,0,0,0,0|2,0,0]=4 1300 B17R2.496 Cc1ccccc1CNc2ccc(Cl)cc2 Amb4313319 [0,2,0,0,0,0|2,0,0]=4 1301 B17R2.496 Cc1ccccc1CNc2ccc(F)cc2 Amb4313325 [0,2,0,0,0,0|2,0,0]=4 1302 B17R2.496 Cc1ccccc1CNc2ccc(O)cc2 Amb9608621 [0,2,0,0,0,0|2,0,0]=4 1303 B17R2.496 Cc1ccccc1COc2ccc(N)cc2 Amb1115826 [0,2,0,0,0,0|1,1,0]=4 1304 B17R2.496 Cc1ccccc1COc2ccc(O)cc2 Amb8837217 [0,2,0,0,0,0|1,1,0]=4 1305 B17R2.496 Cc1ccccc1CSc2ccc(N)cc2 Amb8930366 [0,2,0,0,0,0|1,0,0]=3 1306 B17R2.496 Cc1ccccc1NCc2ccc(Br)cc2 Amb838875 [0,2,0,0,0,0|2,0,0]=4 1307 B17R2.496 Cc1ccccc1NCc2ccc(Cl)cc2 Amb838876 [0,2,0,0,0,0|2,0,0]=4 1308 B17R2.496 Cc1ccccc1NCc2ccc(O)cc2 Amb3543416 [0,2,0,0,0,0|2,0,0]=4 1309 B17R2.496 Cc1ccccc1\C=N\c2ccc(O)cc2 Amb6345147 [0,2,0,0,0,0|2,0,0]=4 1310 B17R2.496 Clc1ccc(CNc2ccccc2Cl)cc1 Amb10609658 [0,2,0,0,0,0|2,0,0]=4 1311 B17R2.496 Clc1ccc(CNc2ccccc2Cl)cc1 Amb4313432 [0,2,0,0,0,0|2,0,0]=4 1312 B17R2.496 Clc1ccc(COc2ccccc2Br)cc1 Amb6636192 [0,2,0,0,0,0|1,1,0]=4 1313 B17R2.496 Clc1ccc(NCc2ccccc2Cl)cc1 Amb4313411 [0,2,0,0,0,0|2,0,0]=4 1314 B17R2.496 Fc1ccc(CNc2ccccc2Cl)cc1 Amb4313370 [0,2,0,0,0,0|2,0,0]=4 1315 B17R2.496 Fc1ccc(CNc2ccccc2F)cc1 Amb6697238 [0,2,0,0,0,0|2,0,0]=4 1316 B17R2.496 Fc1ccc(NCc2ccccc2Cl)cc1 Amb4313417 [0,2,0,0,0,0|2,0,0]=4 1317 B17R2.496 Fc1ccc(NCc2ccccc2F)cc1 Amb6696814 [0,2,0,0,0,0|2,0,0]=4 1318 B17R2.496 Fc1ccc(\N=C\c2ccccc2Cl)cc1 Amb22337519 [0,2,0,0,0,0|2,0,0]=4 1319 B17R2.496 Fc1ccccc1CNc2ccc(Cl)cc2 Amb6695982 [0,2,0,0,0,0|2,0,0]=4 1320 B17R2.496 Fc1ccccc1CNc2ccc(I)cc2 Amb7760851 [0,2,0,0,0,0|2,0,0]=4 1321 B17R2.496 Fc1ccccc1COc2ccc(Br)cc2 Amb6665061 [0,2,0,0,0,0|1,1,0]=4 1322 B17R2.496 Fc1ccccc1NCc2ccc(Cl)cc2 Amb6697235 [0,2,0,0,0,0|2,0,0]=4 1323 B17R2.496 Nc1ccc(COc2ccccc2Br)cc1 Amb5780590 [0,2,0,0,0,0|1,1,0]=4 1324 B17R2.496 Nc1ccc(OCc2ccccc2Cl)cc1 Amb1260935 [0,2,0,0,0,0|1,1,0]=4 1325 B17R2.496 Nc1ccc(OCc2ccccc2Cl)cc1 Amb843446 [0,2,0,0,0,0|1,1,0]=4 1326 B17R2.496 Nc1ccc(OCc2ccccc2F)cc1 Amb13951769 [0,2,0,0,0,0|1,1,0]=4 1327 B17R2.496 Nc1ccc(OCc2ccccc2F)cc1 Amb843445 [0,2,0,0,0,0|1,1,0]=4 1328 B17R2.496 Nc1ccc(SCc2ccccc2Cl)cc1 Amb8930398 [0,2,0,0,0,0|1,0,0]=3 1329 B17R2.496 Nc1ccc(SCc2ccccc2Cl)cn1 Amb8933207 [0,2,0,0,0,0|2,0,0]=4 1330 B17R2.496 Nc1ccc(SCc2ccccc2F)cc1 Amb8930411 [0,2,0,0,0,0|1,0,0]=3 1331 B17R2.496 Nc1ccc(\C=C/c2ccccc2N)cc1 Amb17843352 [0,2,0,0,0,0|2,0,0]=4 1332 B17R2.496 Nc1ccccc1C#Cc2ccc(Cl)cc2 Amb8388481 [0,2,0,0,0,0|2,0,0]=4 1333 B17R2.496 Nc1ccccc1C#Cc2ccc(F)cc2 Amb30634165 [0,2,0,0,0,0|2,0,0]=4 1334 B17R2.496 Nc1ccccc1CCc2ccc(Br)cc2 Amb31122480 [0,2,0,0,0,0|2,0,0]=4 1335 B17R2.496 Nc1ccccc1CCc2ccc(Cl)cc2 Amb22011653 [0,2,0,0,0,0|2,0,0]=4 1336 B17R2.496 Nc1ccccc1CCc2ccc(F)cc2 Amb31135812 [0,2,0,0,0,0|2,0,0]=4 1337 B17R2.496 Nc1ccccc1COc2ccc(Cl)cc2 Amb6251567 [0,2,0,0,0,0|1,1,0]=4 1338 B17R2.496 Nc1ccccc1NCc2ccc(Cl)cc2 Amb7767431 [0,2,0,0,0,0|2,0,0]=4 1339 B17R2.496 Nc1ccccc1OCc2ccc(Br)cc2 Amb6243546 [0,2,0,0,0,0|1,1,0]=4 1340 B17R2.496 Nc1ccccc1OCc2ccc(Cl)cc2 Amb6660975 [0,2,0,0,0,0|1,1,0]=4 1341 B17R2.496 Nc1ccccc1OCc2ccc(F)cc2 Amb1112688 [0,2,0,0,0,0|1,1,0]=4 1342 B17R2.496 Nc1ccccc1SCc2ccc(Cl)cc2 Amb6666817 [0,2,0,0,0,0|1,0,0]=3 1343 B17R2.496 Nc1ccccc1SCc2ccc(F)cc2 Amb2092231 [0,2,0,0,0,0|1,0,0]=3 1344 B17R2.496 Nc1ccccc1SCc2ccc(F)cc2 Amb6277363 [0,2,0,0,0,0|1,0,0]=3 1345 B17R2.496 Oc1ccc(CNc2ccccc2Br)cc1 Amb6696343 [0,2,0,0,0,0|2,0,0]=4 1346 B17R2.496 Oc1ccc(CNc2ccccc2Cl)cc1 Amb6696830 [0,2,0,0,0,0|2,0,0]=4 1347 B17R2.496 Oc1ccc(CNc2ccccc2F)cc1 Amb6697231 [0,2,0,0,0,0|2,0,0]=4 1348 B17R2.496 Oc1ccc(NCc2ccccc2Cl)cc1 Amb9608606 [0,2,0,0,0,0|2,0,0]=4 1349 B17R2.496 Oc1ccc(NCc2ccccc2F)cc1 Amb9608871 [0,2,0,0,0,0|2,0,0]=4 1350 B17R2.496 Oc1ccc(OCc2ccccc2F)cc1 Amb8837259 [0,2,0,0,0,0|1,1,0]=4 1351 B17R2.496 Oc1ccccc1CNc2ccc(Br)cc2 Amb661333 [0,2,0,0,0,0|2,0,0]=4 1352 B17R2.496 Oc1ccccc1CNc2ccc(Cl)cc2 Amb1102149 [0,2,0,0,0,0|2,0,0]=4 1353 B17R2.496 Oc1ccccc1CNc2ccc(F)cc2 Amb1071431 [0,2,0,0,0,0|2,0,0]=4 1354 B17R2.496 Oc1ccccc1NCc2ccc(Cl)cc2 Amb6422819 [0,2,0,0,0,0|2,0,0]=4 1355 B17R2.496 Oc1ccccc1OCc2ccc(F)cc2 Amb8837331 [0,2,0,0,0,0|1,1,0]=4 1356 B17R2.496 Oc1ccccc1\C=N\c2ccc(Br)cc2 Amb2386611 [0,2,0,0,0,0|2,0,0]=4 1357 B17R2.496 Oc1ccccc1\C=N\c2ccc(Cl)cc2 Amb2386610 [0,2,0,0,0,0|2,0,0]=4 1358 B17R2.496 Oc1ccccc1\C=N\c2ccc(F)cc2 Amb2386609 [0,2,0,0,0,0|2,0,0]=4 1359 B17R2.496 Oc1ccccc1\C=N\c2ccc(S)cc2 Amb31308612 [0,2,0,0,0,0|2,0,0]=4 1360 B17R2.3417 CC(Nc1ccccc1)c2ccccc2O Amb9739100 [0,2,0,0,0,0|2,0,0]=4 1361 B17R2.3417 CN(Cc1ccccc1)c2ccccc2N Amb6249827 [0,2,0,0,0,0|2,0,0]=4 1362 B17R2.3417 Cc1ccccc1C(=O)Nc2ccccc2 Amb1196301 [0,2,0,0,0,0|2,0,0]=4 1363 B17R2.3417 Cc1ccccc1C(N)Cc2ccccc2 Amb5736371 [0,2,0,0,0,0|2,0,0]=4 1364 B17R2.3417 Cc1ccccc1C(O)Cc2ccccc2 Amb17241190 [0,2,0,0,0,0|2,0,0]=4 1365 B17R2.3417 NC(Cc1ccccc1)c2ccccc2Cl Amb5736380 [0,2,0,0,0,0|2,0,0]=4 1366 B17R2.3417 NC(Cc1ccccc1)c2ccccc2F Amb5736374 [0,2,0,0,0,0|2,0,0]=4 1367 B17R2.3417 Nc1ccccc1C(=O)Cc2ccccc2 Amb6315840 [0,2,0,0,0,0|2,0,0]=4 1368 B17R2.3417 Nc1ccccc1C(=O)Nc2ccccc2 Amb6358044 [0,2,0,0,0,0|2,0,0]=4 1369 B17R2.3417 Nc1ccccc1C(=O)Oc2ccccc2 Amb2690267 [0,2,0,0,0,0|1,1,0]=4 1370 B17R2.3417 Nc1ccccc1C(=O)Sc2ccccc2 Amb2612721 [0,2,0,0,0,0|1,0,0]=3 1371 B17R2.3417 O=C(Cc1ccccc1)c2ccccc2Br Amb3941070 [0,2,0,0,0,0|2,0,0]=4 1372 B17R2.3417 O=C(Cc1ccccc1)c2ccccc2Cl Amb6301907 [0,2,0,0,0,0|2,0,0]=4 1373 B17R2.3417 O=C(Cc1ccccc1)c2ccccc2F Amb6301905 [0,2,0,0,0,0|2,0,0]=4 1374 B17R2.3417 O=C(Cc1ccccc1)c2ccccc2I Amb6301909 [0,2,0,0,0,0|2,0,0]=4 1375 B17R2.3417 O=C(Cc1ccccc1)c2ccccc2O Amb4477031 [0,2,0,0,0,0|2,0,0]=4 1376 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2Br Amb1233982 [0,2,0,0,0,0|2,0,0]=4 1377 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2Cl Amb1571971 [0,2,0,0,0,0|2,0,0]=4 1378 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2F Amb6465778 [0,2,0,0,0,0|2,0,0]=4 1379 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2I Amb2703718 [0,2,0,0,0,0|2,0,0]=4 1380 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2O Amb264316 [0,2,0,0,0,0|2,0,0]=4 1381 B17R2.3417 O=C(Oc1ccccc1)c2ccccc2O Amb6349613 [0,2,0,0,0,0|1,1,0]=4 1382 B17R2.3417 OC(Cc1ccccc1)c2ccccc2Cl Amb17250537 [0,2,0,0,0,0|2,0,0]=4 1383 B17R2.3417 OC(Cc1ccccc1)c2ccccc2F Amb17242249 [0,2,0,0,0,0|2,0,0]=4 1384 B17R2.3417 Oc1ccccc1C(O)Cc2ccccc2 Amb18657634 [0,2,0,0,0,0|2,0,0]=4 1385 B17R2.3426 CC(Nc1ccccc1N)c2ccccc2 Amb7767588 [0,2,0,0,0,0|2,0,0]=4 1386 B17R2.3426 CC(Oc1ccccc1N)c2ccccc2 Amb19515284 [0,2,0,0,0,0|1,1,0]=4 1387 B17R2.3426 CC(Oc1ccccc1N)c2ccccc2 Amb6676328 [0,2,0,0,0,0|1,1,0]=4 1388 B17R2.3426 CC(Sc1ccccc1N)c2ccccc2 Amb17305637 [0,2,0,0,0,0|1,0,0]=3 1389 B17R2.3426 CN(Cc1ccccc1N)c2ccccc2 Amb6242622 [0,2,0,0,0,0|2,0,0]=4 1390 B17R2.3426 Cc1ccccc1CC(=O)c2ccccc2 Amb6301927 [0,2,0,0,0,0|2,0,0]=4 1391 B17R2.3426 Cc1ccccc1CC(N)c2ccccc2 Amb5736397 [0,2,0,0,0,0|2,0,0]=4 1392 B17R2.3426 Cc1ccccc1CC(O)c2ccccc2 Amb17241185 [0,2,0,0,0,0|2,0,0]=4 1393 B17R2.3426 Cc1ccccc1NC(=O)c2ccccc2 Amb2736447 [0,2,0,0,0,0|2,0,0]=4 1394 B17R2.3426 Cc1ccccc1OC(=O)c2ccccc2 Amb3129589 [0,2,0,0,0,0|1,1,0]=4 1395 B17R2.3426 Clc1ccccc1CC(Cl)c2ccccc2 Amb2794068 [0,2,0,0,0,0|2,0,0]=4 1396 B17R2.3426 NC(Cc1ccccc1Cl)c2ccccc2 Amb13951457 [0,2,0,0,0,0|2,0,0]=4 1397 B17R2.3426 NC(Cc1ccccc1Cl)c2ccccc2 Amb5736637 [0,2,0,0,0,0|2,0,0]=4 1398 B17R2.3426 NC(Cc1ccccc1F)c2ccccc2 Amb5736476 [0,2,0,0,0,0|2,0,0]=4 1399 B17R2.3426 Nc1ccccc1NC(=O)c2ccccc2 Amb6242079 [0,2,0,0,0,0|2,0,0]=4 1400 B17R2.3426 Nc1ccccc1SC(=O)c2ccccc2 Amb2389288 [0,2,0,0,0,0|1,0,0]=3 1401 B17R2.3426 O=C(Cc1ccccc1Br)c2ccccc2 Amb2731627 [0,2,0,0,0,0|2,0,0]=4 1402 B17R2.3426 O=C(Cc1ccccc1Cl)c2ccccc2 Amb4019024 [0,2,0,0,0,0|2,0,0]=4 1403 B17R2.3426 O=C(Cc1ccccc1F)c2ccccc2 Amb6301923 [0,2,0,0,0,0|2,0,0]=4 1404 B17R2.3426 O=C(Nc1ccccc1Cl)c2ccccc2 Amb1333810 [0,2,0,0,0,0|2,0,0]=4 1405 B17R2.3426 O=C(Nc1ccccc1I)c2ccccc2 Amb1210670 [0,2,0,0,0,0|2,0,0]=4 1406 B17R2.3426 O=C(Nc1ccccc1O)c2ccccc2 Amb6344853 [0,2,0,0,0,0|2,0,0]=4 1407 B17R2.3426 O=C(Oc1ccccc1O)c2ccccc2 Amb2227677 [0,2,0,0,0,0|1,1,0]=4 1408 B17R2.3426 OC(Cc1ccccc1Cl)c2ccccc2 Amb17250529 [0,2,0,0,0,0|2,0,0]=4 1409 B17R2.3426 OC(Cc1ccccc1F)c2ccccc2 Amb17242242 [0,2,0,0,0,0|2,0,0]=4 1410 B17R2.3426 S=C(Nc1ccccc1Cl)c2ccccc2 Amb2611263 [0,2,0,0,0,0|2,0,0]=4 1411 B17R2.3933 Cc1cccc(Br)c1NCc2ccccc2 Amb35717900 [0,2,0,0,0,0|2,0,0]=4 1412 B17R2.3933 Cc1cccc(C)c1NCc2ccccc2 Amb17140632 [0,2,0,0,0,0|2,0,0]=4 1413 B17R2.3933 Cc1cccc(Cl)c1OCc2ccccc2 Amb28344000 [0,2,0,0,0,0|1,1,0]=4 1414 B17R2.3933 Cc1cccc(N)c1NCc2ccccc2 Amb18131493 [0,2,0,0,0,0|2,0,0]=4 1415 B17R2.3933 Cc1cccc(N)c1OCc2ccccc2 Amb26479740 [0,2,0,0,0,0|1,1,0]=4 1416 B17R2.3933 Clc1cccc(Cl)c1CNc2ccccc2 Amb837967 [0,2,0,0,0,0|2,0,0]=4 1417 B17R2.3933 Fc1cccc(Br)c1CNc2ccccc2 Amb33838477 [0,2,0,0,0,0|2,0,0]=4 1418 B17R2.3933 Fc1cccc(Cl)c1CNc2ccccc2 Amb838312 [0,2,0,0,0,0|2,0,0]=4 1419 B17R2.3933 Fc1cccc(Cl)c1NCc2ccccc2 Amb27874642 [0,2,0,0,0,0|2,0,0]=4 1420 B17R2.3933 Fc1cccc(Cl)c1OCc2ccccc2 Amb22228143 [0,2,0,0,0,0|1,1,0]=4 1421 B17R2.3933 Fc1cccc(F)c1NCc2ccccc2 Amb7761108 [0,2,0,0,0,0|2,0,0]=4 1422 B17R2.3933 Fc1cccc(F)c1OCc2ccccc2 Amb26912612 [0,2,0,0,0,0|1,1,0]=4 1423 B17R2.3933 Nc1cccc(Br)c1NCc2ccccc2 Amb35654455 [0,2,0,0,0,0|2,0,0]=4 1424 B17R2.3933 Nc1cccc(Br)c1OCc2ccccc2 Amb26380786 [0,2,0,0,0,0|1,1,0]=4 1425 B17R2.3933 Nc1cccc(Cl)c1OCc2ccccc2 Amb6676068 [0,2,0,0,0,0|1,1,0]=4 1426 B17R2.3933 Nc1cccc(F)c1OCc2ccccc2 Amb24393486 [0,2,0,0,0,0|1,1,0]=4 1427 B17R2.5121 Cc1ccccc1CCc2ccccc2C Amb2701814 [0,2,0,0,0,0|2,0,0]=4 1428 B17R2.5121 Cc1ccccc1CCc2ccccc2N Amb31118104 [0,2,0,0,0,0|2,0,0]=4 1429 B17R2.5121 Cc1ccccc1CNc2ccccc2Br Amb6696359 [0,2,0,0,0,0|2,0,0]=4 1430 B17R2.5121 Cc1ccccc1CNc2ccccc2C Amb6701114 [0,2,0,0,0,0|2,0,0]=4 1431 B17R2.5121 Cc1ccccc1CNc2ccccc2Cl Amb4313318 [0,2,0,0,0,0|2,0,0]=4 1432 B17R2.5121 Cc1ccccc1CNc2ccccc2F Amb6697253 [0,2,0,0,0,0|2,0,0]=4 1433 B17R2.5121 Cc1ccccc1CNc2ccccc2N Amb32712052 [0,2,0,0,0,0|2,0,0]=4 1434 B17R2.5121 Cc1ccccc1COc2ccccc2Br Amb6613202 [0,2,0,0,0,0|1,1,0]=4 1435 B17R2.5121 Cc1ccccc1COc2ccccc2N Amb1113683 [0,2,0,0,0,0|1,1,0]=4 1436 B17R2.5121 Cc1ccccc1CSc2ccccc2N Amb6278456 [0,2,0,0,0,0|1,0,0]=3 1437 B17R2.5121 Cc1ccccc1NCc2ccccc2Cl Amb6701103 [0,2,0,0,0,0|2,0,0]=4 1438 B17R2.5121 Cc1ccccc1NCc2ccccc2F Amb6701225 [0,2,0,0,0,0|2,0,0]=4 1439 B17R2.5121 Cc1ccccc1\C=C\c2ccccc2Cl Amb2609142 [0,2,0,0,0,0|2,0,0]=4 1440 B17R2.5121 Clc1ccccc1CNc2ccccc2Cl Amb4313410 [0,2,0,0,0,0|2,0,0]=4 1441 B17R2.5121 Clc1ccccc1SSc2ccccc2Cl Amb8387521 [0,2,0,0,0,0|0,0,0]=2 1442 B17R2.5121 Clc1ccccc1\C=C\c2ccccc2Cl Amb2608980 [0,2,0,0,0,0|2,0,0]=4 1443 B17R2.5121 Fc1ccccc1CCc2ccccc2F Amb20075849 [0,2,0,0,0,0|2,0,0]=4 1444 B17R2.5121 Fc1ccccc1CNc2ccccc2Cl Amb6696912 [0,2,0,0,0,0|2,0,0]=4 1445 B17R2.5121 Fc1ccccc1CNc2ccccc2F Amb6697373 [0,2,0,0,0,0|2,0,0]=4 1446 B17R2.5121 Fc1ccccc1NCc2ccccc2Cl Amb6697232 [0,2,0,0,0,0|2,0,0]=4 1447 B17R2.5121 Fc1ccccc1SSc2ccccc2F Amb8387520 [0,2,0,0,0,0|0,0,0]=2 1448 B17R2.5121 Nc1ccccc1CCc2ccccc2F Amb31135813 [0,2,0,0,0,0|2,0,0]=4 1449 B17R2.5121 Nc1ccccc1CCc2ccccc2N Amb17701597 [0,2,0,0,0,0|2,0,0]=4 1450 B17R2.5121 Nc1ccccc1CNc2ccccc2N Amb15695095 [0,2,0,0,0,0|2,0,0]=4 1451 B17R2.5121 Nc1ccccc1OCc2ccccc2Cl Amb6662205 [0,2,0,0,0,0|1,1,0]=4 1452 B17R2.5121 Nc1ccccc1OCc2ccccc2F Amb6248717 [0,2,0,0,0,0|1,1,0]=4 1453 B17R2.5121 Nc1ccccc1SCc2ccccc2Cl Amb2092093 [0,2,0,0,0,0|1,0,0]=3 1454 B17R2.5121 Nc1ccccc1SCc2ccccc2Cl Amb2748148 [0,2,0,0,0,0|1,0,0]=3 1455 B17R2.5121 Nc1ccccc1SCc2ccccc2F Amb2092230 [0,2,0,0,0,0|1,0,0]=3 1456 B17R2.5121 Nc1ccccc1SCc2ccccc2F Amb6281419 [0,2,0,0,0,0|1,0,0]=3 1457 B17R2.5121 Nc1ccccc1SSc2ccccc2N Amb2499898 [0,2,0,0,0,0|0,0,0]=2 1458 B17R2.5121 Nc1ccccc1\N=N\c2ccccc2N Amb24080796 [0,2,0,0,0,0|2,0,0]=4 1459 B17R2.5121 Nc1ncccc1SSc2cccnc2N Amb22002417 [0,2,0,0,0,0|2,0,0]=4 1460 B17R2.5121 Oc1ccccc1CCc2ccccc2O Amb17595820 [0,2,0,0,0,0|2,0,0]=4 1461 B17R2.5121 Oc1ccccc1CNc2ccccc2Cl Amb2272479 [0,2,0,0,0,0|2,0,0]=4 1462 B17R2.5121 Oc1ccccc1OCc2ccccc2F Amb8837358 [0,2,0,0,0,0|1,1,0]=4 1463 B17R2.5121 Oc1ccccc1SSc2ccccc2O Amb17596890 [0,2,0,0,0,0|0,0,0]=2 1464 B17R2.5121 Oc1ccccc1\C=N\c2ccccc2O Amb1630662 [0,2,0,0,0,0|2,0,0]=4 1465 B17R2.5121 Oc1ccccc1\C=N\c2ccccc2S Amb3992914 [0,2,0,0,0,0|2,0,0]=4 1466 B17R2.5121 Oc1ccccc1\N=N\c2ccccc2O Amb3940303 [0,2,0,0,0,0|2,0,0]=4 1467 B17R2.5121 [NH3+]c1ccccc1CCc2ccccc2[NH3+] Amb21947789 [0,2,0,0,0,0|2,0,0]=4 1468 B17R2.5121 [NH3+]c1ccccc1\C=C\c2ccccc2[NH3+] Amb17777301 [0,2,0,0,0,0|2,0,0]=4 1469 B17R2.5121 [O-][n+]1ccccc1SSc2cccc[n+]2[O-] Amb9786518 [0,2,0,0,0,0|2,0,0]=4 1470 B17R2.5274 Cc1c(Cl)cccc1NCc2ccccc2 Amb4313274 [0,2,0,0,0,0|2,0,0]=4 1471 B17R2.5274 Cc1c(N)cccc1COc2ccccc2 Amb9369817 [0,2,0,0,0,0|1,1,0]=4 1472 B17R2.5274 Cc1c(N)cccc1NCc2ccccc2 Amb27791510 [0,2,0,0,0,0|2,0,0]=4 1473 B17R2.5274 Cc1c(N)cccc1OCc2ccccc2 Amb2696796 [0,2,0,0,0,0|1,1,0]=4 1474 B17R2.5274 Cc1c(O)cccc1OCc2ccccc2 Amb8837123 [0,2,0,0,0,0|1,1,0]=4 1475 B17R2.5274 Cc1cccc(NCc2ccccc2)c1C Amb6700742 [0,2,0,0,0,0|2,0,0]=4 1476 B17R2.5274 Cc1cccc(NCc2ccccc2)c1F Amb27443455 [0,2,0,0,0,0|2,0,0]=4 1477 B17R2.5274 Cc1cccc(NCc2ccccc2)c1O Amb27798989 [0,2,0,0,0,0|2,0,0]=4 1478 B17R2.5274 Cc1cccc(OCc2ccccc2)c1Br Amb26496779 [0,2,0,0,0,0|1,1,0]=4 1479 B17R2.5274 Cc1cccc(OCc2ccccc2)c1C Amb27168883 [0,2,0,0,0,0|1,1,0]=4 1480 B17R2.5274 Cc1cccc(OCc2ccccc2)c1N Amb35746349 [0,2,0,0,0,0|1,1,0]=4 1481 B17R2.5274 Cc1cccc(OCc2ccccc2)c1N Amb9296564 [0,2,0,0,0,0|1,1,0]=4 1482 B17R2.5274 Clc1c(Br)cccc1NCc2ccccc2 Amb29865339 [0,2,0,0,0,0|2,0,0]=4 1483 B17R2.5274 Clc1c(Br)cccc1OCc2ccccc2 Amb26368722 [0,2,0,0,0,0|1,1,0]=4 1484 B17R2.5274 Clc1cccc(NCc2ccccc2)c1Br Amb27631219 [0,2,0,0,0,0|2,0,0]=4 1485 B17R2.5274 Clc1cccc(OCc2ccccc2)c1Br Amb25128182 [0,2,0,0,0,0|1,1,0]=4 1486 B17R2.5274 Fc1c(Br)cccc1CNc2ccccc2 Amb33830239 [0,2,0,0,0,0|2,0,0]=4 1487 B17R2.5274 Fc1c(Br)cccc1NCc2ccccc2 Amb35615322 [0,2,0,0,0,0|2,0,0]=4 1488 B17R2.5274 Nc1c(Br)cccc1OCc2ccccc2 Amb25768799 [0,2,0,0,0,0|1,1,0]=4 1489 B17R2.5274 Nc1c(Cl)cccc1NCc2ccccc2 Amb27832180 [0,2,0,0,0,0|2,0,0]=4 1490 B17R2.5274 Nc1c(Cl)cccc1OCc2ccccc2 Amb27413374 [0,2,0,0,0,0|1,1,0]=4 1491 B17R2.5274 Nc1c(F)cccc1OCc2ccccc2 Amb18968074 [0,2,0,0,0,0|1,1,0]=4 1492 B17R2.5274 Nc1c(O)cccc1OCc2ccccc2 Amb27446663 [0,2,0,0,0,0|1,1,0]=4 1493 B17R2.5274 Nc1cccc(OCc2ccccc2)c1Cl Amb26535046 [0,2,0,0,0,0|1,1,0]=4 1494 B17R2.5274 Nc1cccc(OCc2ccccc2)c1N Amb18657647 [0,2,0,0,0,0|1,1,0]=4 1495 B17R2.5274 Oc1cccc(NCc2ccccc2)c1O Amb27221122 [0,2,0,0,0,0|2,0,0]=4 1496 B17R2.5274 Oc1cccc(\C=N\c2ccccc2)c1O Amb6344972 [0,2,0,0,0,0|2,0,0]=4 1497 B17R2.5360 Brc1cc(I)ccc1NCc2ccccc2 Amb27637540 [0,2,0,0,0,0|2,0,0]=4 1498 B17R2.5360 Brc1cc(I)ccc1OCc2ccccc2 Amb24372146 [0,2,0,0,0,0|1,1,0]=4 1499 B17R2.5360 Brc1ccc(OCc2ccccc2)c(I)c1 Amb22755774 [0,2,0,0,0,0|1,1,0]=4 1500 B17R2.5360 Cc1cc(Br)ccc1NCc2ccccc2 Amb6690052 [0,2,0,0,0,0|2,0,0]=4 1501 B17R2.5360 Cc1cc(Br)ccc1OCc2ccccc2 Amb19148837 [0,2,0,0,0,0|1,1,0]=4 1502 B17R2.5360 Cc1cc(Cl)ccc1NCc2ccccc2 Amb6641372 [0,2,0,0,0,0|2,0,0]=4 1503 B17R2.5360 Cc1cc(Cl)ccc1OCc2ccccc2 Amb28344007 [0,2,0,0,0,0|1,1,0]=4 1504 B17R2.5360 Cc1cc(N)ccc1OCc2ccccc2 Amb19959348 [0,2,0,0,0,0|1,1,0]=4 1505 B17R2.5360 Cc1cc(N)ccc1OCc2ccccc2 Amb8855868 [0,2,0,0,0,0|1,1,0]=4 1506 B17R2.5360 Cc1cc(O)ccc1OCc2ccccc2 Amb17200691 [0,2,0,0,0,0|1,1,0]=4 1507 B17R2.5360 Cc1ccc(CNc2ccccc2)c(C)c1 Amb6685058 [0,2,0,0,0,0|2,0,0]=4 1508 B17R2.5360 Cc1ccc(NCc2ccccc2)c(Br)c1 Amb6688274 [0,2,0,0,0,0|2,0,0]=4 1509 B17R2.5360 Cc1ccc(NCc2ccccc2)c(C)c1 Amb839002 [0,2,0,0,0,0|2,0,0]=4 1510 B17R2.5360 Cc1ccc(NCc2ccccc2)c(F)c1 Amb7761304 [0,2,0,0,0,0|2,0,0]=4 1511 B17R2.5360 Cc1ccc(OCc2ccccc2)c(Br)c1 Amb6638908 [0,2,0,0,0,0|1,1,0]=4 1512 B17R2.5360 Cc1ccc(OCc2ccccc2)c(I)c1 Amb27443670 [0,2,0,0,0,0|1,1,0]=4 1513 B17R2.5360 Cc1ccc(OCc2ccccc2)c(N)c1 Amb8860093 [0,2,0,0,0,0|1,1,0]=4 1514 B17R2.5360 Clc1cc(Br)ccc1NCc2ccccc2 Amb8858616 [0,2,0,0,0,0|2,0,0]=4 1515 B17R2.5360 Clc1cc(Br)ccc1OCc2ccccc2 Amb20672006 [0,2,0,0,0,0|1,1,0]=4 1516 B17R2.5360 Clc1cc(I)ccc1OCc2ccccc2 Amb28386545 [0,2,0,0,0,0|1,1,0]=4 1517 B17R2.5360 Clc1ccc(CNc2ccccc2)c(Cl)c1 Amb3742830 [0,2,0,0,0,0|2,0,0]=4 1518 B17R2.5360 Clc1ccc(OCc2ccccc2)c(Br)c1 Amb25168726 [0,2,0,0,0,0|1,1,0]=4 1519 B17R2.5360 Clc1ccc(OCc2ccccc2)c(Cl)c1 Amb9682468 [0,2,0,0,0,0|1,1,0]=4 1520 B17R2.5360 Clc1ccc(\C=N\c2ccccc2)c(Cl)c1 Amb24092514 [0,2,0,0,0,0|2,0,0]=4 1521 B17R2.5360 Fc1cc(Br)ccc1OCc2ccccc2 Amb8631468 [0,2,0,0,0,0|1,1,0]=4 1522 B17R2.5360 Fc1cc(Cl)ccc1NCc2ccccc2 Amb9228077 [0,2,0,0,0,0|2,0,0]=4 1523 B17R2.5360 Fc1cc(I)ccc1NCc2ccccc2 Amb35589461 [0,2,0,0,0,0|2,0,0]=4 1524 B17R2.5360 Fc1ccc(NCc2ccccc2)c(F)c1 Amb6698335 [0,2,0,0,0,0|2,0,0]=4 1525 B17R2.5360 Fc1ccc(OCc2ccccc2)c(Br)c1 Amb6665090 [0,2,0,0,0,0|1,1,0]=4 1526 B17R2.5360 Fc1ccc(OCc2ccccc2)c(Cl)c1 Amb20678515 [0,2,0,0,0,0|1,1,0]=4 1527 B17R2.5360 Fc1ccc(OCc2ccccc2)c(F)c1 Amb10766356 [0,2,0,0,0,0|1,1,0]=4 1528 B17R2.5360 Nc1cc(Br)ccc1NCc2ccccc2 Amb7767653 [0,2,0,0,0,0|2,0,0]=4 1529 B17R2.5360 Nc1cc(Br)ccc1OCc2ccccc2 Amb6676066 [0,2,0,0,0,0|1,1,0]=4 1530 B17R2.5360 Nc1cc(Cl)ccc1NCc2ccccc2 Amb2258838 [0,2,0,0,0,0|2,0,0]=4 1531 B17R2.5360 Nc1cc(Cl)ccc1OCc2ccccc2 Amb6540782 [0,2,0,0,0,0|1,1,0]=4 1532 B17R2.5360 Nc1cc(Cl)ccc1OCc2ccccc2 Amb6540868 [0,2,0,0,0,0|1,1,0]=4 1533 B17R2.5360 Nc1cc(Cl)ccc1SCc2ccccc2 Amb6668653 [0,2,0,0,0,0|1,0,0]=3 1534 B17R2.5360 Nc1cc(F)ccc1OCc2ccccc2 Amb32658025 [0,2,0,0,0,0|1,1,0]=4 1535 B17R2.5360 Nc1cc(F)ccc1OCc2ccccc2 Amb6679787 [0,2,0,0,0,0|1,1,0]=4 1536 B17R2.5360 Nc1cc(I)ccc1OCc2ccccc2 Amb24379153 [0,2,0,0,0,0|1,1,0]=4 1537 B17R2.5360 Nc1cc([NH3+])ccc1\N=N\c2ccccc2 Amb21952452 [0,2,0,0,0,0|2,0,0]=4 1538 B17R2.5360 Nc1ccc(NCc2ccccc2)c(Br)c1 Amb25223655 [0,2,0,0,0,0|2,0,0]=4 1539 B17R2.5360 Nc1ccc(NCc2ccccc2)c(Cl)c1 Amb7767656 [0,2,0,0,0,0|2,0,0]=4 1540 B17R2.5360 Nc1ccc(NCc2ccccc2)c(F)c1 Amb7783353 [0,2,0,0,0,0|2,0,0]=4 1541 B17R2.5360 Nc1ccc(OCc2ccccc2)c(Br)c1 Amb22059012 [0,2,0,0,0,0|1,1,0]=4 1542 B17R2.5360 Nc1ccc(OCc2ccccc2)c(Br)c1 Amb33548460 [0,2,0,0,0,0|1,1,0]=4 1543 B17R2.5360 Nc1ccc(OCc2ccccc2)c(Cl)c1 Amb1130066 [0,2,0,0,0,0|1,1,0]=4 1544 B17R2.5360 Nc1ccc(OCc2ccccc2)c(F)c1 Amb7783394 [0,2,0,0,0,0|1,1,0]=4 1545 B17R2.5360 Nc1ccc(OCc2ccccc2)c(F)c1 Amb8630049 [0,2,0,0,0,0|1,1,0]=4 1546 B17R2.5360 Nc1ccc(OCc2ccccc2)c(I)c1 Amb28192586 [0,2,0,0,0,0|1,1,0]=4 1547 B17R2.5360 Nc1ccc(SCc2ccccc2)c(Br)c1 Amb28556376 [0,2,0,0,0,0|1,0,0]=3 1548 B17R2.5360 Nc1ccc(\C=C\c2ccccc2)c(N)c1 Amb17777082 [0,2,0,0,0,0|2,0,0]=4 1549 B17R2.5360 Nc1ccc(\C=C\c2ccccc2)c(N)c1 Amb17777083 [0,2,0,0,0,0|2,0,0]=4 1550 B17R2.5360 Nc1ccc(\C=C\c2ccccc2)c(N)c1 Amb17843030 [0,2,0,0,0,0|2,0,0]=4 1551 B17R2.5360 Nc1ccc(\N=N\c2ccccc2)c(N)c1 Amb6336601 [0,2,0,0,0,0|2,0,0]=4 1552 B17R2.5360 Nc1ccc(\N=N\c2ccccc2)c(N)c1 Amb6366391 [0,2,0,0,0,0|2,0,0]=4 1553 B17R2.5360 Oc1cc(Br)ccc1OCc2ccccc2 Amb26347129 [0,2,0,0,0,0|1,1,0]=4 1554 B17R2.5360 Oc1cc(F)ccc1OCc2ccccc2 Amb27960702 [0,2,0,0,0,0|1,1,0]=4 1555 B17R2.5360 Oc1ccc(NCc2ccccc2)c(Cl)c1 Amb30017174 [0,2,0,0,0,0|2,0,0]=4 1556 B17R2.5360 Oc1ccc(NCc2ccccc2)c(O)c1 Amb27481668 [0,2,0,0,0,0|2,0,0]=4 1557 B17R2.5360 Oc1ccc(OCc2ccccc2)c(Cl)c1 Amb21964645 [0,2,0,0,0,0|1,1,0]=4 1558 B17R2.5360 Oc1ccc(OCc2ccccc2)c(F)c1 Amb2413178 [0,2,0,0,0,0|1,1,0]=4 1559 B17R2.5360 Oc1ccc(OCc2ccccc2)c(I)c1 Amb28066119 [0,2,0,0,0,0|1,1,0]=4 1560 B17R2.5360 Oc1ccc(\N=N\c2ccccc2)c(O)c1 Amb6608989 [0,2,0,0,0,0|2,0,0]=4 1561 B17R2.5365 Brc1ccc(Br)c(OCc2ccccc2)c1 Amb22489992 [0,2,0,0,0,0|1,1,0]=4 1562 B17R2.5365 Brc1ccc(I)c(NCc2ccccc2)c1 Amb27453148 [0,2,0,0,0,0|2,0,0]=4 1563 B17R2.5365 Brc1ccc(I)cc1COc2ccccc2 Amb32414576 [0,2,0,0,0,0|1,1,0]=4 1564 B17R2.5365 Cc1ccc(Br)c(OCc2ccccc2)c1 Amb26535133 [0,2,0,0,0,0|1,1,0]=4 1565 B17R2.5365 Cc1ccc(Br)cc1NCc2ccccc2 Amb9595438 [0,2,0,0,0,0|2,0,0]=4 1566 B17R2.5365 Cc1ccc(Br)cc1OCc2ccccc2 Amb22228642 [0,2,0,0,0,0|1,1,0]=4 1567 B17R2.5365 Cc1ccc(C)c(CNc2ccccc2)c1 Amb17404125 [0,2,0,0,0,0|2,0,0]=4 1568 B17R2.5365 Cc1ccc(C)c(NCc2ccccc2)c1 Amb4313273 [0,2,0,0,0,0|2,0,0]=4 1569 B17R2.5365 Cc1ccc(Cl)c(NCc2ccccc2)c1 Amb27791520 [0,2,0,0,0,0|2,0,0]=4 1570 B17R2.5365 Cc1ccc(Cl)c(OCc2ccccc2)c1 Amb20678879 [0,2,0,0,0,0|1,1,0]=4 1571 B17R2.5365 Cc1ccc(Cl)cc1NCc2ccccc2 Amb838954 [0,2,0,0,0,0|2,0,0]=4 1572 B17R2.5365 Cc1ccc(F)c(OCc2ccccc2)c1 Amb27392047 [0,2,0,0,0,0|1,1,0]=4 1573 B17R2.5365 Cc1ccc(F)cc1OCc2ccccc2 Amb2447362 [0,2,0,0,0,0|1,1,0]=4 1574 B17R2.5365 Cc1ccc(I)cc1OCc2ccccc2 Amb27620993 [0,2,0,0,0,0|1,1,0]=4 1575 B17R2.5365 Cc1ccc(N)c(OCc2ccccc2)c1 Amb21954468 [0,2,0,0,0,0|1,1,0]=4 1576 B17R2.5365 Cc1ccc(N)c(OCc2ccccc2)c1 Amb6263514 [0,2,0,0,0,0|1,1,0]=4 1577 B17R2.5365 Cc1ccc(N)cc1OCc2ccccc2 Amb2608597 [0,2,0,0,0,0|1,1,0]=4 1578 B17R2.5365 Cc1ccc(O)c(NCc2ccccc2)c1 Amb28288325 [0,2,0,0,0,0|2,0,0]=4 1579 B17R2.5365 Cc1ccc(O)c(OCc2ccccc2)c1 Amb27750277 [0,2,0,0,0,0|1,1,0]=4 1580 B17R2.5365 Cc1ccc(O)c(\N=N\c2ccccc2)c1 Amb1351588 [0,2,0,0,0,0|2,0,0]=4 1581 B17R2.5365 Cc1ccc(O)cc1OCc2ccccc2 Amb27802752 [0,2,0,0,0,0|1,1,0]=4 1582 B17R2.5365 Clc1ccc(Br)cc1OCc2ccccc2 Amb21856191 [0,2,0,0,0,0|1,1,0]=4 1583 B17R2.5365 Clc1ccc(I)c(NCc2ccccc2)c1 Amb30016093 [0,2,0,0,0,0|2,0,0]=4 1584 B17R2.5365 Clc1ccc(I)c(OCc2ccccc2)c1 Amb24632187 [0,2,0,0,0,0|1,1,0]=4 1585 B17R2.5365 Fc1ccc(Br)c(OCc2ccccc2)c1 Amb7172556 [0,2,0,0,0,0|1,1,0]=4 1586 B17R2.5365 Fc1ccc(Br)cc1CNc2ccccc2 Amb6685060 [0,2,0,0,0,0|2,0,0]=4 1587 B17R2.5365 Fc1ccc(Br)cc1OCc2ccccc2 Amb22489994 [0,2,0,0,0,0|1,1,0]=4 1588 B17R2.5365 Fc1ccc(F)c(CNc2ccccc2)c1 Amb8945080 [0,2,0,0,0,0|2,0,0]=4 1589 B17R2.5365 Nc1ccc(Br)cc1OCc2ccccc2 Amb22750043 [0,2,0,0,0,0|1,1,0]=4 1590 B17R2.5365 Nc1ccc(Cl)c(OCc2ccccc2)c1 Amb25987896 [0,2,0,0,0,0|1,1,0]=4 1591 B17R2.5365 Nc1ccc(Cl)cc1C#Cc2ccccc2 Amb30634241 [0,2,0,0,0,0|2,0,0]=4 1592 B17R2.5365 Nc1ccc(Cl)cc1OCc2ccccc2 Amb24309267 [0,2,0,0,0,0|1,1,0]=4 1593 B17R2.5365 Nc1ccc(Cl)cc1OCc2ccccc2 Amb33552633 [0,2,0,0,0,0|1,1,0]=4 1594 B17R2.5365 Nc1ccc(F)cc1NCc2ccccc2 Amb18298341 [0,2,0,0,0,0|2,0,0]=4 1595 B17R2.5365 Nc1ccc(F)cc1OCc2ccccc2 Amb1112813 [0,2,0,0,0,0|1,1,0]=4 1596 B17R2.5365 O=C1C=CC(=O)C(COc2ccccc2)=C1 Amb8026395 [0,2,0,0,0,0|1,1,0]=4 1597 B17R2.5365 Oc1ccc(Br)cc1OCc2ccccc2 Amb22054431 [0,2,0,0,0,0|1,1,0]=4 1598 B17R2.5365 Oc1ccc(Br)cc1\C=N\c2ccccc2 Amb2229342 [0,2,0,0,0,0|2,0,0]=4 1599 B17R2.5365 Oc1ccc(Cl)cc1CNc2ccccc2 Amb3547469 [0,2,0,0,0,0|2,0,0]=4 1600 B17R2.5365 Oc1ccc(Cl)cc1\C=N\c2ccccc2 Amb1657501 [0,2,0,0,0,0|2,0,0]=4 1601 B17R2.5365 Oc1ccc(F)c(OCc2ccccc2)c1 Amb34911566 [0,2,0,0,0,0|1,1,0]=4 1602 B17R2.5365 Oc1ccc(I)cc1OCc2ccccc2 Amb22054436 [0,2,0,0,0,0|1,1,0]=4 1603 B17R2.5365 Oc1ccc(O)c(NCc2ccccc2)c1 Amb28208207 [0,2,0,0,0,0|2,0,0]=4 1604 B17R2.5365 Oc1ccc(O)c(OCc2ccccc2)c1 Amb27829024 [0,2,0,0,0,0|1,1,0]=4 1605 B17R2.41893 Cc1cccc(CCc2ccccc2N)c1 Amb31118105 [0,2,0,0,0,0|2,0,0]=4 1606 B17R2.41893 Cc1cccc(CNc2ccccc2Br)c1 Amb6696362 [0,2,0,0,0,0|2,0,0]=4 1607 B17R2.41893 Cc1cccc(CNc2ccccc2C)c1 Amb6701117 [0,2,0,0,0,0|2,0,0]=4 1608 B17R2.41893 Cc1cccc(CNc2ccccc2Cl)c1 Amb4313247 [0,2,0,0,0,0|2,0,0]=4 1609 B17R2.41893 Cc1cccc(CNc2ccccc2F)c1 Amb6697257 [0,2,0,0,0,0|2,0,0]=4 1610 B17R2.41893 Cc1cccc(COc2ccccc2N)c1 Amb1111785 [0,2,0,0,0,0|1,1,0]=4 1611 B17R2.41893 Cc1cccc(CSc2ccccc2N)c1 Amb2149343 [0,2,0,0,0,0|1,0,0]=3 1612 B17R2.41893 Cc1cccc(CSc2ccccc2N)c1 Amb6666828 [0,2,0,0,0,0|1,0,0]=3 1613 B17R2.41893 Cc1cccc(NCc2ccccc2C)c1 Amb6684409 [0,2,0,0,0,0|2,0,0]=4 1614 B17R2.41893 Cc1cccc(NCc2ccccc2Cl)c1 Amb6684399 [0,2,0,0,0,0|2,0,0]=4 1615 B17R2.41893 Cc1cccc(NCc2ccccc2F)c1 Amb6684520 [0,2,0,0,0,0|2,0,0]=4 1616 B17R2.41893 Cc1cccc(NCc2ccccc2O)c1 Amb3545216 [0,2,0,0,0,0|2,0,0]=4 1617 B17R2.41893 Cc1ccccc1CNc2cccc(Br)c2 Amb6696579 [0,2,0,0,0,0|2,0,0]=4 1618 B17R2.41893 Cc1ccccc1CNc2cccc(Cl)c2 Amb6611755 [0,2,0,0,0,0|2,0,0]=4 1619 B17R2.41893 Cc1ccccc1CNc2cccc(F)c2 Amb6695768 [0,2,0,0,0,0|2,0,0]=4 1620 B17R2.41893 Cc1ccccc1COc2cccc(Br)c2 Amb2689356 [0,2,0,0,0,0|1,1,0]=4 1621 B17R2.41893 Cc1ccccc1COc2cccc(N)c2 Amb1118415 [0,2,0,0,0,0|1,1,0]=4 1622 B17R2.41893 Cc1ccccc1COc2cccc(O)c2 Amb8837422 [0,2,0,0,0,0|1,1,0]=4 1623 B17R2.41893 Cc1ccccc1NCc2cccc(Br)c2 Amb6701106 [0,2,0,0,0,0|2,0,0]=4 1624 B17R2.41893 Cc1ccccc1NCc2cccc(Cl)c2 Amb4303631 [0,2,0,0,0,0|2,0,0]=4 1625 B17R2.41893 Cc1ccccc1NCc2cccc(F)c2 Amb6701113 [0,2,0,0,0,0|2,0,0]=4 1626 B17R2.41893 Cc1ccccc1NCc2cccc(O)c2 Amb3539993 [0,2,0,0,0,0|2,0,0]=4 1627 B17R2.41893 Clc1cccc(NCc2ccccc2Cl)c1 Amb6616045 [0,2,0,0,0,0|2,0,0]=4 1628 B17R2.41893 Clc1ccnc(SCc2ccccc2Cl)c1 Amb22236289 [0,2,0,0,0,0|2,0,0]=4 1629 B17R2.41893 Fc1cccc(CNc2ccccc2Cl)c1 Amb6696839 [0,2,0,0,0,0|2,0,0]=4 1630 B17R2.41893 Fc1cccc(CNc2ccccc2F)c1 Amb6697251 [0,2,0,0,0,0|2,0,0]=4 1631 B17R2.41893 Fc1cccc(NCc2ccccc2Cl)c1 Amb6695747 [0,2,0,0,0,0|2,0,0]=4 1632 B17R2.41893 Fc1cccc(NCc2ccccc2F)c1 Amb6695890 [0,2,0,0,0,0|2,0,0]=4 1633 B17R2.41893 Fc1ccccc1CNc2cccc(Cl)c2 Amb6695732 [0,2,0,0,0,0|2,0,0]=4 1634 B17R2.41893 Fc1ccccc1CSc2cc(Cl)ccn2 Amb22236293 [0,2,0,0,0,0|2,0,0]=4 1635 B17R2.41893 Fc1ccccc1NCc2cccc(Cl)c2 Amb4303625 [0,2,0,0,0,0|2,0,0]=4 1636 B17R2.41893 Nc1cccc(COc2ccccc2Cl)c1 Amb22282149 [0,2,0,0,0,0|1,1,0]=4 1637 B17R2.41893 Nc1cccc(COc2ccccc2Cl)c1 Amb6249399 [0,2,0,0,0,0|1,1,0]=4 1638 B17R2.41893 Nc1cccc(COc2ccccc2F)c1 Amb6249325 [0,2,0,0,0,0|1,1,0]=4 1639 B17R2.41893 Nc1cccc(OCc2ccccc2Cl)c1 Amb6244088 [0,2,0,0,0,0|1,1,0]=4 1640 B17R2.41893 Nc1cccc(OCc2ccccc2F)c1 Amb5559923 [0,2,0,0,0,0|1,1,0]=4 1641 B17R2.41893 Nc1ccccc1CCc2cccc(Br)c2 Amb31122481 [0,2,0,0,0,0|2,0,0]=4 1642 B17R2.41893 Nc1ccccc1CCc2cccc(F)c2 Amb31135814 [0,2,0,0,0,0|2,0,0]=4 1643 B17R2.41893 Nc1ccccc1OCc2cccc(Br)c2 Amb1138739 [0,2,0,0,0,0|1,1,0]=4 1644 B17R2.41893 Nc1ccccc1OCc2cccc(Cl)c2 Amb6660312 [0,2,0,0,0,0|1,1,0]=4 1645 B17R2.41893 Nc1ccccc1OCc2cccc(F)c2 Amb1121098 [0,2,0,0,0,0|1,1,0]=4 1646 B17R2.41893 Nc1ccccc1SCc2cccc(Cl)c2 Amb2092094 [0,2,0,0,0,0|1,0,0]=3 1647 B17R2.41893 Nc1ccccc1SCc2cccc(F)c2 Amb2092232 [0,2,0,0,0,0|1,0,0]=3 1648 B17R2.41893 Oc1cccc(CNc2ccccc2Br)c1 Amb6696449 [0,2,0,0,0,0|2,0,0]=4 1649 B17R2.41893 Oc1cccc(CNc2ccccc2Cl)c1 Amb6696909 [0,2,0,0,0,0|2,0,0]=4 1650 B17R2.41893 Oc1cccc(CNc2ccccc2F)c1 Amb6697367 [0,2,0,0,0,0|2,0,0]=4 1651 B17R2.41893 Oc1cccc(OCc2ccccc2Cl)c1 Amb8837450 [0,2,0,0,0,0|1,1,0]=4 1652 B17R2.41893 Oc1cccc(OCc2ccccc2F)c1 Amb8837465 [0,2,0,0,0,0|1,1,0]=4 1653 B17R2.41893 Oc1ccccc1CNc2cccc(Br)c2 Amb2618408 [0,2,0,0,0,0|2,0,0]=4 1654 B17R2.41893 Oc1ccccc1CNc2cccc(Cl)c2 Amb4020615 [0,2,0,0,0,0|2,0,0]=4 1655 B17R2.41893 Oc1ccccc1CNc2cccc(F)c2 Amb6695803 [0,2,0,0,0,0|2,0,0]=4 1656 B17R2.41893 Oc1ccccc1OCc2cccc(F)c2 Amb8837334 [0,2,0,0,0,0|1,1,0]=4 1657 B17R2.41893 Oc1ccccc1\C=N\c2cccc(Br)c2 Amb4008553 [0,2,0,0,0,0|2,0,0]=4 1658 B17R2.41893 Oc1ccccc1\C=N\c2cccc(Cl)c2 Amb4035435 [0,2,0,0,0,0|2,0,0]=4 1659 B17R2.162 CCN(Cc1ccccc1)c2ccccc2 Amb6357108 [0,2,0,0,0,0|2,0,0]=4 1660 B17R2.162 CNC(Cc1ccccc1)c2ccccc2 Amb3939423 [0,2,0,0,0,0|2,0,0]=4 1661 B17R2.162 N#CC(Cc1ccccc1)c2ccccc2 Amb2761506 [0,2,0,0,0,0|2,0,0]=4 1662 B17R2.162 N#CC(Nc1ccccc1)c2ccccc2 Amb2387118 [0,2,0,0,0,0|2,0,0]=4 1663 B17R2.162 N#C\C(=C\c1ccccc1)c2ccccc2 Amb2721080 [0,2,0,0,0,0|2,0,0]=4 1664 B17R2.162 N#C\C(=N/c1ccccc1)c2ccccc2 Amb17595514 [0,2,0,0,0,0|2,0,0]=4 1665 B17R2.162 NCC(Cc1ccccc1)c2ccccc2 Amb5733600 [0,2,0,0,0,0|2,0,0]=4 1666 B17R2.162 NCC(Nc1ccccc1)c2ccccc2 Amb17404194 [0,2,0,0,0,0|2,0,0]=4 1667 B17R2.162 NCC(Oc1ccccc1)c2ccccc2 Amb17077703 [0,2,0,0,0,0|1,1,0]=4 1668 B17R2.162 NCC(Oc1ccccc1)c2ccccc2 Amb3433826 [0,2,0,0,0,0|1,1,0]=4 1669 B17R2.162 O=CC(Cc1ccccc1)c2ccccc2 Amb5749234 [0,2,0,0,0,0|2,0,0]=4 1670 B17R2.162 O=CN(Cc1ccccc1)c2ccccc2 Amb27611605 [0,2,0,0,0,0|2,0,0]=4 1671 B17R2.162 O=C\C(=C\c1ccccc1)c2ccccc2 Amb9826098 [0,2,0,0,0,0|2,0,0]=4 1672 B17R2.162 OCC(Cc1ccccc1)c2ccccc2 Amb4035768 [0,2,0,0,0,0|2,0,0]=4 1673 B17R2.162 OCC(Nc1ccccc1)c2ccccc2 Amb19008888 [0,2,0,0,0,0|2,0,0]=4 1674 B17R2.162 OC[C@@H](Nc1ccccc1)c2ccccc2 Amb2700535 [0,2,0,0,0,0|2,0,0]=4 1675 B17R2.162 OC[C@H](Nc1ccccc1)c2ccccc2 Amb28556797 [0,2,0,0,0,0|2,0,0]=4 1676 B17R2.162 O\N=C(/Cc1ccccc1)c2ccccc2 Amb10975748 [0,2,0,0,0,0|2,0,0]=4 1677 B17R2.192 CC(Nc1ccccc1)c2ccc(Cl)cc2 Amb9739094 [0,2,0,0,0,0|2,0,0]=4 1678 B17R2.192 CC(Sc1ccccc1)c2ccc(N)cc2 Amb20629414 [0,2,0,0,0,0|1,0,0]=3 1679 B17R2.192 CC(Sc1ccccc1)c2ccc(N)cc2 Amb22058906 [0,2,0,0,0,0|1,0,0]=3 1680 B17R2.192 CN(Cc1ccccc1)c2ccc(Br)cc2 Amb28138525 [0,2,0,0,0,0|2,0,0]=4 1681 B17R2.192 CN(Cc1ccccc1)c2ccc(N)cc2 Amb6249305 [0,2,0,0,0,0|2,0,0]=4 1682 B17R2.192 Cc1ccc(C(=O)Cc2ccccc2)cc1 Amb2221620 [0,2,0,0,0,0|2,0,0]=4 1683 B17R2.192 Cc1ccc(C(=S)Sc2ccccc2)cc1 Amb2609086 [0,2,0,0,0,0|1,0,0]=3 1684 B17R2.192 Cc1ccc(C(N)Cc2ccccc2)cc1 Amb5736373 [0,2,0,0,0,0|2,0,0]=4 1685 B17R2.192 Cc1ccc(C(O)Cc2ccccc2)cc1 Amb17241192 [0,2,0,0,0,0|2,0,0]=4 1686 B17R2.192 NC(Cc1ccccc1)c2ccc(Cl)cc2 Amb10610122 [0,2,0,0,0,0|2,0,0]=4 1687 B17R2.192 NC(Cc1ccccc1)c2ccc(Cl)cc2 Amb5736382 [0,2,0,0,0,0|2,0,0]=4 1688 B17R2.192 NC(Cc1ccccc1)c2ccc(F)cc2 Amb5736375 [0,2,0,0,0,0|2,0,0]=4 1689 B17R2.192 N\C(=N/c1ccccc1)c2ccc(N)cc2 Amb32663773 [0,2,0,0,0,0|2,0,0]=4 1690 B17R2.192 Nc1ccc(C(=O)Cc2ccccc2)cc1 Amb17101651 [0,2,0,0,0,0|2,0,0]=4 1691 B17R2.192 Nc1ccc(C(=O)Nc2ccccc2)cc1 Amb6447151 [0,2,0,0,0,0|2,0,0]=4 1692 B17R2.192 Nc1ccc(C(=O)Oc2ccccc2)cc1 Amb6318092 [0,2,0,0,0,0|1,1,0]=4 1693 B17R2.192 Nc1ccc(C(O)Cc2ccccc2)cc1 Amb17101769 [0,2,0,0,0,0|2,0,0]=4 1694 B17R2.192 Nc1ccc(S(=O)Nc2ccccc2)cc1 Amb18227986 [0,2,0,0,0,0|1,0,1]=4 1695 B17R2.192 O=C(Cc1ccccc1)c2ccc(Br)cc2 Amb534181 [0,2,0,0,0,0|2,0,0]=4 1696 B17R2.192 O=C(Cc1ccccc1)c2ccc(Cl)cc2 Amb2610540 [0,2,0,0,0,0|2,0,0]=4 1697 B17R2.192 O=C(Cc1ccccc1)c2ccc(F)cc2 Amb534905 [0,2,0,0,0,0|2,0,0]=4 1698 B17R2.192 O=C(Cc1ccccc1)c2ccc(I)cc2 Amb6301911 [0,2,0,0,0,0|2,0,0]=4 1699 B17R2.192 O=C(Cc1ccccc1)c2ccc(O)cc2 Amb535082 [0,2,0,0,0,0|2,0,0]=4 1700 B17R2.192 O=C(Nc1ccccc1)c2ccc(Br)cc2 Amb1212859 [0,2,0,0,0,0|2,0,0]=4 1701 B17R2.192 O=C(Nc1ccccc1)c2ccc(Cl)cc2 Amb6364930 [0,2,0,0,0,0|2,0,0]=4 1702 B17R2.192 O=C(Nc1ccccc1)c2ccc(O)cc2 Amb1304779 [0,2,0,0,0,0|2,0,0]=4 1703 B17R2.192 O=C(Oc1ccccc1)c2ccc(Br)cc2 Amb2563670 [0,2,0,0,0,0|1,1,0]=4 1704 B17R2.192 O=C(Oc1ccccc1)c2ccc(O)cc2 Amb2690291 [0,2,0,0,0,0|1,1,0]=4 1705 B17R2.192 OC(Cc1ccccc1)c2ccc(Br)cc2 Amb18036245 [0,2,0,0,0,0|2,0,0]=4 1706 B17R2.192 OC(Cc1ccccc1)c2ccc(Cl)cc2 Amb17250539 [0,2,0,0,0,0|2,0,0]=4 1707 B17R2.192 OC(Cc1ccccc1)c2ccc(F)cc2 Amb17242250 [0,2,0,0,0,0|2,0,0]=4 1708 B17R2.209 CC(Nc1ccc(Br)cc1)c2ccccc2 Amb6696500 [0,2,0,0,0,0|2,0,0]=4 1709 B17R2.209 CC(Nc1ccc(N)cc1)c2ccccc2 Amb7767586 [0,2,0,0,0,0|2,0,0]=4 1710 B17R2.209 CC(Oc1ccc(N)cc1)c2ccccc2 Amb6676330 [0,2,0,0,0,0|1,1,0]=4 1711 B17R2.209 CN(Cc1ccc(N)cc1)c2ccccc2 Amb1119268 [0,2,0,0,0,0|2,0,0]=4 1712 B17R2.209 C\C(=N\c1ccc(Cl)cc1)c2ccccc2 Amb2610219 [0,2,0,0,0,0|2,0,0]=4 1713 B17R2.209 Cc1ccc(CC(=O)c2ccccc2)cc1 Amb6301929 [0,2,0,0,0,0|2,0,0]=4 1714 B17R2.209 Cc1ccc(CC(N)c2ccccc2)cc1 Amb3940067 [0,2,0,0,0,0|2,0,0]=4 1715 B17R2.209 Cc1ccc(CC(O)c2ccccc2)cc1 Amb17241187 [0,2,0,0,0,0|2,0,0]=4 1716 B17R2.209 Cc1ccc(NC(=O)c2ccccc2)cc1 Amb33533893 [0,2,0,0,0,0|2,0,0]=4 1717 B17R2.209 Cc1ccc(OC(=O)c2ccccc2)cc1 Amb2389285 [0,2,0,0,0,0|1,1,0]=4 1718 B17R2.209 Cc1ccc(\N=C(/N)c2ccccc2)cc1 Amb4292878 [0,2,0,0,0,0|2,0,0]=4 1719 B17R2.209 Fc1ccc(CC(Br)c2ccccc2)cc1 Amb29845397 [0,2,0,0,0,0|2,0,0]=4 1720 B17R2.209 NC(Cc1ccc(Cl)cc1)c2ccccc2 Amb10609790 [0,2,0,0,0,0|2,0,0]=4 1721 B17R2.209 NC(Cc1ccc(Cl)cc1)c2ccccc2 Amb5736691 [0,2,0,0,0,0|2,0,0]=4 1722 B17R2.209 NC(Cc1ccc(F)cc1)c2ccccc2 Amb9717657 [0,2,0,0,0,0|2,0,0]=4 1723 B17R2.209 N\C(=N/c1ccc(Cl)cc1)c2ccccc2 Amb2602399 [0,2,0,0,0,0|2,0,0]=4 1724 B17R2.209 Nc1ccc(NC(=O)c2ccccc2)cc1 Amb6336058 [0,2,0,0,0,0|2,0,0]=4 1725 B17R2.209 Nc1ccc(OC(=O)c2ccccc2)cc1 Amb18131547 [0,2,0,0,0,0|1,1,0]=4 1726 B17R2.209 O=C(Cc1ccc(Br)cc1)c2ccccc2 Amb3941056 [0,2,0,0,0,0|2,0,0]=4 1727 B17R2.209 O=C(Cc1ccc(Cl)cc1)c2ccccc2 Amb1570222 [0,2,0,0,0,0|2,0,0]=4 1728 B17R2.209 O=C(Cc1ccc(F)cc1)c2ccccc2 Amb6301925 [0,2,0,0,0,0|2,0,0]=4 1729 B17R2.209 O=C(Nc1ccc(Br)cc1)c2ccccc2 Amb6367465 [0,2,0,0,0,0|2,0,0]=4 1730 B17R2.209 O=C(Nc1ccc(F)cc1)c2ccccc2 Amb6347160 [0,2,0,0,0,0|2,0,0]=4 1731 B17R2.209 O=C(Nc1ccc(I)cc1)c2ccccc2 Amb6540614 [0,2,0,0,0,0|2,0,0]=4 1732 B17R2.209 O=C(Nc1ccc(O)cc1)c2ccccc2 Amb1819644 [0,2,0,0,0,0|2,0,0]=4 1733 B17R2.209 O=C(Oc1ccc(Br)cc1)c2ccccc2 Amb6870955 [0,2,0,0,0,0|1,1,0]=4 1734 B17R2.209 O=C(Oc1ccc(Cl)cc1)c2ccccc2 Amb6343698 [0,2,0,0,0,0|1,1,0]=4 1735 B17R2.209 O=C(Oc1ccc(O)cc1)c2ccccc2 Amb4019719 [0,2,0,0,0,0|1,1,0]=4 1736 B17R2.209 OC(Cc1ccc(Cl)cc1)c2ccccc2 Amb17250531 [0,2,0,0,0,0|2,0,0]=4 1737 B17R2.209 OC(Cc1ccc(F)cc1)c2ccccc2 Amb17242243 [0,2,0,0,0,0|2,0,0]=4 1738 B17R2.209 S=C(Nc1ccc(Cl)cc1)c2ccccc2 Amb2608987 [0,2,0,0,0,0|2,0,0]=4 1739 B17R2.209 [O-]\[N+](=C/c1ccc(Cl)cc1)c2ccccc2 Amb2612090 [0,2,0,0,0,0|2,0,0]=4 1740 B17R2.5273 CN(Cc1ccccc1)c2cccc(Cl)c2 Amb8629392 [0,2,0,0,0,0|2,0,0]=4 1741 B17R2.5273 CN(Cc1ccccc1)c2cccc(N)c2 Amb8825408 [0,2,0,0,0,0|2,0,0]=4 1742 B17R2.5273 Cc1cccc(C(=O)Cc2ccccc2)c1 Amb6301913 [0,2,0,0,0,0|2,0,0]=4 1743 B17R2.5273 Cc1cccc(C(=O)Nc2ccccc2)c1 Amb3360913 [0,2,0,0,0,0|2,0,0]=4 1744 B17R2.5273 Cc1cccc(C(N)Cc2ccccc2)c1 Amb5736372 [0,2,0,0,0,0|2,0,0]=4 1745 B17R2.5273 Cc1cccc(C(O)Cc2ccccc2)c1 Amb17241191 [0,2,0,0,0,0|2,0,0]=4 1746 B17R2.5273 NC(Cc1ccccc1)c2cccc(Cl)c2 Amb5736381 [0,2,0,0,0,0|2,0,0]=4 1747 B17R2.5273 Nc1cccc(C(=O)Cc2ccccc2)c1 Amb17339671 [0,2,0,0,0,0|2,0,0]=4 1748 B17R2.5273 Nc1cccc(C(=O)Nc2ccccc2)c1 Amb6447152 [0,2,0,0,0,0|2,0,0]=4 1749 B17R2.5273 Nc1cccc(\[N+]([O-])=N\c2ccccc2)c1 Amb17843266 [0,2,0,0,0,0|2,0,0]=4 1750 B17R2.5273 O=C(Cc1ccccc1)c2cccc(Br)c2 Amb3941063 [0,2,0,0,0,0|2,0,0]=4 1751 B17R2.5273 O=C(Cc1ccccc1)c2cccc(Cl)c2 Amb6301908 [0,2,0,0,0,0|2,0,0]=4 1752 B17R2.5273 O=C(Cc1ccccc1)c2cccc(I)c2 Amb6301910 [0,2,0,0,0,0|2,0,0]=4 1753 B17R2.5273 O=C(Nc1ccccc1)c2cccc(Br)c2 Amb1852030 [0,2,0,0,0,0|2,0,0]=4 1754 B17R2.5273 O=C(Nc1ccccc1)c2cccc(Cl)c2 Amb6340869 [0,2,0,0,0,0|2,0,0]=4 1755 B17R2.5273 O=C(Nc1ccccc1)c2cccc(F)c2 Amb6397729 [0,2,0,0,0,0|2,0,0]=4 1756 B17R2.5273 O=C(Nc1ccccc1)c2cccc(O)c2 Amb6671449 [0,2,0,0,0,0|2,0,0]=4 1757 B17R2.5273 O=C(Oc1ccccc1)c2cccc(O)c2 Amb6298473 [0,2,0,0,0,0|1,1,0]=4 1758 B17R2.5273 OC(Cc1ccccc1)c2cccc(Br)c2 Amb17279931 [0,2,0,0,0,0|2,0,0]=4 1759 B17R2.5273 OC(Cc1ccccc1)c2cccc(Cl)c2 Amb17250538 [0,2,0,0,0,0|2,0,0]=4 1760 B17R2.5293 CC(Oc1cccc(N)c1)c2ccccc2 Amb18111929 [0,2,0,0,0,0|1,1,0]=4 1761 B17R2.5293 CN(Cc1cccc(Br)c1)c2ccccc2 Amb33276209 [0,2,0,0,0,0|2,0,0]=4 1762 B17R2.5293 CN(Cc1cccc(N)c1)c2ccccc2 Amb6248267 [0,2,0,0,0,0|2,0,0]=4 1763 B17R2.5293 Cc1cccc(CC(=O)c2ccccc2)c1 Amb6301928 [0,2,0,0,0,0|2,0,0]=4 1764 B17R2.5293 Cc1cccc(CC(Cl)c2ccccc2)c1 Amb2794065 [0,2,0,0,0,0|2,0,0]=4 1765 B17R2.5293 Cc1cccc(CC(N)c2ccccc2)c1 Amb5736424 [0,2,0,0,0,0|2,0,0]=4 1766 B17R2.5293 Cc1cccc(CC(O)c2ccccc2)c1 Amb17241186 [0,2,0,0,0,0|2,0,0]=4 1767 B17R2.5293 Cc1cccc(NC(=N)c2ccccc2)c1 Amb19149181 [0,2,0,0,0,0|2,0,0]=4 1768 B17R2.5293 Cc1cccc(NC(=O)c2ccccc2)c1 Amb6317805 [0,2,0,0,0,0|2,0,0]=4 1769 B17R2.5293 NC(Cc1cccc(Cl)c1)c2ccccc2 Amb5736664 [0,2,0,0,0,0|2,0,0]=4 1770 B17R2.5293 NC(Cc1cccc(O)c1)c2ccccc2 Amb18300564 [0,2,0,0,0,0|2,0,0]=4 1771 B17R2.5293 NC(Cc1cccc(O)c1)c2ccccc2 Amb33549620 [0,2,0,0,0,0|2,0,0]=4 1772 B17R2.5293 Nc1cccc(CS(=O)c2ccccc2)c1 Amb18977539 [0,2,0,0,0,0|1,0,1]=4 1773 B17R2.5293 Nc1cccc(NC(=O)c2ccccc2)c1 Amb6315785 [0,2,0,0,0,0|2,0,0]=4 1774 B17R2.5293 O=C(Cc1cccc(Br)c1)c2ccccc2 Amb3941064 [0,2,0,0,0,0|2,0,0]=4 1775 B17R2.5293 O=C(Cc1cccc(Cl)c1)c2ccccc2 Amb6301926 [0,2,0,0,0,0|2,0,0]=4 1776 B17R2.5293 O=C(Nc1cccc(Br)c1)c2ccccc2 Amb6399038 [0,2,0,0,0,0|2,0,0]=4 1777 B17R2.5293 O=C(Nc1cccc(O)c1)c2ccccc2 Amb1790104 [0,2,0,0,0,0|2,0,0]=4 1778 B17R2.5293 O=C(Oc1cccc(Br)c1)c2ccccc2 Amb22263914 [0,2,0,0,0,0|1,1,0]=4 1779 B17R2.5293 O=C(Oc1cccc(O)c1)c2ccccc2 Amb8516774 [0,2,0,0,0,0|1,1,0]=4 1780 B17R2.5293 OC(Cc1cccc(Cl)c1)c2ccccc2 Amb17250530 [0,2,0,0,0,0|2,0,0]=4 1781 B17R2.5293 S=C(Cc1cccc(Cl)c1)c2ccccc2 Amb24308869 [0,2,0,0,0,0|2,0,0]=4 1782 B17R2.5293 S=C(Nc1cccc(Cl)c1)c2ccccc2 Amb2611262 [0,2,0,0,0,0|2,0,0]=4 1783 B17R2.10205 BrC(c1ccccc1)C(Br)c2ccccc2 Amb2721555 [0,2,0,0,0,0|2,0,0]=4 1784 B17R2.10205 Br[C@@H](c1ccccc1)[C@H](Br)c2ccccc2 Amb28463678 [0,2,0,0,0,0|2,0,0]=4 1785 B17R2.10205 Br\C(=C(\Br)c1ccccc1)c2ccccc2 Amb17777191 [0,2,0,0,0,0|2,0,0]=4 1786 B17R2.10205 CC(C(=O)c1ccccc1)c2ccccc2 Amb4036456 [0,2,0,0,0,0|2,0,0]=4 1787 B17R2.10205 CC(c1ccccc1)C(C)c2ccccc2 Amb2385896 [0,2,0,0,0,0|2,0,0]=4 1788 B17R2.10205 CN(C(=O)c1ccccc1)c2ccccc2 Amb6347163 [0,2,0,0,0,0|2,0,0]=4 1789 B17R2.10205 C\C(=C(/C)c1ccccc1)c2ccccc2 Amb2389676 [0,2,0,0,0,0|2,0,0]=4 1790 B17R2.10205 FC(c1ccccc1)C(F)c2ccccc2 Amb22547455 [0,2,0,0,0,0|2,0,0]=4 1791 B17R2.10205 F\C(=C(\F)c1ccccc1)c2ccccc2 Amb13952904 [0,2,0,0,0,0|2,0,0]=4 1792 B17R2.10205 NC(C(=O)c1ccccc1)c2ccccc2 Amb17939052 [0,2,0,0,0,0|2,0,0]=4 1793 B17R2.10205 NC(C(=O)c1ccccc1)c2ccccc2 Amb19373676 [0,2,0,0,0,0|2,0,0]=4 1794 B17R2.10205 NC(c1ccccc1)C(N)c2ccccc2 Amb8385081 [0,2,0,0,0,0|2,0,0]=4 1795 B17R2.10205 NC(c1ccccc1)C(O)c2ccccc2 Amb21984437 [0,2,0,0,0,0|2,0,0]=4 1796 B17R2.10205 NC(c1ccccc1)C(O)c2ccccc2 Amb2699027 [0,2,0,0,0,0|2,0,0]=4 1797 B17R2.10205 NN(C(=O)c1ccccc1)c2ccccc2 Amb3998357 [0,2,0,0,0,0|2,0,0]=4 1798 B17R2.10205 N[C@@H](c1ccccc1)[C@@H](N)c2ccccc2 Amb2687665 [0,2,0,0,0,0|2,0,0]=4 1799 B17R2.10205 N[C@@H](c1ccccc1)[C@@H](N)c2ccccc2 Amb33714403 [0,2,0,0,0,0|2,0,0]=4 1800 B17R2.10205 N[C@@H](c1ccccc1)[C@@H](O)c2ccccc2 Amb6306842 [0,2,0,0,0,0|2,0,0]=4 1801 B17R2.10205 N[C@@H](c1ccccc1)[C@H](N)c2ccccc2 Amb1093402 [0,2,0,0,0,0|2,0,0]=4 1802 B17R2.10205 N[C@@H](c1ccccc1)[C@H](O)c2ccccc2 Amb8628456 [0,2,0,0,0,0|2,0,0]=4 1803 B17R2.10205 N[C@H](c1ccccc1)[C@@H](O)c2ccccc2 Amb17779637 [0,2,0,0,0,0|2,0,0]=4 1804 B17R2.10205 N[C@H](c1ccccc1)[C@H](N)c2ccccc2 Amb2687664 [0,2,0,0,0,0|2,0,0]=4 1805 B17R2.10205 N[C@H](c1ccccc1)[C@H](O)c2ccccc2 Amb6306843 [0,2,0,0,0,0|2,0,0]=4 1806 B17R2.10205 N\C(=C(/N)c1ccccc1)c2ccccc2 Amb17777246 [0,2,0,0,0,0|2,0,0]=4 1807 B17R2.10205 O=C(C(=O)c1ccccc1)c2ccccc2 Amb2388293 [0,2,0,0,0,0|2,0,0]=4 1808 B17R2.10205 O=C(c1ccccc1)C(Br)c2ccccc2 Amb2792465 [0,2,0,0,0,0|2,0,0]=4 1809 B17R2.10205 O=C(c1ccccc1)C(Cl)c2ccccc2 Amb1676617 [0,2,0,0,0,0|2,0,0]=4 1810 B17R2.10205 O=C(c1ccccc1)C(O)c2ccccc2 Amb9703088 [0,2,0,0,0,0|2,0,0]=4 1811 B17R2.10205 O=C(c1ccccc1)N(O)c2ccccc2 Amb6364934 [0,2,0,0,0,0|2,0,0]=4 1812 B17R2.10205 OC(c1ccccc1)C(O)c2ccccc2 Amb2609048 [0,2,0,0,0,0|2,0,0]=4 1813 B17R2.10205 O[C@@H](c1ccccc1)[C@@H](O)c2ccccc2 Amb6356700 [0,2,0,0,0,0|2,0,0]=4 1814 B17R2.10205 O[C@H](c1ccccc1)[C@H](O)c2ccccc2 Amb2388291 [0,2,0,0,0,0|2,0,0]=4 1815 B17R2.10205 [NH3+]\C(=C(\[NH3+])c1ccccc1)c2ccccc2 Amb17777298 [0,2,0,0,0,0|2,0,0]=4 1816 B17R2.20249 CC(N)(Cc1ccccc1)c2ccccc2 Amb32663716 [0,2,0,0,0,0|2,0,0]=4 1817 B17R2.20249 CC(N)(Cc1ccccc1)c2ccccc2 Amb9781831 [0,2,0,0,0,0|2,0,0]=4 1818 B17R2.20249 CC(O)(Cc1ccccc1)c2ccccc2 Amb6356847 [0,2,0,0,0,0|2,0,0]=4 1819 B17R2.20249 C[N+](C)(Cc1ccccc1)c2ccccc2 Amb4008644 [0,2,0,0,0,0|2,0,0]=4 1820 B17R2.20249 C[P@@+]([O-])(Cc1ccccc1)c2ccccc2 Amb17844213 [0,2,0,0,0,0|2,0,0]=4 1821 B17R2.20249 NP(=O)(Oc1ccccc1)c2ccccc2 Amb17779469 [0,2,0,0,0,0|1,1,0]=4 1822 B17R2.20249 O=S(=O)(Cc1ccccc1)c2ccccc2 Amb2684671 [0,2,0,0,0,0|1,0,1]=4 1823 B17R2.20249 O=S(=O)(Nc1ccccc1)c2ccccc2 Amb1538809 [0,2,0,0,0,0|1,0,1]=4 1824 B17R2.20249 O=S(=O)(Sc1ccccc1)c2ccccc2 Amb9809846 [0,2,0,0,0,0|0,0,1]=3 1825 B17R2.20249 O=S(=O)([Se]c1ccccc1)c2ccccc2 Amb24054311 [0,2,0,0,0,0|0,1,1]=4 1826 B17R2.48 BrCc1ccc(OCc2ccccc2)cc1 Amb8835462 [0,2,0,0,0,0|1,1,0]=4 1827 B17R2.48 C#Cc1ccc(OCc2ccccc2)cc1 Amb2413200 [0,2,0,0,0,0|1,1,0]=4 1828 B17R2.48 C=Cc1ccc(OCc2ccccc2)cc1 Amb24570123 [0,2,0,0,0,0|1,1,0]=4 1829 B17R2.48 CCc1ccc(CNc2ccccc2)cc1 Amb837896 [0,2,0,0,0,0|2,0,0]=4 1830 B17R2.48 CCc1ccc(NCc2ccccc2)cc1 Amb837976 [0,2,0,0,0,0|2,0,0]=4 1831 B17R2.48 CNc1ccc(OCc2ccccc2)cc1 Amb24186941 [0,2,0,0,0,0|1,1,0]=4 1832 B17R2.48 CNc1ccc(\N=N\c2ccccc2)cc1 Amb22732523 [0,2,0,0,0,0|2,0,0]=4 1833 B17R2.48 COc1ccc(C#Cc2ccccc2)cc1 Amb2227471 [0,2,0,0,0,0|2,0,0]=4 1834 B17R2.48 COc1ccc(CNc2ccccc2)cc1 Amb1017320 [0,2,0,0,0,0|2,0,0]=4 1835 B17R2.48 COc1ccc(COc2ccccc2)cc1 Amb24064723 [0,2,0,0,0,0|1,1,0]=4 1836 B17R2.48 COc1ccc(NCc2ccccc2)cc1 Amb1233294 [0,2,0,0,0,0|2,0,0]=4 1837 B17R2.48 COc1ccc(OCc2ccccc2)cc1 Amb1837932 [0,2,0,0,0,0|1,1,0]=4 1838 B17R2.48 COc1ccc(\C=C\c2ccccc2)cc1 Amb1011762 [0,2,0,0,0,0|2,0,0]=4 1839 B17R2.48 COc1ccc(\C=N\c2ccccc2)cc1 Amb1262806 [0,2,0,0,0,0|2,0,0]=4 1840 B17R2.48 COc1ccc(\N=C\c2ccccc2)cc1 Amb6358468 [0,2,0,0,0,0|2,0,0]=4 1841 B17R2.48 COc1ccc(\N=N\c2ccccc2)cc1 Amb9786743 [0,2,0,0,0,0|2,0,0]=4 1842 B17R2.48 CSc1ccc(CNc2ccccc2)cc1 Amb6719501 [0,2,0,0,0,0|2,0,0]=4 1843 B17R2.48 ClCc1ccc(NCc2ccccc2)cc1 Amb27816136 [0,2,0,0,0,0|2,0,0]=4 1844 B17R2.48 ClCc1ccc(OCc2ccccc2)cc1 Amb2719845 [0,2,0,0,0,0|1,1,0]=4 1845 B17R2.48 ClCc1ccc(\C=C\c2ccccc2)cc1 Amb29523006 [0,2,0,0,0,0|2,0,0]=4 1846 B17R2.48 N#Cc1ccc(C#Cc2ccccc2)cc1 Amb2724631 [0,2,0,0,0,0|2,0,0]=4 1847 B17R2.48 N#Cc1ccc(CNc2ccccc2)cc1 Amb6685128 [0,2,0,0,0,0|2,0,0]=4 1848 B17R2.48 N#Cc1ccc(CSc2ccccc2)cc1 Amb4137246 [0,2,0,0,0,0|1,0,0]=3 1849 B17R2.48 N#Cc1ccc(NCc2ccccc2)cc1 Amb6679365 [0,2,0,0,0,0|2,0,0]=4 1850 B17R2.48 N#Cc1ccc(OCc2ccccc2)cc1 Amb2725166 [0,2,0,0,0,0|1,1,0]=4 1851 B17R2.48 N#Cc1ccc(SCc2ccccc2)cc1 Amb2682493 [0,2,0,0,0,0|1,0,0]=3 1852 B17R2.48 NCc1ccc(CCc2ccccc2)cc1 Amb17101792 [0,2,0,0,0,0|2,0,0]=4 1853 B17R2.48 NCc1ccc(COc2ccccc2)cc1 Amb1137568 [0,2,0,0,0,0|1,1,0]=4 1854 B17R2.48 NCc1ccc(COc2ccccc2)cc1 Amb7969879 [0,2,0,0,0,0|1,1,0]=4 1855 B17R2.48 NCc1ccc(OCc2ccccc2)cc1 Amb1117944 [0,2,0,0,0,0|1,1,0]=4 1856 B17R2.48 NCc1ccc(OCc2ccccc2)cc1 Amb15740891 [0,2,0,0,0,0|1,1,0]=4 1857 B17R2.48 NNc1ccc(OCc2ccccc2)cc1 Amb1058728 [0,2,0,0,0,0|1,1,0]=4 1858 B17R2.48 NNc1ccc(OCc2ccccc2)cc1 Amb22640974 [0,2,0,0,0,0|1,1,0]=4 1859 B17R2.48 NNc1ccc(\N=N\c2ccccc2)cc1 Amb2795050 [0,2,0,0,0,0|2,0,0]=4 1860 B17R2.48 O=Cc1ccc(C#Cc2ccccc2)cc1 Amb2690284 [0,2,0,0,0,0|2,0,0]=4 1861 B17R2.48 O=Cc1ccc(COc2ccccc2)cc1 Amb6572321 [0,2,0,0,0,0|1,1,0]=4 1862 B17R2.48 O=Cc1ccc(CSc2ccccc2)cc1 Amb2612857 [0,2,0,0,0,0|1,0,0]=3 1863 B17R2.48 O=Cc1ccc(OCc2ccccc2)cc1 Amb1207194 [0,2,0,0,0,0|1,1,0]=4 1864 B17R2.48 O=Cc1ccc(SCc2ccccc2)cc1 Amb20668530 [0,2,0,0,0,0|1,0,0]=3 1865 B17R2.48 OCc1ccc(C#Cc2ccccc2)cc1 Amb23401015 [0,2,0,0,0,0|2,0,0]=4 1866 B17R2.48 OCc1ccc(COc2ccccc2)cc1 Amb6572323 [0,2,0,0,0,0|1,1,0]=4 1867 B17R2.48 OCc1ccc(OCc2ccccc2)cc1 Amb6356514 [0,2,0,0,0,0|1,1,0]=4 1868 B17R2.48 OCc1ccc(SCc2ccccc2)cc1 Amb24092770 [0,2,0,0,0,0|1,0,0]=3 1869 B17R2.48 OCc1ccc(\C=C\c2ccccc2)cc1 Amb8394373 [0,2,0,0,0,0|2,0,0]=4 1870 B17R2.48 OCc1ccc(\N=N\c2ccccc2)cc1 Amb2609083 [0,2,0,0,0,0|2,0,0]=4 1871 B17R2.48 SCc1ccc(OCc2ccccc2)cc1 Amb16192528 [0,2,0,0,0,0|1,1,0]=4 1872 B17R2.48 [C-]#[N+]c1ccc(OCc2ccccc2)cc1 Amb2236628 [0,2,0,0,0,0|1,1,0]=4 1873 B17R2.48 [NH3+]Cc1ccc(OCc2ccccc2)cc1 Amb2444410 [0,2,0,0,0,0|1,1,0]=4 1874 B17R2.193 Cc1cc(CNc2ccccc2)ccc1F Amb17404428 [0,2,0,0,0,0|2,0,0]=4 1875 B17R2.193 Cc1cc(NCc2ccccc2)ccc1Br Amb6691704 [0,2,0,0,0,0|2,0,0]=4 1876 B17R2.193 Cc1cc(OCc2ccccc2)ccc1Br Amb2612257 [0,2,0,0,0,0|1,1,0]=4 1877 B17R2.193 Cc1cc(OCc2ccccc2)ccc1Cl Amb22451441 [0,2,0,0,0,0|1,1,0]=4 1878 B17R2.193 Cc1cc(OCc2ccccc2)ccc1N Amb1114913 [0,2,0,0,0,0|1,1,0]=4 1879 B17R2.193 Cc1cc(OCc2ccccc2)ccc1O Amb26380767 [0,2,0,0,0,0|1,1,0]=4 1880 B17R2.193 Cc1cc(\N=N\c2ccccc2)ccc1N Amb24065759 [0,2,0,0,0,0|2,0,0]=4 1881 B17R2.193 Cc1cc(\N=N\c2ccccc2)ccc1O Amb8477210 [0,2,0,0,0,0|2,0,0]=4 1882 B17R2.193 Cc1ccc(CNc2ccccc2)cc1C Amb9622211 [0,2,0,0,0,0|2,0,0]=4 1883 B17R2.193 Cc1ccc(NCc2ccccc2)cc1Br Amb17169140 [0,2,0,0,0,0|2,0,0]=4 1884 B17R2.193 Cc1ccc(NCc2ccccc2)cc1C Amb3699217 [0,2,0,0,0,0|2,0,0]=4 1885 B17R2.193 Cc1ccc(NCc2ccccc2)cc1Cl Amb6650002 [0,2,0,0,0,0|2,0,0]=4 1886 B17R2.193 Cc1ccc(NCc2ccccc2)cc1N Amb27870334 [0,2,0,0,0,0|2,0,0]=4 1887 B17R2.193 Cc1ccc(OCc2ccccc2)cc1Br Amb22229507 [0,2,0,0,0,0|1,1,0]=4 1888 B17R2.193 Cc1ccc(OCc2ccccc2)cc1C Amb25168747 [0,2,0,0,0,0|1,1,0]=4 1889 B17R2.193 Cc1ccc(OCc2ccccc2)cc1F Amb22489996 [0,2,0,0,0,0|1,1,0]=4 1890 B17R2.193 Cc1ccc(OCc2ccccc2)cc1N Amb17140790 [0,2,0,0,0,0|1,1,0]=4 1891 B17R2.193 Cc1ccc(OCc2ccccc2)cc1N Amb33328732 [0,2,0,0,0,0|1,1,0]=4 1892 B17R2.193 Cc1ccc(OCc2ccccc2)cc1O Amb23568466 [0,2,0,0,0,0|1,1,0]=4 1893 B17R2.193 Clc1ccc(OCc2ccccc2)cc1Br Amb28060332 [0,2,0,0,0,0|1,1,0]=4 1894 B17R2.193 Clc1ccc(OCc2ccccc2)cc1Cl Amb22442443 [0,2,0,0,0,0|1,1,0]=4 1895 B17R2.193 Fc1cc(OCc2ccccc2)ccc1Br Amb10841589 [0,2,0,0,0,0|1,1,0]=4 1896 B17R2.193 Fc1ccc(NCc2ccccc2)cc1Br Amb28056800 [0,2,0,0,0,0|2,0,0]=4 1897 B17R2.193 Fc1ccc(NCc2ccccc2)cc1Cl Amb837933 [0,2,0,0,0,0|2,0,0]=4 1898 B17R2.193 Fc1ccc(NCc2ccccc2)cc1F Amb6695004 [0,2,0,0,0,0|2,0,0]=4 1899 B17R2.193 Fc1ccc(OCc2ccccc2)cc1Br Amb28192649 [0,2,0,0,0,0|1,1,0]=4 1900 B17R2.193 Nc1cc(OCc2ccccc2)ccc1Br Amb21964593 [0,2,0,0,0,0|1,1,0]=4 1901 B17R2.193 Nc1cc(OCc2ccccc2)ccc1Cl Amb17157659 [0,2,0,0,0,0|1,1,0]=4 1902 B17R2.193 Nc1cc(OCc2ccccc2)ccc1F Amb8439034 [0,2,0,0,0,0|1,1,0]=4 1903 B17R2.193 Nc1cc(OCc2ccccc2)ccc1O Amb18131930 [0,2,0,0,0,0|1,1,0]=4 1904 B17R2.193 Nc1ccc(OCc2ccccc2)cc1Br Amb24419727 [0,2,0,0,0,0|1,1,0]=4 1905 B17R2.193 Nc1ccc(OCc2ccccc2)cc1Cl Amb24309266 [0,2,0,0,0,0|1,1,0]=4 1906 B17R2.193 Nc1ccc(OCc2ccccc2)cc1F Amb18980920 [0,2,0,0,0,0|1,1,0]=4 1907 B17R2.193 Nc1ccc(OCc2ccccc2)cc1F Amb33849608 [0,2,0,0,0,0|1,1,0]=4 1908 B17R2.193 Nc1ccc(OCc2ccccc2)cc1N Amb17609273 [0,2,0,0,0,0|1,1,0]=4 1909 B17R2.193 Nc1ccc(OCc2ccccc2)cc1N Amb21964591 [0,2,0,0,0,0|1,1,0]=4 1910 B17R2.193 Nc1ccc(OCc2ccccc2)cc1N Amb32758672 [0,2,0,0,0,0|1,1,0]=4 1911 B17R2.193 Nc1ccc(OCc2ccccc2)cc1O Amb25131155 [0,2,0,0,0,0|1,1,0]=4 1912 B17R2.193 Nc1ccc(OCc2ccccc2)cc1S Amb18939291 [0,2,0,0,0,0|1,1,0]=4 1913 B17R2.193 Oc1cc(OCc2ccccc2)ccc1Br Amb27762383 [0,2,0,0,0,0|1,1,0]=4 1914 B17R2.193 Oc1cc(OCc2ccccc2)ccc1Cl Amb28343858 [0,2,0,0,0,0|1,1,0]=4 1915 B17R2.193 Oc1cc(OCc2ccccc2)ccc1F Amb24548672 [0,2,0,0,0,0|1,1,0]=4 1916 B17R2.193 Oc1cc(OCc2ccccc2)ccc1I Amb27653012 [0,2,0,0,0,0|1,1,0]=4 1917 B17R2.193 Oc1cc(OCc2ccccc2)ccc1S Amb33080666 [0,2,0,0,0,0|1,1,0]=4 1918 B17R2.193 Oc1ccc(CSc2ccncc2)cc1O Amb32416603 [0,2,0,0,0,0|2,0,0]=4 1919 B17R2.193 Oc1ccc(NCc2ccccc2)cc1F Amb27199557 [0,2,0,0,0,0|2,0,0]=4 1920 B17R2.193 Oc1ccc(NCc2ccccc2)cc1O Amb27413633 [0,2,0,0,0,0|2,0,0]=4 1921 B17R2.193 Oc1ccc(OCc2ccccc2)cc1Br Amb23438858 [0,2,0,0,0,0|1,1,0]=4 1922 B17R2.193 Oc1ccc(OCc2ccccc2)cc1Cl Amb24563131 [0,2,0,0,0,0|1,1,0]=4 1923 B17R2.193 Oc1ccc(OCc2ccccc2)cc1F Amb25050085 [0,2,0,0,0,0|1,1,0]=4 1924 B17R2.193 Oc1ccc(OCc2ccccc2)cc1O Amb27164683 [0,2,0,0,0,0|1,1,0]=4 1925 B17R2.193 Oc1ccc(OCc2ccccc2)cc1S Amb25168756 [0,2,0,0,0,0|1,1,0]=4 1926 B17R2.207 Brc1ccc(C#Cc2ccc(Br)cc2)cc1 Amb3987409 [0,2,0,0,0,0|2,0,0]=4 1927 B17R2.207 Brc1ccc(CCc2ccc(Br)cc2)cc1 Amb17672571 [0,2,0,0,0,0|2,0,0]=4 1928 B17R2.207 Brc1ccc(SSc2ccc(Br)cc2)cc1 Amb2695511 [0,2,0,0,0,0|0,0,0]=2 1929 B17R2.207 Brc1ccc(SSc2ccc(Br)cn2)nc1 Amb19959549 [0,2,0,0,0,0|2,0,0]=4 1930 B17R2.207 Brc1ccc(\C=C\c2ccc(Br)cc2)cc1 Amb2608985 [0,2,0,0,0,0|2,0,0]=4 1931 B17R2.207 Cc1ccc(CCc2ccc(C)cc2)cc1 Amb6335821 [0,2,0,0,0,0|2,0,0]=4 1932 B17R2.207 Cc1ccc(CNc2ccc(Br)cc2)cc1 Amb3744256 [0,2,0,0,0,0|2,0,0]=4 1933 B17R2.207 Cc1ccc(CNc2ccc(C)cc2)cc1 Amb3765443 [0,2,0,0,0,0|2,0,0]=4 1934 B17R2.207 Cc1ccc(CNc2ccc(Cl)cc2)cc1 Amb3725042 [0,2,0,0,0,0|2,0,0]=4 1935 B17R2.207 Cc1ccc(CNc2ccc(F)cc2)cc1 Amb3699183 [0,2,0,0,0,0|2,0,0]=4 1936 B17R2.207 Cc1ccc(CNc2ccc(O)cc2)cc1 Amb6857102 [0,2,0,0,0,0|2,0,0]=4 1937 B17R2.207 Cc1ccc(COc2ccc(N)cc2)cc1 Amb1121413 [0,2,0,0,0,0|1,1,0]=4 1938 B17R2.207 Cc1ccc(CSc2ccc(N)cc2)cc1 Amb8930371 [0,2,0,0,0,0|1,0,0]=3 1939 B17R2.207 Cc1ccc(CSc2ccc(N)nc2)cc1 Amb8933177 [0,2,0,0,0,0|2,0,0]=4 1940 B17R2.207 Cc1ccc(NCc2ccc(Br)cc2)cc1 Amb838972 [0,2,0,0,0,0|2,0,0]=4 1941 B17R2.207 Cc1ccc(NCc2ccc(Cl)cc2)cc1 Amb839006 [0,2,0,0,0,0|2,0,0]=4 1942 B17R2.207 Cc1ccc(NCc2ccc(F)cc2)cc1 Amb4313369 [0,2,0,0,0,0|2,0,0]=4 1943 B17R2.207 Cc1ccc(NCc2ccc(O)cc2)cc1 Amb3547087 [0,2,0,0,0,0|2,0,0]=4 1944 B17R2.207 Cc1ccc(NNc2ccc(N)cc2)cc1 Amb24103301 [0,2,0,0,0,0|2,0,0]=4 1945 B17R2.207 Cc1ccc(OCc2ccc(Br)cc2)cc1 Amb24064692 [0,2,0,0,0,0|1,1,0]=4 1946 B17R2.207 Cc1ccc(SSc2ccc(C)cc2)cc1 Amb1212230 [0,2,0,0,0,0|0,0,0]=2 1947 B17R2.207 Cc1ccc(\C=C\c2ccc(C)cc2)cc1 Amb33850478 [0,2,0,0,0,0|2,0,0]=4 1948 B17R2.207 Cc1ccc(\N=C\c2ccc(Cl)cc2)cc1 Amb1641375 [0,2,0,0,0,0|2,0,0]=4 1949 B17R2.207 Cc1ccc(\N=C\c2ccc(O)cc2)cc1 Amb1040065 [0,2,0,0,0,0|2,0,0]=4 1950 B17R2.207 Cc1ccc(\N=N\c2ccc(C)cc2)cc1 Amb4034243 [0,2,0,0,0,0|2,0,0]=4 1951 B17R2.207 Clc1ccc(CCc2ccc(Cl)cc2)cc1 Amb2752768 [0,2,0,0,0,0|2,0,0]=4 1952 B17R2.207 Clc1ccc(CNc2ccc(Br)cc2)cc1 Amb839010 [0,2,0,0,0,0|2,0,0]=4 1953 B17R2.207 Clc1ccc(COc2ccc(I)cc2)cc1 Amb4985461 [0,2,0,0,0,0|1,1,0]=4 1954 B17R2.207 Clc1ccc(NNc2ccc(Cl)cc2)cc1 Amb22057503 [0,2,0,0,0,0|2,0,0]=4 1955 B17R2.207 Clc1ccc(OCc2ccc(Br)cc2)cc1 Amb4853935 [0,2,0,0,0,0|1,1,0]=4 1956 B17R2.207 Clc1ccc(SSc2ccc(Cl)cc2)cc1 Amb1153259 [0,2,0,0,0,0|0,0,0]=2 1957 B17R2.207 Clc1ccc(\C=C\c2ccc(Cl)cc2)cc1 Amb2384075 [0,2,0,0,0,0|2,0,0]=4 1958 B17R2.207 Clc1ccc(\N=N\c2ccc(Cl)cc2)cc1 Amb23481621 [0,2,0,0,0,0|2,0,0]=4 1959 B17R2.207 Fc1ccc(CCc2ccc(F)cc2)cc1 Amb2759832 [0,2,0,0,0,0|2,0,0]=4 1960 B17R2.207 Fc1ccc(COc2ccc(Br)cc2)cc1 Amb6665066 [0,2,0,0,0,0|1,1,0]=4 1961 B17R2.207 Fc1ccc(COc2ccc(Cl)cc2)cc1 Amb1547339 [0,2,0,0,0,0|1,1,0]=4 1962 B17R2.207 Fc1ccc(NCc2ccc(Cl)cc2)cc1 Amb4313433 [0,2,0,0,0,0|2,0,0]=4 1963 B17R2.207 Fc1ccc(\C=C/c2ccc(F)cc2)cc1 Amb2609129 [0,2,0,0,0,0|2,0,0]=4 1964 B17R2.207 Fc1ccc(\C=N\c2ccc(F)cc2)cc1 Amb2227962 [0,2,0,0,0,0|2,0,0]=4 1965 B17R2.207 Nc1ccc(C#Cc2ccc(N)cc2)cc1 Amb2440767 [0,2,0,0,0,0|2,0,0]=4 1966 B17R2.207 Nc1ccc(CCc2ccc(N)cc2)cc1 Amb264309 [0,2,0,0,0,0|2,0,0]=4 1967 B17R2.207 Nc1ccc(CCc2ccc(N)cc2)cc1 Amb4017082 [0,2,0,0,0,0|2,0,0]=4 1968 B17R2.207 Nc1ccc(CCc2ccc(O)cc2)cc1 Amb6298293 [0,2,0,0,0,0|2,0,0]=4 1969 B17R2.207 Nc1ccc(COc2ccc(Br)cc2)cc1 Amb2371348 [0,2,0,0,0,0|1,1,0]=4 1970 B17R2.207 Nc1ccc(COc2ccc(Cl)cc2)cc1 Amb1128477 [0,2,0,0,0,0|1,1,0]=4 1971 B17R2.207 Nc1ccc(CSc2ccc(Br)cc2)cc1 Amb8996693 [0,2,0,0,0,0|1,0,0]=3 1972 B17R2.207 Nc1ccc(CSc2ccc(Cl)cc2)cc1 Amb2414967 [0,2,0,0,0,0|1,0,0]=3 1973 B17R2.207 Nc1ccc(CSc2ccc(F)cc2)cc1 Amb2414977 [0,2,0,0,0,0|1,0,0]=3 1974 B17R2.207 Nc1ccc(OCc2ccc(Br)cc2)cc1 Amb843450 [0,2,0,0,0,0|1,1,0]=4 1975 B17R2.207 Nc1ccc(OCc2ccc(Cl)cc2)cc1 Amb1395344 [0,2,0,0,0,0|1,1,0]=4 1976 B17R2.207 Nc1ccc(OCc2ccc(F)cc2)cc1 Amb1119010 [0,2,0,0,0,0|1,1,0]=4 1977 B17R2.207 Nc1ccc(SCc2ccc(Cl)cc2)cc1 Amb8930431 [0,2,0,0,0,0|1,0,0]=3 1978 B17R2.207 Nc1ccc(SCc2ccc(Cl)cc2)cn1 Amb8933243 [0,2,0,0,0,0|2,0,0]=4 1979 B17R2.207 Nc1ccc(SCc2ccc(F)cc2)cc1 Amb2719883 [0,2,0,0,0,0|1,0,0]=3 1980 B17R2.207 Nc1ccc(SCc2ccc(F)cc2)nc1 Amb8932474 [0,2,0,0,0,0|2,0,0]=4 1981 B17R2.207 Nc1ccc(SSc2ccc(N)cc2)cc1 Amb6565819 [0,2,0,0,0,0|0,0,0]=2 1982 B17R2.207 Nc1ccc([Se][Se]c2ccc(N)cc2)cc1 Amb10975869 [0,2,0,0,0,0|0,2,0]=4 1983 B17R2.207 Nc1ccc(\C=C\c2ccc(N)cc2)cc1 Amb2384063 [0,2,0,0,0,0|2,0,0]=4 1984 B17R2.207 Nc1ccc(\N=N\c2ccc(N)cc2)cc1 Amb6573351 [0,2,0,0,0,0|2,0,0]=4 1985 B17R2.207 O=C1C=CC(=CC=C2C=CC(=O)C=C2)C=C1 Amb17595653 [0,2,0,0,0,0|2,0,0]=4 1986 B17R2.207 Oc1ccc(C#Cc2ccc(F)cc2)cc1 Amb10839829 [0,2,0,0,0,0|2,0,0]=4 1987 B17R2.207 Oc1ccc(C#Cc2ccc(O)cc2)cc1 Amb17595655 [0,2,0,0,0,0|2,0,0]=4 1988 B17R2.207 Oc1ccc(CCc2ccc(Cl)cc2)cc1 Amb2413167 [0,2,0,0,0,0|2,0,0]=4 1989 B17R2.207 Oc1ccc(CCc2ccc(O)cc2)cc1 Amb2445097 [0,2,0,0,0,0|2,0,0]=4 1990 B17R2.207 Oc1ccc(CNc2ccc(Br)cc2)cc1 Amb4032194 [0,2,0,0,0,0|2,0,0]=4 1991 B17R2.207 Oc1ccc(CNc2ccc(Cl)cc2)cc1 Amb4020906 [0,2,0,0,0,0|2,0,0]=4 1992 B17R2.207 Oc1ccc(CNc2ccc(F)cc2)cc1 Amb4018606 [0,2,0,0,0,0|2,0,0]=4 1993 B17R2.207 Oc1ccc(CNc2ccc(O)cc2)cc1 Amb6867964 [0,2,0,0,0,0|2,0,0]=4 1994 B17R2.207 Oc1ccc(NCc2ccc(Br)cc2)cc1 Amb6456501 [0,2,0,0,0,0|2,0,0]=4 1995 B17R2.207 Oc1ccc(NCc2ccc(Cl)cc2)cc1 Amb6857103 [0,2,0,0,0,0|2,0,0]=4 1996 B17R2.207 Oc1ccc(OCc2ccc(Br)cc2)cc1 Amb33528788 [0,2,0,0,0,0|1,1,0]=4 1997 B17R2.207 Oc1ccc(SSc2ccc(O)cc2)cc1 Amb583424 [0,2,0,0,0,0|0,0,0]=2 1998 B17R2.207 Oc1ccc(\C=C\c2ccc(O)cc2)cc1 Amb2384062 [0,2,0,0,0,0|2,0,0]=4 1999 B17R2.207 Oc1ccc(\C=N\c2ccc(Br)cc2)cc1 Amb2229338 [0,2,0,0,0,0|2,0,0]=4 2000 B17R2.207 Oc1ccc(\C=N\c2ccc(F)cc2)cc1 Amb2704333 [0,2,0,0,0,0|2,0,0]=4 2001 B17R2.207 Oc1ccc(\C=N\c2ccc(F)cc2)cc1 Amb33715879 [0,2,0,0,0,0|2,0,0]=4 2002 B17R2.207 Oc1ccc(\N=N\c2ccc(O)cc2)cc1 Amb2704441 [0,2,0,0,0,0|2,0,0]=4 2003 B17R2.215 Cc1ccc(CNc2cccc(Br)c2)cc1 Amb6696580 [0,2,0,0,0,0|2,0,0]=4 2004 B17R2.215 Cc1ccc(CNc2cccc(C)c2)cc1 Amb6684410 [0,2,0,0,0,0|2,0,0]=4 2005 B17R2.215 Cc1ccc(CNc2cccc(Cl)c2)cc1 Amb6644635 [0,2,0,0,0,0|2,0,0]=4 2006 B17R2.215 Cc1ccc(CNc2cccc(F)c2)cc1 Amb6695769 [0,2,0,0,0,0|2,0,0]=4 2007 B17R2.215 Cc1ccc(COc2cccc(N)c2)cc1 Amb1118549 [0,2,0,0,0,0|1,1,0]=4 2008 B17R2.215 Cc1ccc(COc2cccc(O)c2)cc1 Amb8837427 [0,2,0,0,0,0|1,1,0]=4 2009 B17R2.215 Cc1ccc(NCc2cccc(Br)c2)cc1 Amb837855 [0,2,0,0,0,0|2,0,0]=4 2010 B17R2.215 Cc1ccc(NCc2cccc(C)c2)cc1 Amb4313244 [0,2,0,0,0,0|2,0,0]=4 2011 B17R2.215 Cc1ccc(NCc2cccc(Cl)c2)cc1 Amb4303633 [0,2,0,0,0,0|2,0,0]=4 2012 B17R2.215 Cc1ccc(NCc2cccc(F)c2)cc1 Amb6700763 [0,2,0,0,0,0|2,0,0]=4 2013 B17R2.215 Cc1ccc(NCc2cccc(O)c2)cc1 Amb3538468 [0,2,0,0,0,0|2,0,0]=4 2014 B17R2.215 Cc1cccc(CNc2ccc(Br)cc2)c1 Amb4313253 [0,2,0,0,0,0|2,0,0]=4 2015 B17R2.215 Cc1cccc(CNc2ccc(Cl)cc2)c1 Amb4313248 [0,2,0,0,0,0|2,0,0]=4 2016 B17R2.215 Cc1cccc(CNc2ccc(F)cc2)c1 Amb4313254 [0,2,0,0,0,0|2,0,0]=4 2017 B17R2.215 Cc1cccc(COc2ccc(N)cc2)c1 Amb1119835 [0,2,0,0,0,0|1,1,0]=4 2018 B17R2.215 Cc1cccc(CSc2ccc(N)cc2)c1 Amb8930369 [0,2,0,0,0,0|1,0,0]=3 2019 B17R2.215 Cc1cccc(NCc2ccc(Br)cc2)c1 Amb838880 [0,2,0,0,0,0|2,0,0]=4 2020 B17R2.215 Cc1cccc(NCc2ccc(Cl)cc2)c1 Amb838881 [0,2,0,0,0,0|2,0,0]=4 2021 B17R2.215 Cc1cccc(NCc2ccc(O)cc2)c1 Amb3542173 [0,2,0,0,0,0|2,0,0]=4 2022 B17R2.215 Cc1cccc(OCc2ccc(N)cc2)c1 Amb1134529 [0,2,0,0,0,0|1,1,0]=4 2023 B17R2.215 Cc1cccc(SCc2ccc(N)cc2)c1 Amb24091120 [0,2,0,0,0,0|1,0,0]=3 2024 B17R2.215 Clc1ccc(CNc2cccc(Cl)c2)cc1 Amb838911 [0,2,0,0,0,0|2,0,0]=4 2025 B17R2.215 Clc1ccc(CSc2cc(Cl)ccn2)cc1 Amb22236325 [0,2,0,0,0,0|2,0,0]=4 2026 B17R2.215 Clc1ccc(OCc2cccc(Br)c2)cc1 Amb30588926 [0,2,0,0,0,0|1,1,0]=4 2027 B17R2.215 Fc1ccc(CNc2cccc(F)c2)cc1 Amb6695752 [0,2,0,0,0,0|2,0,0]=4 2028 B17R2.215 Fc1ccc(COc2cccc(Br)c2)cc1 Amb2688061 [0,2,0,0,0,0|1,1,0]=4 2029 B17R2.215 Fc1ccc(CSc2cc(Cl)ccn2)cc1 Amb22236330 [0,2,0,0,0,0|2,0,0]=4 2030 B17R2.215 Fc1ccc(NCc2cccc(Cl)c2)cc1 Amb4303626 [0,2,0,0,0,0|2,0,0]=4 2031 B17R2.215 Fc1ccc(NCc2cccc(F)c2)cc1 Amb6696703 [0,2,0,0,0,0|2,0,0]=4 2032 B17R2.215 Fc1cccc(CNc2ccc(Cl)cc2)c1 Amb6695914 [0,2,0,0,0,0|2,0,0]=4 2033 B17R2.215 Fc1cccc(COc2ccc(I)cc2)c1 Amb28984096 [0,2,0,0,0,0|1,1,0]=4 2034 B17R2.215 Fc1cccc(NCc2ccc(Cl)cc2)c1 Amb6695750 [0,2,0,0,0,0|2,0,0]=4 2035 B17R2.215 Nc1ccc(OCc2cccc(Br)c2)cc1 Amb1135336 [0,2,0,0,0,0|1,1,0]=4 2036 B17R2.215 Nc1ccc(OCc2cccc(Cl)c2)cc1 Amb6245870 [0,2,0,0,0,0|1,1,0]=4 2037 B17R2.215 Nc1ccc(OCc2cccc(F)c2)cc1 Amb1117692 [0,2,0,0,0,0|1,1,0]=4 2038 B17R2.215 Nc1ccc(SCc2cccc(Cl)c2)cc1 Amb8930389 [0,2,0,0,0,0|1,0,0]=3 2039 B17R2.215 Nc1ccc(SCc2cccc(Cl)c2)nc1 Amb8932494 [0,2,0,0,0,0|2,0,0]=4 2040 B17R2.215 Nc1ccc(SCc2cccc(F)c2)cc1 Amb8930281 [0,2,0,0,0,0|1,0,0]=3 2041 B17R2.215 Nc1ccc(\C=C\c2cccc(N)c2)cc1 Amb17843350 [0,2,0,0,0,0|2,0,0]=4 2042 B17R2.215 Nc1cccc(COc2ccc(Cl)cc2)c1 Amb6243774 [0,2,0,0,0,0|1,1,0]=4 2043 B17R2.215 Nc1cccc(COc2ccc(F)cc2)c1 Amb6243286 [0,2,0,0,0,0|1,1,0]=4 2044 B17R2.215 Nc1cccc(OCc2ccc(Br)cc2)c1 Amb6251570 [0,2,0,0,0,0|1,1,0]=4 2045 B17R2.215 Nc1cccc(OCc2ccc(Cl)cc2)c1 Amb6247067 [0,2,0,0,0,0|1,1,0]=4 2046 B17R2.215 Nc1cccc(OCc2ccc(F)cc2)c1 Amb1120896 [0,2,0,0,0,0|1,1,0]=4 2047 B17R2.215 Oc1ccc(CCc2cccc(O)c2)cc1 Amb31289382 [0,2,0,0,0,0|2,0,0]=4 2048 B17R2.215 Oc1ccc(CNc2cccc(Br)c2)cc1 Amb6696568 [0,2,0,0,0,0|2,0,0]=4 2049 B17R2.215 Oc1ccc(CNc2cccc(Cl)c2)cc1 Amb6695649 [0,2,0,0,0,0|2,0,0]=4 2050 B17R2.215 Oc1ccc(CNc2cccc(F)c2)cc1 Amb6695746 [0,2,0,0,0,0|2,0,0]=4 2051 B17R2.215 Oc1ccc(NCc2cccc(Br)c2)cc1 Amb6857128 [0,2,0,0,0,0|2,0,0]=4 2052 B17R2.215 Oc1ccc(NCc2cccc(Cl)c2)cc1 Amb9608750 [0,2,0,0,0,0|2,0,0]=4 2053 B17R2.215 Oc1ccc(OCc2cccc(Br)c2)cc1 Amb8837215 [0,2,0,0,0,0|1,1,0]=4 2054 B17R2.215 Oc1ccc(OCc2cccc(Cl)c2)cc1 Amb9210962 [0,2,0,0,0,0|1,1,0]=4 2055 B17R2.215 Oc1ccc(OCc2cccc(F)c2)cc1 Amb8837229 [0,2,0,0,0,0|1,1,0]=4 2056 B17R2.215 Oc1ccc(\C=C\c2cccc(O)c2)cc1 Amb32661181 [0,2,0,0,0,0|2,0,0]=4 2057 B17R2.215 Oc1cccc(CNc2ccc(Br)cc2)c1 Amb6696555 [0,2,0,0,0,0|2,0,0]=4 2058 B17R2.215 Oc1cccc(CNc2ccc(Cl)cc2)c1 Amb6695979 [0,2,0,0,0,0|2,0,0]=4 2059 B17R2.215 Oc1cccc(CNc2ccc(F)cc2)c1 Amb6696810 [0,2,0,0,0,0|2,0,0]=4 2060 B17R2.215 Oc1cccc(OCc2ccc(Br)cc2)c1 Amb9210990 [0,2,0,0,0,0|1,1,0]=4 2061 B17R2.215 Oc1cccc(OCc2ccc(Cl)cc2)c1 Amb8837477 [0,2,0,0,0,0|1,1,0]=4 2062 B17R2.215 Oc1cccc(OCc2ccc(F)cc2)c1 Amb8837426 [0,2,0,0,0,0|1,1,0]=4 2063 B17R2.215 Oc1cccc(\C=N\c2ccc(Cl)cc2)c1 Amb3693049 [0,2,0,0,0,0|2,0,0]=4 2064 B17R2.1819 BrCc1cccc(OCc2ccccc2)c1 Amb2694949 [0,2,0,0,0,0|1,1,0]=4 2065 B17R2.1819 C#Cc1cccc(NCc2ccccc2)c1 Amb6684379 [0,2,0,0,0,0|2,0,0]=4 2066 B17R2.1819 C#Cc1cccc(OCc2ccccc2)c1 Amb19944488 [0,2,0,0,0,0|1,1,0]=4 2067 B17R2.1819 C=Cc1cccc(OCc2ccccc2)c1 Amb25201240 [0,2,0,0,0,0|1,1,0]=4 2068 B17R2.1819 CNc1cccc(NCc2ccccc2)c1 Amb28192647 [0,2,0,0,0,0|2,0,0]=4 2069 B17R2.1819 CNc1cccc(OCc2ccccc2)c1 Amb19889083 [0,2,0,0,0,0|1,1,0]=4 2070 B17R2.1819 COc1cccc(CNc2ccccc2)c1 Amb3548401 [0,2,0,0,0,0|2,0,0]=4 2071 B17R2.1819 COc1cccc(NCc2ccccc2)c1 Amb4313275 [0,2,0,0,0,0|2,0,0]=4 2072 B17R2.1819 COc1cccc(OCc2ccccc2)c1 Amb25099494 [0,2,0,0,0,0|1,1,0]=4 2073 B17R2.1819 ClCc1cccc(OCc2ccccc2)c1 Amb6618713 [0,2,0,0,0,0|1,1,0]=4 2074 B17R2.1819 ClCc1cccc(SCc2ccccc2)c1 Amb32652002 [0,2,0,0,0,0|1,0,0]=3 2075 B17R2.1819 N#Cc1cccc(COc2ccccc2)c1 Amb2724118 [0,2,0,0,0,0|1,1,0]=4 2076 B17R2.1819 N#Cc1cccc(NCc2ccccc2)c1 Amb6696323 [0,2,0,0,0,0|2,0,0]=4 2077 B17R2.1819 N#Cc1cccc(OCc2ccccc2)c1 Amb6664107 [0,2,0,0,0,0|1,1,0]=4 2078 B17R2.1819 NCc1cccc(COc2ccccc2)c1 Amb1136372 [0,2,0,0,0,0|1,1,0]=4 2079 B17R2.1819 NCc1cccc(OCc2ccccc2)c1 Amb10767182 [0,2,0,0,0,0|1,1,0]=4 2080 B17R2.1819 NCc1cccc(OCc2ccccc2)c1 Amb1120868 [0,2,0,0,0,0|1,1,0]=4 2081 B17R2.1819 NCc1cccc(OCc2ccccc2)c1 Amb17622255 [0,2,0,0,0,0|1,1,0]=4 2082 B17R2.1819 NNc1cccc(OCc2ccccc2)c1 Amb17241686 [0,2,0,0,0,0|1,1,0]=4 2083 B17R2.1819 NNc1cccc(OCc2ccccc2)c1 Amb6298610 [0,2,0,0,0,0|1,1,0]=4 2084 B17R2.1819 O=Cc1cccc(C#Cc2ccccc2)c1 Amb6355998 [0,2,0,0,0,0|2,0,0]=4 2085 B17R2.1819 O=Cc1cccc(COc2ccccc2)c1 Amb2724112 [0,2,0,0,0,0|1,1,0]=4 2086 B17R2.1819 O=Cc1cccc(OCc2ccccc2)c1 Amb1881706 [0,2,0,0,0,0|1,1,0]=4 2087 B17R2.1819 O=Cc1cccc(SCc2ccccc2)c1 Amb32652003 [0,2,0,0,0,0|1,0,0]=3 2088 B17R2.1819 OCc1cccc(C#Cc2ccccc2)c1 Amb23400999 [0,2,0,0,0,0|2,0,0]=4 2089 B17R2.1819 OCc1cccc(COc2ccccc2)c1 Amb2724115 [0,2,0,0,0,0|1,1,0]=4 2090 B17R2.1819 OCc1cccc(CSc2ccncc2)c1 Amb22234670 [0,2,0,0,0,0|2,0,0]=4 2091 B17R2.1819 OCc1cccc(NCc2ccccc2)c1 Amb9229802 [0,2,0,0,0,0|2,0,0]=4 2092 B17R2.1819 OCc1cccc(OCc2ccccc2)c1 Amb3606262 [0,2,0,0,0,0|1,1,0]=4 2093 B17R2.1819 SCc1cccc(OCc2ccccc2)c1 Amb27427319 [0,2,0,0,0,0|1,1,0]=4 2094 B17R2.1819 [C-]#[N+]c1cccc(OCc2ccccc2)c1 Amb26559267 [0,2,0,0,0,0|1,1,0]=4 2095 B17R2.3212 Brc1cc(Br)cc(NCc2ccccc2)c1 Amb35725843 [0,2,0,0,0,0|2,0,0]=4 2096 B17R2.3212 Brc1cc(Br)cc(OCc2ccccc2)c1 Amb22490038 [0,2,0,0,0,0|1,1,0]=4 2097 B17R2.3212 Cc1cc(C)cc(NCc2ccccc2)c1 Amb4313272 [0,2,0,0,0,0|2,0,0]=4 2098 B17R2.3212 Cc1cc(Cl)cc(OCc2ccccc2)c1 Amb27620845 [0,2,0,0,0,0|1,1,0]=4 2099 B17R2.3212 Cc1cc(I)cc(NCc2ccccc2)c1 Amb35691018 [0,2,0,0,0,0|2,0,0]=4 2100 B17R2.3212 Cc1cc(N)cc(OCc2ccccc2)c1 Amb26078529 [0,2,0,0,0,0|1,1,0]=4 2101 B17R2.3212 Cc1cc(O)cc(OCc2ccccc2)c1 Amb25729121 [0,2,0,0,0,0|1,1,0]=4 2102 B17R2.3212 Clc1cc(Br)cc(OCc2ccccc2)c1 Amb21856643 [0,2,0,0,0,0|1,1,0]=4 2103 B17R2.3212 Clc1cc(Cl)cc(CNc2ccccc2)c1 Amb20076470 [0,2,0,0,0,0|2,0,0]=4 2104 B17R2.3212 Clc1cc(Cl)cc(NCc2ccccc2)c1 Amb3693314 [0,2,0,0,0,0|2,0,0]=4 2105 B17R2.3212 Clc1cc(Cl)cc(OCc2ccccc2)c1 Amb28244870 [0,2,0,0,0,0|1,1,0]=4 2106 B17R2.3212 Fc1cc(Br)cc(NCc2ccccc2)c1 Amb27453756 [0,2,0,0,0,0|2,0,0]=4 2107 B17R2.3212 Fc1cc(Br)cc(OCc2ccccc2)c1 Amb19517019 [0,2,0,0,0,0|1,1,0]=4 2108 B17R2.3212 Fc1cc(F)cc(OCc2ccccc2)c1 Amb21964311 [0,2,0,0,0,0|1,1,0]=4 2109 B17R2.3212 Ic1cc(I)cc(NCc2ccccc2)c1 Amb35717719 [0,2,0,0,0,0|2,0,0]=4 2110 B17R2.3212 Nc1cc(Cl)cc(OCc2ccccc2)c1 Amb21857934 [0,2,0,0,0,0|1,1,0]=4 2111 B17R2.3212 Nc1cc(F)cc(OCc2ccccc2)c1 Amb28424227 [0,2,0,0,0,0|1,1,0]=4 2112 B17R2.3212 Oc1cc(Br)cc(OCc2ccccc2)c1 Amb24698770 [0,2,0,0,0,0|1,1,0]=4 2113 B17R2.3212 Oc1cc(Cl)cc(OCc2ccccc2)c1 Amb25910282 [0,2,0,0,0,0|1,1,0]=4 2114 B17R2.3212 Oc1cc(O)cc(CCc2ccccc2)c1 Amb15692016 [0,2,0,0,0,0|2,0,0]=4 2115 B17R2.3212 Oc1cc(O)cc(OCc2ccccc2)c1 Amb27802787 [0,2,0,0,0,0|1,1,0]=4 2116 B17R2.5300 Cc1cccc(CNc2cccc(Br)c2)c1 Amb6696582 [0,2,0,0,0,0|2,0,0]=4 2117 B17R2.5300 Cc1cccc(CNc2cccc(C)c2)c1 Amb6684411 [0,2,0,0,0,0|2,0,0]=4 2118 B17R2.5300 Cc1cccc(CNc2cccc(Cl)c2)c1 Amb6618089 [0,2,0,0,0,0|2,0,0]=4 2119 B17R2.5300 Cc1cccc(CNc2cccc(F)c2)c1 Amb6695772 [0,2,0,0,0,0|2,0,0]=4 2120 B17R2.5300 Cc1cccc(COc2cccc(N)c2)c1 Amb1112224 [0,2,0,0,0,0|1,1,0]=4 2121 B17R2.5300 Cc1cccc(COc2cccc(O)c2)c1 Amb8837425 [0,2,0,0,0,0|1,1,0]=4 2122 B17R2.5300 Cc1cccc(NCc2cccc(Br)c2)c1 Amb6684401 [0,2,0,0,0,0|2,0,0]=4 2123 B17R2.5300 Cc1cccc(NCc2cccc(Cl)c2)c1 Amb4303632 [0,2,0,0,0,0|2,0,0]=4 2124 B17R2.5300 Cc1cccc(NCc2cccc(F)c2)c1 Amb6684408 [0,2,0,0,0,0|2,0,0]=4 2125 B17R2.5300 Cc1cccc(NCc2cccc(O)c2)c1 Amb3549188 [0,2,0,0,0,0|2,0,0]=4 2126 B17R2.5300 Cc1cccc(\N=N\c2cccc(C)c2)c1 Amb22734036 [0,2,0,0,0,0|2,0,0]=4 2127 B17R2.5300 Clc1cccc(CSc2cc(Cl)ccn2)c1 Amb22236305 [0,2,0,0,0,0|2,0,0]=4 2128 B17R2.5300 Clc1cccc(SSc2cccc(Cl)c2)c1 Amb8387531 [0,2,0,0,0,0|0,0,0]=2 2129 B17R2.5300 Clc1cccc(\N=N\c2cccc(Cl)c2)c1 Amb2390020 [0,2,0,0,0,0|2,0,0]=4 2130 B17R2.5300 Fc1cccc(CNc2cccc(F)c2)c1 Amb6695765 [0,2,0,0,0,0|2,0,0]=4 2131 B17R2.5300 Fc1cccc(COc2cccc(Br)c2)c1 Amb2688060 [0,2,0,0,0,0|1,1,0]=4 2132 B17R2.5300 Fc1cccc(CSc2cc(Cl)ccn2)c1 Amb22236309 [0,2,0,0,0,0|2,0,0]=4 2133 B17R2.5300 Fc1cccc(NCc2cccc(Cl)c2)c1 Amb6695879 [0,2,0,0,0,0|2,0,0]=4 2134 B17R2.5300 Fc1cccc(SSc2cccc(F)c2)c1 Amb2684760 [0,2,0,0,0,0|0,0,0]=2 2135 B17R2.5300 Fc1cccc(\N=N\c2cccc(F)c2)c1 Amb2390016 [0,2,0,0,0,0|2,0,0]=4 2136 B17R2.5300 Nc1cccc(COc2cccc(F)c2)c1 Amb6245061 [0,2,0,0,0,0|1,1,0]=4 2137 B17R2.5300 Nc1cccc(COc2cccc(F)c2)c1 Amb7969467 [0,2,0,0,0,0|1,1,0]=4 2138 B17R2.5300 Nc1cccc(NNc2cccc(N)c2)c1 Amb17843263 [0,2,0,0,0,0|2,0,0]=4 2139 B17R2.5300 Nc1cccc(OCc2cccc(Br)c2)c1 Amb1127518 [0,2,0,0,0,0|1,1,0]=4 2140 B17R2.5300 Nc1cccc(OCc2cccc(Cl)c2)c1 Amb6246771 [0,2,0,0,0,0|1,1,0]=4 2141 B17R2.5300 Nc1cccc(OCc2cccc(F)c2)c1 Amb1120444 [0,2,0,0,0,0|1,1,0]=4 2142 B17R2.5300 Nc1cccc(\N=N\c2cccc(N)c2)c1 Amb17777558 [0,2,0,0,0,0|2,0,0]=4 2143 B17R2.5300 Nc1cccc(\N=N\c2cccc(N)c2)c1 Amb21947851 [0,2,0,0,0,0|2,0,0]=4 2144 B17R2.5300 Oc1cccc(CNc2cccc(Br)c2)c1 Amb6696670 [0,2,0,0,0,0|2,0,0]=4 2145 B17R2.5300 Oc1cccc(CNc2cccc(Cl)c2)c1 Amb6695726 [0,2,0,0,0,0|2,0,0]=4 2146 B17R2.5300 Oc1cccc(CNc2cccc(F)c2)c1 Amb6695883 [0,2,0,0,0,0|2,0,0]=4 2147 B17R2.5300 Oc1cccc(OCc2cccc(Br)c2)c1 Amb8837419 [0,2,0,0,0,0|1,1,0]=4 2148 B17R2.5300 Oc1cccc(OCc2cccc(Cl)c2)c1 Amb9211006 [0,2,0,0,0,0|1,1,0]=4 2149 B17R2.5300 Oc1cccc(OCc2cccc(F)c2)c1 Amb8837434 [0,2,0,0,0,0|1,1,0]=4 2150 B17R2.5300 Oc1cccc(SSc2cccc(O)c2)c1 Amb8384402 [0,2,0,0,0,0|0,0,0]=2 2151 B15R2.21 C=Cc1ccccc1-c2ccccc2 Amb32411052 [0,0,1,1,0,0|2,0,0]=4 2152 B15R2.17 C=Cc1cccc(-c2ccccc2)c1 Amb32411056 [0,0,1,1,0,0|2,0,0]=4 2153 B15R3.3 C1=Cc2sc3ccccc3c2CS1 Amb27762406 [0,0,0,1,1,0|1,0,1]=4 2154 B15R3.3 C1=Cc2sc3ccccc3c2SC1 Amb27836698 [0,0,0,1,1,0|1,0,1]=4 2155 B15R3.3 c1ccc-2c(c1)Cc3ccccc32 Amb2793085 [0,0,0,1,1,0|1,0,0]=3 2156 B15R3.3 c1ccc-2c(c1)Cc3cccnc32 Amb1056107 [0,0,0,1,1,0|2,0,0]=4 2157 B15R3.3 c1ccc2c(c1)[i+]c3ccccc32 Amb22731766 [0,0,0,1,1,0|1,0,0]=3 2158 B15R3.3 c1ccc2c(c1)cc3ccccn32 Amb27241354 [0,0,0,1,1,0|2,0,0]=4 2159 B15R3.3 c1ccc2c(c1)nc3ccccn32 Amb1014333 [0,0,0,1,1,0|2,0,0]=4 2160 B15R3.3 c1ccc2c(c1)nn3ccccc23 Amb28293455 [0,0,0,1,1,0|2,0,0]=4 2161 B15R3.3 c1ccc2c(c1)oc3ccccc32 Amb6608847 [0,0,0,1,1,0|0,1,0]=3 2162 B15R3.3 c1ccc2c(c1)oc3cccnc32 Amb27165193 [0,0,0,1,1,0|1,1,0]=4 2163 B15R3.3 c1ccc2c(c1)oc3ccncc32 Amb27267846 [0,0,0,1,1,0|1,1,0]=4 2164 B15R3.3 c1ccc2c(c1)oc3ncccc32 Amb22641129 [0,0,0,1,1,0|1,1,0]=4 2165 B15R3.3 c1ccc2c(c1)sc3ccccc32 Amb2686709 [0,0,0,1,1,0|0,0,0]=2 2166 B17R3.8 C1=C(c2ccccc2)c3ccccc3C1 Amb17778883 [0,0,0,1,0,1|2,0,0]=4 2167 B17R3.8 C1=CC(c2ccccc2)c3ccccc31 Amb20240702 [0,0,0,1,0,1|2,0,0]=4 2168 B17R3.8 c1ccc(-c2coc3ccccc23)cc1 Amb10067083 [0,0,0,1,0,1|1,1,0]=4 2169 B17R3.8 c1ccc(-n2ccc3ccccc32)cc1 Amb8388379 [0,0,0,1,0,1|2,0,0]=4 2170 B17R3.8 c1ccc(-n2cnc3ccccc32)cc1 Amb2700555 [0,0,0,1,0,1|2,0,0]=4 2171 B17R3.8 c1ccc(-n2ncc3ccccc32)cc1 Amb4006218 [0,0,0,1,0,1|2,0,0]=4 2172 B17R3.8 c1ccc(-n2nnc3ccccc32)cc1 Amb2622119 [0,0,0,1,0,1|2,0,0]=4 2173 B17R3.8 c1ccc(C2CNc3ccccc32)cc1 Amb32882496 [0,0,0,1,0,1|2,0,0]=4 2174 B17R3.8 c1ccc(C2NCc3ccccc32)cc1 Amb31135052 [0,0,0,1,0,1|2,0,0]=4 2175 B17R3.8 c1ccc(N2CCc3ccccc32)cc1 Amb8392756 [0,0,0,1,0,1|2,0,0]=4 2176 B17R3.1927 c1ccc(C2CC2c3ccccc3)cc1 Amb4302622 [0,0,0,1,0,1|2,0,0]=4 2177 B17R3.1927 c1ccc(C2OC2c3ccccc3)cc1 Amb2610165 [0,0,0,1,0,1|1,1,0]=4 2178 B17R3.1927 c1ccc([C@@H]2O[C@H]2c3ccccc3)cc1 Amb8513314 [0,0,0,1,0,1|1,1,0]=4 2179 B17R3.1927 c1ccc([C@H]2O[C@@H]2c3ccccc3)cc1 Amb8629192 [0,0,0,1,0,1|1,1,0]=4 2180 B17R3.1939 c1ccc(CC2Cc3ccccc32)cc1 Amb17778868 [0,0,0,1,0,1|2,0,0]=4 2181 B17R3.1963 C1=Cc2ccccc2-c3ccccc3N1 Amb33948453 [0,0,0,1,0,1|2,0,0]=4 2182 B17R3.1963 c1ccc-2c(c1)CCNc3ccccc32 Amb19375172 [0,0,0,1,0,1|2,0,0]=4 2183 B17R3.1963 c1ccc-2c(c1)CNCc3ccccc32 Amb13952599 [0,0,0,1,0,1|2,0,0]=4 2184 B17R3.1963 c1ccc-2c(c1)CNCc3ccccc32 Amb6740263 [0,0,0,1,0,1|2,0,0]=4 2185 B17R3.1832 C1=CC=C2CC(=C1)C=Cc3ccccc32 Amb17778327 [0,0,0,1,0,1|2,0,0]=4 2186 B17R3.1830 C1=Cc2ccccc2Cc3ccccc31 Amb2387203 [0,1,0,1,0,0|2,0,0]=4 2187 B17R3.1830 C1=Cc2ccccc2Nc3ccccc31 Amb2746847 [0,1,0,1,0,0|2,0,0]=4 2188 B17R3.1830 C1=Nc2ccccc2Oc3ccccc31 Amb6384672 [0,1,0,1,0,0|2,0,0]=4 2189 B17R3.1830 c1ccc2c(c1)CCc3ccccc3N2 Amb1934143 [0,1,0,1,0,0|2,0,0]=4 2190 B17R3.1830 c1ccc2c(c1)CNc3ccccc3C2 Amb6355964 [0,1,0,1,0,0|2,0,0]=4 2191 B17R3.1830 c1ccc2c(c1)CNc3ccccc3O2 Amb1068313 [0,1,0,1,0,0|2,0,0]=4 2192 B17R3.1830 c1ccc2c(c1)COc3ccccc3N2 Amb21964317 [0,1,0,1,0,0|1,1,0]=4 2193 B17R3.4465 Cc1cccc2c1ccc3ccccc32 Amb2614712 [0,1,0,1,0,0|2,0,0]=4 2194 B17R3.8708 C1=C(c2ccccc2)Cc3ccccc31 Amb20240691 [0,1,0,1,0,0|2,0,0]=4 2195 B17R3.8708 c1ccc(-b2oc3ccccc3o2)cc1 Amb22723370 [0,1,0,1,0,0|1,1,0]=4 2196 B17R3.8708 c1ccc(-c2cc3ccccc3o2)cc1 Amb4011153 [0,1,0,1,0,0|1,1,0]=4 2197 B17R3.8708 c1ccc(-c2cc3ccccc3s2)nc1 Amb20622012 [0,1,0,1,0,0|2,0,0]=4 2198 B17R3.8708 c1ccc(-c2nc3ccccc3o2)cc1 Amb6335377 [0,1,0,1,0,0|1,1,0]=4 2199 B17R3.8708 c1ccc(-c2nc3ccccc3s2)cc1 Amb5349200 [0,1,0,1,0,0|1,0,0]=3 2200 B17R3.8708 c1ccc(-c2nc3ccccc3s2)nc1 Amb1152276 [0,1,0,1,0,0|2,0,0]=4 2201 B17R3.8708 c1ccc(-c2nc3cnccc3s2)cc1 Amb24088108 [0,1,0,1,0,0|2,0,0]=4 2202 B17R3.8708 c1ccc(-n2cc3ccccc3n2)cc1 Amb22460840 [0,1,0,1,0,0|2,0,0]=4 2203 B17R3.8708 c1ccc(-n2nc3ccccc3n2)cc1 Amb17843057 [0,1,0,1,0,0|2,0,0]=4 2204 B17R3.8708 c1ccc(C2Cc3ccccc3N2)cc1 Amb17777066 [0,1,0,1,0,0|2,0,0]=4 2205 B17R3.8708 c1ccc(C2Cc3ccccc3O2)cc1 Amb24084933 [0,1,0,1,0,0|1,1,0]=4 2206 B17R3.8708 c1ccc(N2Sc3ccccc3S2)cc1 Amb32667600 [0,1,0,1,0,0|1,0,0]=3 2207 B17R3.8708 c1ccc2sc(-c3ccncc3)nc2c1 Amb8275666 [0,1,0,1,0,0|2,0,0]=4 2208 B17R3.8708 c1cncc(-c2nc3ccccc3s2)c1 Amb6389417 [0,1,0,1,0,0|2,0,0]=4 2209 B17R3.3135 ClC1(c2ccccc2)Cc3ccccc31 Amb17844041 [0,1,0,1,0,0|2,0,0]=4 2210 B17R3.3135 OC1(c2ccccc2)Cc3ccccc31 Amb17778681 [0,1,0,1,0,0|2,0,0]=4 2211 B17R3.54615 Brc1cc2ccccc2c3ccccc13 Amb3939536 [0,1,0,1,0,0|2,0,0]=4 2212 B17R3.54615 Brc1nc2ccccc2c3ccccc13 Amb5721867 [0,1,0,1,0,0|2,0,0]=4 2213 B17R3.54615 Cc1cc2ccccc2c3ccccc13 Amb8477150 [0,1,0,1,0,0|2,0,0]=4 2214 B17R3.54615 Clc1cc2ccccc2c3ccccc13 Amb6366175 [0,1,0,1,0,0|2,0,0]=4 2215 B17R3.54615 Clc1nc2ccccc2c3ccccc13 Amb6331633 [0,1,0,1,0,0|2,0,0]=4 2216 B17R3.54615 Ic1cc2ccccc2c3ccccc13 Amb8480542 [0,1,0,1,0,0|2,0,0]=4 2217 B17R3.54615 Nc1cc2ccccc2c3ccccc13 Amb22230195 [0,1,0,1,0,0|2,0,0]=4 2218 B17R3.54615 O=C1Nc2ccccc2-c3ccccc31 Amb19063347 [0,1,0,1,0,0|2,0,0]=4 2219 B17R3.54615 O=C1Oc2ccccc2-c3ccccc31 Amb19766528 [0,1,0,1,0,0|1,1,0]=4 2220 B17R3.54615 O=S1Oc2ccccc2-c3ccccc31 Amb2611916 [0,1,0,1,0,0|0,1,1]=4 2221 B17R3.54615 O=[PH]1Oc2ccccc2-c3ccccc31 Amb8393219 [0,1,0,1,0,0|1,1,0]=4 2222 B17R3.54615 OB1Nc2ccccc2-c3ccccc31 Amb2611451 [0,1,0,1,0,0|2,0,0]=4 2223 B17R3.54615 OC1Cc2ccccc2-c3ccccc31 Amb17595191 [0,1,0,1,0,0|2,0,0]=4 2224 B17R3.54615 Oc1cc2ccccc2c3ccccc13 Amb17689153 [0,1,0,1,0,0|2,0,0]=4 2225 B17R3.54615 S=C1Nc2ccccc2-c3ccccc31 Amb21933605 [0,1,0,1,0,0|2,0,0]=4 2226 B17R3.18998 Brc1ccc2ccc3ccccc3c2c1 Amb13799001 [0,1,0,1,0,0|2,0,0]=4 2227 B17R3.18998 Cc1ccc2ccc3ccccc3c2c1 Amb17673342 [0,1,0,1,0,0|2,0,0]=4 2228 B17R3.18998 Clc1ccc2ccc3ccccc3c2c1 Amb21964024 [0,1,0,1,0,0|2,0,0]=4 2229 B17R3.18998 Ic1ccc2ccc3ccccc3c2c1 Amb21964027 [0,1,0,1,0,0|2,0,0]=4 2230 B17R3.18998 Oc1ccc2ccc3ccccc3c2c1 Amb17619234 [0,1,0,1,0,0|2,0,0]=4 2231 B17R3.31 Brc1ccc2c(ccc3ccccc32)c1 Amb15692739 [0,1,0,1,0,0|2,0,0]=4 2232 B17R3.31 Cc1ccc2c(ccc3ccccc32)c1 Amb4019439 [0,1,0,1,0,0|2,0,0]=4 2233 B17R3.31 Clc1ccc2c(ccc3ccccc32)c1 Amb15692736 [0,1,0,1,0,0|2,0,0]=4 2234 B17R3.31 Ic1ccc2c(ccc3ccccc32)c1 Amb21964754 [0,1,0,1,0,0|2,0,0]=4 2235 B17R3.31 Nc1ccc2c(c1)ncc3ccccc32 Amb24062186 [0,1,0,1,0,0|2,0,0]=4 2236 B17R3.31 Oc1ccc-2c(c1)OCc3ccccc32 Amb18652801 [0,1,0,1,0,0|1,1,0]=4 2237 B17R3.50084 Brc1cccc2c1-c3ccccc3CC2 Amb32415241 [0,1,0,1,0,0|2,0,0]=4 2238 B17R3.50084 Brc1cccc2c1-c3ccccc3CO2 Amb35825125 [0,1,0,1,0,0|1,1,0]=4 2239 B17R3.50084 Nc1cccc2c1-c3ccccc3CC2 Amb18652229 [0,1,0,1,0,0|2,0,0]=4 2240 B17R3.50084 Oc1cccc2c1-c3ccccc3CC2 Amb32415240 [0,1,0,1,0,0|2,0,0]=4 2241 B17R3.50084 Oc1cccc2c1-c3ccccc3CO2 Amb35826777 [0,1,0,1,0,0|1,1,0]=4 2242 B17R3.50084 Oc1cccc2c1-c3ccccc3OC2 Amb35826721 [0,1,0,1,0,0|1,1,0]=4 2243 B13R2.3 C1=CNC(c2ccccc2)C=C1 Amb27790782 [0,0,0,0,2,0|1,0,1]=4 2244 B13R2.3 c1cc(-c2ccncc2)ccn1 Amb2609993 [0,0,0,0,2,0|2,0,0]=4 2245 B13R2.3 c1cc[n+](-c2ccncc2)cc1 Amb24117484 [0,0,0,0,2,0|2,0,0]=4 2246 B13R2.3 c1cc[n+](-c2ccncc2)cc1 Amb4011619 [0,0,0,0,2,0|2,0,0]=4 2247 B13R2.3 c1cc[n+](-c2ccncc2)cc1 Amb8513303 [0,0,0,0,2,0|2,0,0]=4 2248 B13R2.3 c1ccc(-[n+]2ccccc2)cc1 Amb10553556 [0,0,0,0,2,0|1,0,0]=3 2249 B13R2.3 c1ccc(-c2ccccc2)cc1 Amb6608799 [0,0,0,0,2,0|0,0,0]=2 2250 B13R2.3 c1ccc(-c2ccccn2)cc1 Amb2696960 [0,0,0,0,2,0|1,0,0]=3 2251 B13R2.3 c1ccc(-c2ccccn2)cc1 Amb2780012 [0,0,0,0,2,0|1,0,0]=3 2252 B13R2.3 c1ccc(-c2ccccn2)nc1 Amb22353481 [0,0,0,0,2,0|2,0,0]=4 2253 B13R2.3 c1ccc(-c2ccccn2)nc1 Amb22730311 [0,0,0,0,2,0|2,0,0]=4 2254 B13R2.3 c1ccc(-c2ccccn2)nc1 Amb2384018 [0,0,0,0,2,0|2,0,0]=4 2255 B13R2.3 c1ccc(-c2ccccn2)nc1 Amb2687682 [0,0,0,0,2,0|2,0,0]=4 2256 B13R2.3 c1ccc(-c2cccnc2)cc1 Amb6608931 [0,0,0,0,2,0|1,0,0]=3 2257 B13R2.3 c1ccc(-c2cccnc2)nc1 Amb10066897 [0,0,0,0,2,0|2,0,0]=4 2258 B13R2.3 c1ccc(-c2cccnn2)cc1 Amb2732076 [0,0,0,0,2,0|2,0,0]=4 2259 B13R2.3 c1ccc(-c2ccncc2)cc1 Amb2609978 [0,0,0,0,2,0|1,0,0]=3 2260 B13R2.3 c1ccc(-c2ccncc2)nc1 Amb8513873 [0,0,0,0,2,0|2,0,0]=4 2261 B13R2.3 c1ccc(-c2ccncn2)cc1 Amb2609975 [0,0,0,0,2,0|2,0,0]=4 2262 B13R2.3 c1ccc(-c2cnccn2)cc1 Amb2610101 [0,0,0,0,2,0|2,0,0]=4 2263 B13R2.3 c1ccc(-c2cncnc2)cc1 Amb2196491 [0,0,0,0,2,0|2,0,0]=4 2264 B13R2.3 c1ccc(-c2ncccn2)cc1 Amb2447317 [0,0,0,0,2,0|2,0,0]=4 2265 B13R2.3 c1cncc(-c2ccncc2)c1 Amb26020164 [0,0,0,0,2,0|2,0,0]=4 2266 B13R2.3 c1cncc(-c2ccncc2)c1 Amb33465518 [0,0,0,0,2,0|2,0,0]=4 2267 B13R2.64 c1ccc(Cc2cccs2)cc1 Amb22045059 [0,0,0,0,2,0|2,0,0]=4 2268 B13R2.64 c1ccc(Cc2ccoc2)cc1 Amb27748433 [0,0,0,0,2,0|2,0,0]=4 2269 B13R2.64 c1ccc(Cn2cccc2)cc1 Amb9248735 [0,0,0,0,2,0|2,0,0]=4 2270 B13R2.64 c1ccc(Nc2ccco2)cc1 Amb27774843 [0,0,0,0,2,0|2,0,0]=4 2271 B13R2.64 c1ccc(Nc2cccs2)cc1 Amb24394931 [0,0,0,0,2,0|2,0,0]=4 2272 B13R2.64 c1ccc(Nc2ccsc2)cc1 Amb26974460 [0,0,0,0,2,0|2,0,0]=4 2273 B13R2.64 c1ccc(Nn2cccc2)cc1 Amb27207071 [0,0,0,0,2,0|2,0,0]=4 2274 B13R2.64 c1ccc(Oc2ccoc2)cc1 Amb10071966 [0,0,0,0,2,0|1,1,0]=4 2275 B13R2.64 c1ccc(Oc2ccsc2)cc1 Amb4477180 [0,0,0,0,2,0|1,1,0]=4 2276 B13R2.64 c1ccc(Sc2cccs2)cc1 Amb2724546 [0,0,0,0,2,0|1,0,0]=3 2277 B13R2.64 c1ccc(Sc2nccs2)cc1 Amb10573494 [0,0,0,0,2,0|2,0,0]=4 2278 B17R2.2382 C(=N\N=C\c1ccccc1)/c2ccccc2 Amb1419561 [0,0,0,0,0,2|2,0,0]=4 2279 B17R2.2382 C(C#Cc1ccccc1)#Cc2ccccc2 Amb17836434 [0,0,0,0,0,2|2,0,0]=4 2280 B17R2.2382 C(\C=C\c1ccccc1)=C/c2ccccc2 Amb2458220 [0,0,0,0,0,2|2,0,0]=4 2281 B17R2.2382 c1ccc(CCCNc2ccccc2)cc1 Amb4313446 [0,0,0,0,0,2|2,0,0]=4 2282 B17R2.2382 c1ccc(CCCSc2ccccc2)cc1 Amb4010759 [0,0,0,0,0,2|1,0,0]=3 2283 B17R2.2382 c1ccc(CCNCc2ccccc2)cc1 Amb1049050 [0,0,0,0,0,2|2,0,0]=4 2284 B17R2.2382 c1ccc(CCNCc2ccccc2)cc1 Amb33439 [0,0,0,0,0,2|2,0,0]=4 2285 B17R2.2382 c1ccc(CNOCc2ccccc2)cc1 Amb27611604 [0,0,0,0,0,2|1,1,0]=4 2286 B17R2.2382 c1ccc(CSSCc2ccccc2)cc1 Amb3978810 [0,0,0,0,0,2|0,0,0]=2 2287 B17R2.2382 c1ccc(C[Se][Se]Cc2ccccc2)cc1 Amb8515143 [0,0,0,0,0,2|0,2,0]=4 2288 B17R2.2382 c1ccc(NCCNc2ccccc2)cc1 Amb2720079 [0,0,0,0,0,2|2,0,0]=4 2289 B17R2.2382 c1ccc(OCCOc2ccccc2)cc1 Amb6356501 [0,0,0,0,0,2|0,2,0]=4 2290 B17R2.2382 c1ccc(SCCSc2ccccc2)cc1 Amb2684781 [0,0,0,0,0,2|0,0,0]=2 2291 B17R2.2382 c1ccc(\N=N\NNc2ccccc2)cc1 Amb21953597 [0,0,0,0,0,2|2,0,0]=4