0 B15R2.2195 C(#Cc1ccccc1)c2ccccc2 Amb8390026 [0,0,0,0,0,0|2,0,1]=3 1 B15R2.2195 C(#Cc1cccnc1)c2ccccc2 Amb8388336 [0,0,0,0,0,0|1,0,1]=2 2 B15R2.2195 C(#Cc1cccnc1)c2cccnc2 Amb16192298 [0,0,0,0,0,0|2,0,1]=3 3 B15R2.2195 C(#Cc1cncnc1)c2ccccc2 Amb3485535 [0,0,0,0,0,0|2,0,1]=3 4 B15R2.2195 C(=C/c1ccccc1)/c2ccccc2 Amb16192901 [0,0,0,0,0,0|2,0,1]=3 5 B15R2.2195 C(=C\c1ccccc1)/c2ccccc2 Amb18511865 [0,0,0,0,0,0|2,0,1]=3 6 B15R2.2195 C(=C\c1ccccn1)/c2ccccc2 Amb6430521 [0,0,0,0,0,0|3,0,1]=4 7 B15R2.2195 C(=C\c1ccccn1)/c2cccnc2 Amb4006368 [0,0,0,0,0,0|2,0,1]=3 8 B15R2.2195 C(=C\c1cccnc1)/c2ccccc2 Amb5718974 [0,0,0,0,0,0|1,0,1]=2 9 B15R2.2195 C(=C\c1cccnc1)/c2ccncc2 Amb27454085 [0,0,0,0,0,0|2,0,1]=3 10 B15R2.2195 C(=C\c1cccnn1)/c2ccccc2 Amb24589878 [0,0,0,0,0,0|2,0,1]=3 11 B15R2.2195 C(=C\c1ccncc1)/c2ccccc2 Amb2226978 [0,0,0,0,0,0|3,0,1]=4 12 B15R2.2195 C(=N\c1ccccc1)/c2ccccc2 Amb32411825 [0,0,0,0,0,0|1,0,2]=3 13 B15R2.2195 C(=N\c1ccccc1)/c2ccccn2 Amb25173927 [0,0,0,0,0,0|2,0,2]=4 14 B15R2.2195 C(=N\c1ccccc1)/c2ccncc2 Amb3693127 [0,0,0,0,0,0|2,0,2]=4 15 B15R2.2195 C1=C(CNc2ccccc2)CCCC1 Amb27387064 [0,0,0,0,0,0|1,0,3]=4 16 B15R2.2195 C1=C(CNc2ccccc2)OCCO1 Amb29866244 [0,0,0,0,0,0|2,0,2]=4 17 B15R2.2195 C1=CCC(CNc2ccccc2)CC1 Amb6719493 [0,0,0,0,0,0|1,0,3]=4 18 B15R2.2195 C1=COC(OCc2ccccc2)C=C1 Amb4011814 [0,0,0,0,0,0|3,0,1]=4 19 B15R2.2195 c1cc(CCc2ccncc2)ccn1 Amb6336326 [0,0,0,0,0,0|4,0,0]=4 20 B15R2.2195 c1cc(NCc2cnccn2)ccn1 Amb35654935 [0,0,0,0,0,0|2,0,0]=2 21 B15R2.2195 c1cc(NCc2cnccn2)ncn1 Amb35635434 [0,0,0,0,0,0|3,0,0]=3 22 B15R2.2195 c1cc[n+](CC[n+]2ccccc2)cc1 Amb2221672 [0,0,0,0,0,0|4,0,0]=4 23 B15R2.2195 c1ccc(CCc2ccccc2)cc1 Amb17678850 [0,0,0,0,0,0|2,0,0]=2 24 B15R2.2195 c1ccc(CCc2ccccn2)cc1 Amb5494186 [0,0,0,0,0,0|3,0,0]=3 25 B15R2.2195 c1ccc(CCc2ccccn2)nc1 Amb2713299 [0,0,0,0,0,0|4,0,0]=4 26 B15R2.2195 c1ccc(CCc2cccnc2)nc1 Amb6769550 [0,0,0,0,0,0|2,0,0]=2 27 B15R2.2195 c1ccc(CCc2ccncc2)cc1 Amb2612998 [0,0,0,0,0,0|3,0,0]=3 28 B15R2.2195 c1ccc(CCc2cnccn2)cc1 Amb15695191 [0,0,0,0,0,0|2,0,0]=2 29 B15R2.2195 c1ccc(CNc2ccccc2)cc1 Amb6355841 [0,0,0,0,0,0|1,0,0]=1 30 B15R2.2195 c1ccc(CNc2ccccn2)cc1 Amb1087875 [0,0,0,0,0,0|2,0,0]=2 31 B15R2.2195 c1ccc(CNc2ccccn2)nc1 Amb6642874 [0,0,0,0,0,0|3,0,0]=3 32 B15R2.2195 c1ccc(CNc2cccnc2)cc1 Amb2383000 [0,0,0,0,0,0|2,0,0]=2 33 B15R2.2195 c1ccc(CNc2cccnc2)nc1 Amb6686655 [0,0,0,0,0,0|3,0,0]=3 34 B15R2.2195 c1ccc(CNc2ccncc2)cc1 Amb597752 [0,0,0,0,0,0|2,0,0]=2 35 B15R2.2195 c1ccc(CNc2ccncc2)nc1 Amb6656695 [0,0,0,0,0,0|3,0,0]=3 36 B15R2.2195 c1ccc(CNc2ccncn2)cc1 Amb18973887 [0,0,0,0,0,0|3,0,0]=3 37 B15R2.2195 c1ccc(CNc2cnccn2)cc1 Amb2444500 [0,0,0,0,0,0|3,0,0]=3 38 B15R2.2195 c1ccc(CNc2cncnc2)cc1 Amb2612437 [0,0,0,0,0,0|3,0,0]=3 39 B15R2.2195 c1ccc(CNc2ncccn2)nc1 Amb6636882 [0,0,0,0,0,0|4,0,0]=4 40 B15R2.2195 c1ccc(CNc2ncncn2)cc1 Amb24347967 [0,0,0,0,0,0|4,0,0]=4 41 B15R2.2195 c1ccc(COc2ccccc2)cc1 Amb24097492 [0,0,0,0,0,0|2,0,0]=2 42 B15R2.2195 c1ccc(COc2ccccc2)cc1 Amb2691207 [0,0,0,0,0,0|2,0,0]=2 43 B15R2.2195 c1ccc(COc2ccccn2)cc1 Amb16191945 [0,0,0,0,0,0|3,0,0]=3 44 B15R2.2195 c1ccc(COc2cccnc2)cc1 Amb21927728 [0,0,0,0,0,0|2,0,0]=2 45 B15R2.2195 c1ccc(COc2cccnc2)nc1 Amb27236662 [0,0,0,0,0,0|3,0,0]=3 46 B15R2.2195 c1ccc(COc2ccncc2)cc1 Amb10603750 [0,0,0,0,0,0|3,0,0]=3 47 B15R2.2195 c1ccc(COc2cncnc2)cc1 Amb24098649 [0,0,0,0,0,0|3,0,0]=3 48 B15R2.2195 c1ccc(CSc2ccccc2)cc1 Amb2684670 [0,0,0,0,0,0|2,0,0]=2 49 B15R2.2195 c1ccc(CSc2ccccn2)cc1 Amb3862159 [0,0,0,0,0,0|3,0,0]=3 50 B15R2.2195 c1ccc(CSc2cccnn2)cc1 Amb25785634 [0,0,0,0,0,0|3,0,0]=3 51 B15R2.2195 c1ccc(CSc2ncccn2)cc1 Amb1263972 [0,0,0,0,0,0|4,0,0]=4 52 B15R2.2195 c1ccc(C[SiH2]c2ccccc2)cc1 Amb22347054 [0,0,0,0,0,0|2,0,0]=2 53 B15R2.2195 c1ccc(NCc2ccccn2)cc1 Amb6356069 [0,0,0,0,0,0|2,0,0]=2 54 B15R2.2195 c1ccc(NCc2cccnc2)cc1 Amb6356070 [0,0,0,0,0,0|0,0,0]=0 55 B15R2.2195 c1ccc(NCc2cccnc2)nc1 Amb2694194 [0,0,0,0,0,0|1,0,0]=1 56 B15R2.2195 c1ccc(NCc2ccncc2)cc1 Amb6356071 [0,0,0,0,0,0|2,0,0]=2 57 B15R2.2195 c1ccc(NCc2ccncc2)nc1 Amb6609621 [0,0,0,0,0,0|3,0,0]=3 58 B15R2.2195 c1ccc(NCc2cnccn2)nc1 Amb35635431 [0,0,0,0,0,0|2,0,0]=2 59 B15R2.2195 c1ccc(NCc2cncnc2)cc1 Amb18996444 [0,0,0,0,0,0|1,0,0]=1 60 B15R2.2195 c1ccc(NCc2cncnc2)nc1 Amb22749350 [0,0,0,0,0,0|2,0,0]=2 61 B15R2.2195 c1ccc(NNc2ccccc2)cc1 Amb28990937 [0,0,0,0,0,0|2,0,0]=2 62 B15R2.2195 c1ccc(NNc2ccccc2)cc1 Amb4000296 [0,0,0,0,0,0|2,0,0]=2 63 B15R2.2195 c1ccc(OCc2cccnc2)cc1 Amb27465872 [0,0,0,0,0,0|1,0,0]=1 64 B15R2.2195 c1ccc(OCc2ccncc2)cc1 Amb27217814 [0,0,0,0,0,0|3,0,0]=3 65 B15R2.2195 c1ccc(OCc2cnccn2)cc1 Amb35700555 [0,0,0,0,0,0|2,0,0]=2 66 B15R2.2195 c1ccc(OCc2ncccn2)cc1 Amb27181427 [0,0,0,0,0,0|4,0,0]=4 67 B15R2.2195 c1ccc(SC[n+]2ccccc2)cc1 Amb10568955 [0,0,0,0,0,0|3,0,0]=3 68 B15R2.2195 c1ccc(SCc2cccnc2)cc1 Amb10632429 [0,0,0,0,0,0|1,0,0]=1 69 B15R2.2195 c1ccc(SCc2cccnc2)nc1 Amb10710736 [0,0,0,0,0,0|2,0,0]=2 70 B15R2.2195 c1ccc(SCc2ccncc2)nc1 Amb25776849 [0,0,0,0,0,0|4,0,0]=4 71 B15R2.2195 c1ccc(SSc2ccccc2)cc1 Amb2687663 [0,0,0,0,0,0|3,0,0]=3 72 B15R2.2195 c1ccc([Se][Se]c2ccccc2)cc1 Amb4138616 [0,0,0,0,0,0|3,0,0]=3 73 B15R2.2195 c1ccc([Te][Te]c2ccccc2)cc1 Amb6366598 [0,0,0,0,0,0|3,0,0]=3 74 B15R2.2195 c1ccc(\N=N/c2ccccc2)cc1 Amb10843899 [0,0,0,0,0,0|2,0,1]=3 75 B15R2.2195 c1ccc(\N=N\c2ccccc2)cc1 Amb4408423 [0,0,0,0,0,0|2,0,1]=3 76 B15R2.2195 c1cnc(CNc2cnccn2)cn1 Amb35635433 [0,0,0,0,0,0|3,0,0]=3 77 B15R2.2195 c1cnc(NCc2ccncc2)nc1 Amb6641864 [0,0,0,0,0,0|4,0,0]=4 78 B15R2.2195 c1cnc(NCc2cnccn2)nc1 Amb35635432 [0,0,0,0,0,0|3,0,0]=3 79 B15R2.2195 c1cnc(NCc2cncnc2)cn1 Amb27826081 [0,0,0,0,0,0|3,0,0]=3 80 B15R2.2195 c1cncc(CNc2cccnc2)c1 Amb6686503 [0,0,0,0,0,0|1,0,0]=1 81 B15R2.2195 c1cncc(CNc2ccncc2)c1 Amb6614340 [0,0,0,0,0,0|1,0,0]=1 82 B15R2.2195 c1cncc(CNc2cncnc2)c1 Amb18933247 [0,0,0,0,0,0|2,0,0]=2 83 B15R2.2195 c1cncc(NCc2ccncc2)c1 Amb6686507 [0,0,0,0,0,0|3,0,0]=3 84 B15R2.2195 c1cncc(NCc2cncnc2)c1 Amb18996446 [0,0,0,0,0,0|2,0,0]=2 85 B15R2.2195 c1cncc(OCc2cnccn2)c1 Amb35722943 [0,0,0,0,0,0|3,0,0]=3 86 B15R2.2195 c1cncc(SSc2cccnc2)c1 Amb22002419 [0,0,0,0,0,0|3,0,0]=3 87 B15R2.2195 c1cnnc(CNc2cccnn2)c1 Amb27217161 [0,0,0,0,0,0|3,0,0]=3 88 B15R2.2195 c1cnnc(NCc2cnccn2)c1 Amb35635435 [0,0,0,0,0,0|3,0,0]=3 89 B16R2.71 Brc1ccccc1C#Cc2ccccc2 Amb8394446 [0,1,0,0,0,0|2,0,1]=4 90 B16R2.71 Brc1ccccc1CCc2nccnn2 Amb18883666 [0,1,0,0,0,0|3,0,0]=4 91 B16R2.71 Brc1ccccc1CNc2cccnc2 Amb6686658 [0,1,0,0,0,0|2,0,0]=3 92 B16R2.71 Brc1ccccc1CNc2cnccn2 Amb32411666 [0,1,0,0,0,0|3,0,0]=4 93 B16R2.71 Brc1ccccc1COc2ccccc2 Amb2724080 [0,1,0,0,0,0|2,0,0]=3 94 B16R2.71 Brc1ccccc1CSc2ccccc2 Amb22265930 [0,1,0,0,0,0|2,0,0]=3 95 B16R2.71 Brc1ccccc1NCc2ccccc2 Amb6696457 [0,1,0,0,0,0|1,0,0]=2 96 B16R2.71 Brc1ccccc1NCc2ccccn2 Amb6696465 [0,1,0,0,0,0|2,0,0]=3 97 B16R2.71 Brc1ccccc1NCc2cccnc2 Amb6696374 [0,1,0,0,0,0|0,0,0]=1 98 B16R2.71 Brc1ccccc1NCc2ccncc2 Amb4002542 [0,1,0,0,0,0|2,0,0]=3 99 B16R2.71 Brc1ccccc1NCc2cncnc2 Amb33212675 [0,1,0,0,0,0|1,0,0]=2 100 B16R2.71 Brc1ccccc1OCc2ccccc2 Amb6665080 [0,1,0,0,0,0|2,0,0]=3 101 B16R2.71 Brc1ccccc1OCc2ccccn2 Amb6256204 [0,1,0,0,0,0|3,0,0]=4 102 B16R2.71 Brc1ccccc1OCc2cccnc2 Amb6273762 [0,1,0,0,0,0|1,0,0]=2 103 B16R2.71 Brc1ccccc1OCc2cnccn2 Amb30018078 [0,1,0,0,0,0|2,0,0]=3 104 B16R2.71 Brc1cccnc1NCc2cccnc2 Amb27791668 [0,1,0,0,0,0|1,0,0]=2 105 B16R2.71 Brc1cccnc1NCc2ccncc2 Amb27635151 [0,1,0,0,0,0|3,0,0]=4 106 B16R2.71 Brc1cccnc1NCc2cnccn2 Amb35654718 [0,1,0,0,0,0|2,0,0]=3 107 B16R2.71 Brc1cccnc1OCc2ccccc2 Amb21856407 [0,1,0,0,0,0|3,0,0]=4 108 B16R2.71 Brc1cccnc1OCc2cccnc2 Amb27434350 [0,1,0,0,0,0|2,0,0]=3 109 B16R2.71 Brc1cccnc1SCc2ccccc2 Amb27152053 [0,1,0,0,0,0|3,0,0]=4 110 B16R2.71 Brc1ccncc1OCc2ccccc2 Amb27209054 [0,1,0,0,0,0|2,0,0]=3 111 B16R2.71 Brc1cnccc1NCc2ccncc2 Amb27611454 [0,1,0,0,0,0|3,0,0]=4 112 B16R2.71 Brc1cnccc1NCc2cnccn2 Amb35654720 [0,1,0,0,0,0|2,0,0]=3 113 B16R2.71 Brc1cnccc1OCc2ccccc2 Amb27230531 [0,1,0,0,0,0|3,0,0]=4 114 B16R2.71 Brc1cnccc1SCc2ccccc2 Amb27976296 [0,1,0,0,0,0|3,0,0]=4 115 B16R2.71 Brc1cncnc1NCc2cccnn2 Amb27842575 [0,1,0,0,0,0|3,0,0]=4 116 B16R2.71 Brc1cncnc1NCc2cnccn2 Amb35654721 [0,1,0,0,0,0|3,0,0]=4 117 B16R2.71 Brc1ncccc1OCc2ccccc2 Amb13889959 [0,1,0,0,0,0|2,0,0]=3 118 B16R2.71 Brc1ncccc1OCc2ccccn2 Amb10601227 [0,1,0,0,0,0|3,0,0]=4 119 B16R2.71 Brc1ncccc1OCc2cccnc2 Amb10601228 [0,1,0,0,0,0|2,0,0]=3 120 B16R2.71 Brc1ncccc1OCc2ccncc2 Amb10601229 [0,1,0,0,0,0|3,0,0]=4 121 B16R2.71 Brc1ncccc1OCc2cnccn2 Amb35723055 [0,1,0,0,0,0|3,0,0]=4 122 B16R2.71 Brc1ncncc1OCc2ccccc2 Amb27962395 [0,1,0,0,0,0|3,0,0]=4 123 B16R2.71 C[n+]1ccccc1OCc2ccccc2 Amb10601695 [0,1,0,0,0,0|3,0,0]=4 124 B16R2.71 Cc1ccccc1CNc2ccccc2 Amb4313317 [0,1,0,0,0,0|1,0,0]=2 125 B16R2.71 Cc1ccccc1CNc2cccnc2 Amb6686478 [0,1,0,0,0,0|2,0,0]=3 126 B16R2.71 Cc1ccccc1CNc2cnccn2 Amb18979404 [0,1,0,0,0,0|3,0,0]=4 127 B16R2.71 Cc1ccccc1NCc2ccccc2 Amb11014339 [0,1,0,0,0,0|1,0,0]=2 128 B16R2.71 Cc1ccccc1NCc2ccccc2 Amb838871 [0,1,0,0,0,0|1,0,0]=2 129 B16R2.71 Cc1ccccc1NCc2ccccn2 Amb6701235 [0,1,0,0,0,0|2,0,0]=3 130 B16R2.71 Cc1ccccc1NCc2cccnc2 Amb6701128 [0,1,0,0,0,0|0,0,0]=1 131 B16R2.71 Cc1ccccc1NCc2ccncc2 Amb6286265 [0,1,0,0,0,0|2,0,0]=3 132 B16R2.71 Cc1ccccc1NCc2cncnc2 Amb18300802 [0,1,0,0,0,0|1,0,0]=2 133 B16R2.71 Cc1ccccc1OCc2ccccc2 Amb2447370 [0,1,0,0,0,0|2,0,0]=3 134 B16R2.71 Cc1ccncc1NCc2ccccc2 Amb25170961 [0,1,0,0,0,0|2,0,0]=3 135 B16R2.71 Cc1ccncc1NCc2ccccn2 Amb33496316 [0,1,0,0,0,0|3,0,0]=4 136 B16R2.71 Cc1ccncc1NCc2cccnc2 Amb33496309 [0,1,0,0,0,0|1,0,0]=2 137 B16R2.71 Cc1ccncc1NCc2ccncc2 Amb33496311 [0,1,0,0,0,0|3,0,0]=4 138 B16R2.71 Cc1ccncc1NCc2cncnc2 Amb33496326 [0,1,0,0,0,0|2,0,0]=3 139 B16R2.71 Cc1cncnc1NCc2ccccc2 Amb27625086 [0,1,0,0,0,0|3,0,0]=4 140 B16R2.71 Cc1ncccc1NCc2ccccc2 Amb26642123 [0,1,0,0,0,0|2,0,0]=3 141 B16R2.71 Cc1ncccc1NCc2ccccn2 Amb33363174 [0,1,0,0,0,0|3,0,0]=4 142 B16R2.71 Cc1ncccc1NCc2cccnc2 Amb33363175 [0,1,0,0,0,0|1,0,0]=2 143 B16R2.71 Cc1ncccc1NCc2ccncc2 Amb31371741 [0,1,0,0,0,0|3,0,0]=4 144 B16R2.71 Cc1ncccc1NCc2cncnc2 Amb33363186 [0,1,0,0,0,0|2,0,0]=3 145 B16R2.71 Cc1ncncc1NCc2ccccc2 Amb27478499 [0,1,0,0,0,0|3,0,0]=4 146 B16R2.71 Clc1ccccc1CNc2ccccc2 Amb4313409 [0,1,0,0,0,0|1,0,0]=2 147 B16R2.71 Clc1ccccc1CNc2ccccn2 Amb2382990 [0,1,0,0,0,0|2,0,0]=3 148 B16R2.71 Clc1ccccc1CNc2cccnc2 Amb2383003 [0,1,0,0,0,0|2,0,0]=3 149 B16R2.71 Clc1ccccc1CNc2cccnc2 Amb24079952 [0,1,0,0,0,0|2,0,0]=3 150 B16R2.71 Clc1ccccc1CNc2ccncc2 Amb24079953 [0,1,0,0,0,0|2,0,0]=3 151 B16R2.71 Clc1ccccc1CNc2cncnc2 Amb18270140 [0,1,0,0,0,0|3,0,0]=4 152 B16R2.71 Clc1ccccc1CNc2ncccn2 Amb6636471 [0,1,0,0,0,0|3,0,0]=4 153 B16R2.71 Clc1ccccc1NCc2ccccc2 Amb4313268 [0,1,0,0,0,0|1,0,0]=2 154 B16R2.71 Clc1ccccc1NCc2ccccn2 Amb6696917 [0,1,0,0,0,0|2,0,0]=3 155 B16R2.71 Clc1ccccc1NCc2cccnc2 Amb6696851 [0,1,0,0,0,0|0,0,0]=1 156 B16R2.71 Clc1ccccc1NCc2ccncc2 Amb6696855 [0,1,0,0,0,0|2,0,0]=3 157 B16R2.71 Clc1ccccc1NCc2cncnc2 Amb18300793 [0,1,0,0,0,0|1,0,0]=2 158 B16R2.71 Clc1ccccc1OCc2ccccc2 Amb28141643 [0,1,0,0,0,0|2,0,0]=3 159 B16R2.71 Clc1cccnc1NCc2ccccc2 Amb6638612 [0,1,0,0,0,0|2,0,0]=3 160 B16R2.71 Clc1ncccc1CNc2ccccc2 Amb16691142 [0,1,0,0,0,0|0,0,0]=1 161 B16R2.71 Clc1ncccc1CSc2ccncc2 Amb27173398 [0,1,0,0,0,0|2,0,0]=3 162 B16R2.71 Clc1ncccc1CSc2cnccn2 Amb27649427 [0,1,0,0,0,0|3,0,0]=4 163 B16R2.71 Clc1ncccc1CSc2ncccn2 Amb27954536 [0,1,0,0,0,0|3,0,0]=4 164 B16R2.71 Clc1ncccc1NCc2ccccc2 Amb9555488 [0,1,0,0,0,0|2,0,0]=3 165 B16R2.71 Clc1ncccc1OCc2ccccc2 Amb2611987 [0,1,0,0,0,0|2,0,0]=3 166 B16R2.71 Clc1ncccc1OCc2cnccn2 Amb35723052 [0,1,0,0,0,0|3,0,0]=4 167 B16R2.71 Clc1nccnc1CCc2ccccc2 Amb28125268 [0,1,0,0,0,0|2,0,0]=3 168 B16R2.71 Clc1nccnc1NCc2ccccc2 Amb18293478 [0,1,0,0,0,0|3,0,0]=4 169 B16R2.71 Clc1nccnc1NCc2cccnc2 Amb18981259 [0,1,0,0,0,0|2,0,0]=3 170 B16R2.71 Clc1nccnc1NCc2cccnn2 Amb27807298 [0,1,0,0,0,0|3,0,0]=4 171 B16R2.71 Clc1nccnc1NCc2cnccn2 Amb30036273 [0,1,0,0,0,0|3,0,0]=4 172 B16R2.71 Clc1nccnc1OCc2ccccc2 Amb28380927 [0,1,0,0,0,0|3,0,0]=4 173 B16R2.71 Clc1nccnc1OCc2cccnc2 Amb25027682 [0,1,0,0,0,0|3,0,0]=4 174 B16R2.71 Clc1ncncc1OCc2ccccc2 Amb22234502 [0,1,0,0,0,0|3,0,0]=4 175 B16R2.71 Clc1nnccc1OCc2ccccc2 Amb23402477 [0,1,0,0,0,0|3,0,0]=4 176 B16R2.71 Fc1ccccc1CNc2ccccc2 Amb4304157 [0,1,0,0,0,0|1,0,0]=2 177 B16R2.71 Fc1ccccc1CNc2ccccn2 Amb6648620 [0,1,0,0,0,0|2,0,0]=3 178 B16R2.71 Fc1ccccc1CNc2ccncc2 Amb33545756 [0,1,0,0,0,0|2,0,0]=3 179 B16R2.71 Fc1ccccc1COc2cnccn2 Amb33619065 [0,1,0,0,0,0|3,0,0]=4 180 B16R2.71 Fc1ccccc1NCc2ccccc2 Amb33527612 [0,1,0,0,0,0|1,0,0]=2 181 B16R2.71 Fc1ccccc1NCc2ccccc2 Amb6697374 [0,1,0,0,0,0|1,0,0]=2 182 B16R2.71 Fc1ccccc1NCc2ccccn2 Amb6697384 [0,1,0,0,0,0|2,0,0]=3 183 B16R2.71 Fc1ccccc1NCc2cccnc2 Amb6697270 [0,1,0,0,0,0|0,0,0]=1 184 B16R2.71 Fc1ccccc1NCc2ccncc2 Amb6697275 [0,1,0,0,0,0|2,0,0]=3 185 B16R2.71 Fc1ccccc1NCc2cncnc2 Amb18996457 [0,1,0,0,0,0|1,0,0]=2 186 B16R2.71 Fc1ccccc1OCc2ccccc2 Amb8392535 [0,1,0,0,0,0|2,0,0]=3 187 B16R2.71 Fc1cccnc1NCc2ccccc2 Amb18300631 [0,1,0,0,0,0|2,0,0]=3 188 B16R2.71 Fc1ncccc1NCc2ccccc2 Amb35693144 [0,1,0,0,0,0|2,0,0]=3 189 B16R2.71 Fc1ncccc1OCc2ccccc2 Amb27452907 [0,1,0,0,0,0|2,0,0]=3 190 B16R2.71 Fc1ncccc1OCc2ccncc2 Amb27805658 [0,1,0,0,0,0|3,0,0]=4 191 B16R2.71 Fc1ncccc1OCc2cnccn2 Amb35723051 [0,1,0,0,0,0|3,0,0]=4 192 B16R2.71 Fc1nccnc1NCc2ccccc2 Amb35729328 [0,1,0,0,0,0|3,0,0]=4 193 B16R2.71 Fc1nccnc1NCc2cccnc2 Amb35729329 [0,1,0,0,0,0|2,0,0]=3 194 B16R2.71 Fc1nccnc1NCc2cccnn2 Amb35729333 [0,1,0,0,0,0|3,0,0]=4 195 B16R2.71 Fc1nccnc1NCc2cnccn2 Amb35654739 [0,1,0,0,0,0|3,0,0]=4 196 B16R2.71 Fc1nccnc1OCc2ccccc2 Amb35729165 [0,1,0,0,0,0|3,0,0]=4 197 B16R2.71 Fc1nccnc1OCc2cccnc2 Amb35729169 [0,1,0,0,0,0|3,0,0]=4 198 B16R2.71 Fc1nccnc1SCc2ccccc2 Amb35714691 [0,1,0,0,0,0|3,0,0]=4 199 B16R2.71 Ic1ccccc1COc2ccccc2 Amb32410434 [0,1,0,0,0,0|2,0,0]=3 200 B16R2.71 Ic1ccccc1NCc2ccccc2 Amb7760756 [0,1,0,0,0,0|1,0,0]=2 201 B16R2.71 Ic1ccccc1NCc2ccccn2 Amb9208194 [0,1,0,0,0,0|2,0,0]=3 202 B16R2.71 Ic1ccccc1NCc2cccnc2 Amb9208198 [0,1,0,0,0,0|0,0,0]=1 203 B16R2.71 Ic1ccccc1NCc2ccncc2 Amb9203694 [0,1,0,0,0,0|2,0,0]=3 204 B16R2.71 Ic1ccccc1NCc2cncnc2 Amb33212677 [0,1,0,0,0,0|1,0,0]=2 205 B16R2.71 Ic1ccccc1OCc2ccccc2 Amb22232803 [0,1,0,0,0,0|2,0,0]=3 206 B16R2.71 Ic1ccccc1OCc2cccnc2 Amb27773280 [0,1,0,0,0,0|1,0,0]=2 207 B16R2.71 Ic1ccccc1OCc2ccncc2 Amb27486174 [0,1,0,0,0,0|3,0,0]=4 208 B16R2.71 Ic1ccccc1OCc2cnccn2 Amb35722523 [0,1,0,0,0,0|2,0,0]=3 209 B16R2.71 Ic1cncnc1NCc2ccccc2 Amb27391966 [0,1,0,0,0,0|3,0,0]=4 210 B16R2.71 Ic1cncnc1NCc2cccnc2 Amb27473192 [0,1,0,0,0,0|2,0,0]=3 211 B16R2.71 Ic1cncnc1NCc2cnccn2 Amb35654723 [0,1,0,0,0,0|3,0,0]=4 212 B16R2.71 Nc1ccccc1C#Cc2ccccc2 Amb1772819 [0,1,0,0,0,0|2,0,1]=4 213 B16R2.71 Nc1ccccc1CCc2ccccc2 Amb17843031 [0,1,0,0,0,0|2,0,0]=3 214 B16R2.71 Nc1ccccc1CCc2ccccc2 Amb21954211 [0,1,0,0,0,0|2,0,0]=3 215 B16R2.71 Nc1ccccc1CCc2ccccn2 Amb1092119 [0,1,0,0,0,0|3,0,0]=4 216 B16R2.71 Nc1ccccc1CCc2cccnc2 Amb22011444 [0,1,0,0,0,0|1,0,0]=2 217 B16R2.71 Nc1ccccc1CCc2ccncc2 Amb1087951 [0,1,0,0,0,0|3,0,0]=4 218 B16R2.71 Nc1ccccc1CCc2nccnn2 Amb18864292 [0,1,0,0,0,0|3,0,0]=4 219 B16R2.71 Nc1ccccc1CNc2ccccc2 Amb18973315 [0,1,0,0,0,0|1,0,0]=2 220 B16R2.71 Nc1ccccc1CNc2ccccn2 Amb17100062 [0,1,0,0,0,0|2,0,0]=3 221 B16R2.71 Nc1ccccc1CNc2ccncc2 Amb18984737 [0,1,0,0,0,0|2,0,0]=3 222 B16R2.71 Nc1ccccc1COc2ccccc2 Amb2724081 [0,1,0,0,0,0|2,0,0]=3 223 B16R2.71 Nc1ccccc1NCc2ccccc2 Amb7764683 [0,1,0,0,0,0|1,0,0]=2 224 B16R2.71 Nc1ccccc1NCc2ccccn2 Amb9205292 [0,1,0,0,0,0|2,0,0]=3 225 B16R2.71 Nc1ccccc1NCc2cccnc2 Amb7768126 [0,1,0,0,0,0|0,0,0]=1 226 B16R2.71 Nc1ccccc1NCc2ccncc2 Amb7768116 [0,1,0,0,0,0|2,0,0]=3 227 B16R2.71 Nc1ccccc1NNc2ccccc2 Amb17777429 [0,1,0,0,0,0|2,0,0]=3 228 B16R2.71 Nc1ccccc1OCc2ccccc2 Amb1119599 [0,1,0,0,0,0|2,0,0]=3 229 B16R2.71 Nc1ccccc1OCc2ccccc2 Amb18369109 [0,1,0,0,0,0|2,0,0]=3 230 B16R2.71 Nc1ccccc1OCc2ccccn2 Amb1084282 [0,1,0,0,0,0|3,0,0]=4 231 B16R2.71 Nc1ccccc1OCc2ccccn2 Amb8503355 [0,1,0,0,0,0|3,0,0]=4 232 B16R2.71 Nc1ccccc1OCc2cccnc2 Amb22282186 [0,1,0,0,0,0|1,0,0]=2 233 B16R2.71 Nc1ccccc1OCc2cccnc2 Amb33536530 [0,1,0,0,0,0|1,0,0]=2 234 B16R2.71 Nc1ccccc1OCc2nccnn2 Amb18864523 [0,1,0,0,0,0|3,0,0]=4 235 B16R2.71 Nc1ccccc1SCc2ccccc2 Amb1216619 [0,1,0,0,0,0|2,0,0]=3 236 B16R2.71 Nc1ccccc1SCc2ccccn2 Amb2889101 [0,1,0,0,0,0|3,0,0]=4 237 B16R2.71 Nc1ccccc1\C=C\c2ccccc2 Amb21947815 [0,1,0,0,0,0|2,0,1]=4 238 B16R2.71 Nc1cccnc1NCc2ccccc2 Amb7172721 [0,1,0,0,0,0|2,0,0]=3 239 B16R2.71 Nc1cccnc1NCc2ccccn2 Amb7768031 [0,1,0,0,0,0|3,0,0]=4 240 B16R2.71 Nc1cccnc1NCc2cccnc2 Amb33529105 [0,1,0,0,0,0|1,0,0]=2 241 B16R2.71 Nc1cccnc1NCc2ccncc2 Amb7768113 [0,1,0,0,0,0|3,0,0]=4 242 B16R2.71 Nc1cccnc1OCc2ccccc2 Amb1136051 [0,1,0,0,0,0|3,0,0]=4 243 B16R2.71 Nc1ccncc1NCc2ccccc2 Amb17933223 [0,1,0,0,0,0|2,0,0]=3 244 B16R2.71 Nc1ccncc1OCc2ccccc2 Amb25184191 [0,1,0,0,0,0|2,0,0]=3 245 B16R2.71 Nc1cnccc1NCc2ccccc2 Amb7767649 [0,1,0,0,0,0|2,0,0]=3 246 B16R2.71 Nc1cnccc1NCc2ccccn2 Amb7768026 [0,1,0,0,0,0|3,0,0]=4 247 B16R2.71 Nc1cnccc1NCc2cccnc2 Amb7768118 [0,1,0,0,0,0|1,0,0]=2 248 B16R2.71 Nc1cnccc1OCc2ccccc2 Amb7765080 [0,1,0,0,0,0|3,0,0]=4 249 B16R2.71 Nc1ncccc1NCc2ccccc2 Amb15701551 [0,1,0,0,0,0|2,0,0]=3 250 B16R2.71 Nc1ncccc1OCc2ccccc2 Amb2719821 [0,1,0,0,0,0|2,0,0]=3 251 B16R2.71 Nc1ncccc1OCc2ccccn2 Amb9208366 [0,1,0,0,0,0|3,0,0]=4 252 B16R2.71 Nc1ncccc1OCc2cccnc2 Amb9208365 [0,1,0,0,0,0|2,0,0]=3 253 B16R2.71 Nc1ncccc1OCc2ccncc2 Amb9208356 [0,1,0,0,0,0|3,0,0]=4 254 B16R2.71 Nc1ncccc1\N=C\c2ccccc2 Amb16186861 [0,1,0,0,0,0|2,0,0]=3 255 B16R2.71 Nc1nccnc1C#Cc2ccccc2 Amb22496075 [0,1,0,0,0,0|2,0,1]=4 256 B16R2.71 Nc1nccnc1OCc2ccccc2 Amb10601931 [0,1,0,0,0,0|3,0,0]=4 257 B16R2.71 O=C1C=CC=CN1CCc2ccccc2 Amb33330037 [0,1,0,0,0,0|3,0,0]=4 258 B16R2.71 O=C1C=CC=CN1OCc2ccccc2 Amb21994776 [0,1,0,0,0,0|3,0,0]=4 259 B16R2.71 O=C1C=CN=CN1OCc2ccccc2 Amb27968077 [0,1,0,0,0,0|3,0,0]=4 260 B16R2.71 O=C1C=COC=C1OCc2ccccc2 Amb21962788 [0,1,0,0,0,0|3,0,0]=4 261 B16R2.71 O=C1NC=CC=C1OCc2ccccc2 Amb18537465 [0,1,0,0,0,0|2,0,1]=4 262 B16R2.71 O=c1ccocc1OCc2ccccc2 Amb22270207 [0,1,0,0,0,0|3,0,0]=4 263 B16R2.71 Oc1ccccc1CCc2ccccc2 Amb17843033 [0,1,0,0,0,0|2,0,0]=3 264 B16R2.71 Oc1ccccc1CNc2ccccc2 Amb2720827 [0,1,0,0,0,0|1,0,0]=2 265 B16R2.71 Oc1ccccc1CNc2ccccn2 Amb33276251 [0,1,0,0,0,0|2,0,0]=3 266 B16R2.71 Oc1ccccc1CNc2cccnc2 Amb2692216 [0,1,0,0,0,0|2,0,0]=3 267 B16R2.71 Oc1ccccc1NCc2ccccc2 Amb1076536 [0,1,0,0,0,0|1,0,0]=2 268 B16R2.71 Oc1ccccc1NCc2ccccn2 Amb22901094 [0,1,0,0,0,0|2,0,0]=3 269 B16R2.71 Oc1ccccc1OCc2ccccc2 Amb2583282 [0,1,0,0,0,0|2,0,0]=3 270 B16R2.71 Oc1ccccc1\C=C\c2ccccc2 Amb17920449 [0,1,0,0,0,0|2,0,1]=4 271 B16R2.71 Oc1ccccc1\C=N\c2ccccc2 Amb2386606 [0,1,0,0,0,0|1,0,2]=4 272 B16R2.71 Oc1ccccc1\N=N\c2ccccc2 Amb21812043 [0,1,0,0,0,0|2,0,1]=4 273 B16R2.71 Oc1cccnc1OCc2ccccc2 Amb2699423 [0,1,0,0,0,0|3,0,0]=4 274 B16R2.71 Oc1ccncc1OCc2ccccc2 Amb26457014 [0,1,0,0,0,0|2,0,0]=3 275 B16R2.71 Oc1cnccc1OCc2ccccc2 Amb25184181 [0,1,0,0,0,0|3,0,0]=4 276 B16R2.71 Oc1ncncc1OCc2ccccc2 Amb18653830 [0,1,0,0,0,0|3,0,0]=4 277 B16R2.71 Sc1ccccc1NCc2ccccc2 Amb27643633 [0,1,0,0,0,0|1,0,0]=2 278 B16R2.71 Sc1ccccc1OCc2ccccc2 Amb26321985 [0,1,0,0,0,0|2,0,0]=3 279 B16R2.71 [NH3+]c1ccccc1\C=C/c2ccccc2 Amb31302363 [0,1,0,0,0,0|2,0,1]=4 280 B16R2.71 [NH3+]c1ccccc1\C=C\c2ccccc2 Amb17777295 [0,1,0,0,0,0|2,0,1]=4 281 B16R2.71 [O-]c1ccccc1CNc2cccc[nH+]2 Amb4229463 [0,1,0,0,0,0|2,0,0]=3 282 B16R2.88 BrC(Cc1ccccc1)c2ccccc2 Amb9210661 [0,1,0,0,0,0|2,0,0]=3 283 B16R2.88 BrC(Cc1ccccc1)c2ccccn2 Amb29845392 [0,1,0,0,0,0|3,0,0]=4 284 B16R2.88 BrC(Cc1ccccc1)c2cccnc2 Amb29845394 [0,1,0,0,0,0|1,0,0]=2 285 B16R2.88 BrC(Cc1ccccc1)c2ccncc2 Amb29845396 [0,1,0,0,0,0|3,0,0]=4 286 B16R2.88 BrC(Cc1ccncc1)c2ccccc2 Amb28040756 [0,1,0,0,0,0|3,0,0]=4 287 B16R2.88 CC(Nc1ccccc1)c2ccccc2 Amb4017037 [0,1,0,0,0,0|1,0,0]=2 288 B16R2.88 CC(Nc1ccccc1)c2ccccn2 Amb534556 [0,1,0,0,0,0|2,0,0]=3 289 B16R2.88 CC(Nc1ccccc1)c2cccnc2 Amb9739106 [0,1,0,0,0,0|0,0,0]=1 290 B16R2.88 CC(Nc1ccccc1)c2ccncc2 Amb6356068 [0,1,0,0,0,0|2,0,0]=3 291 B16R2.88 CC(Nc1ccccn1)c2ccccc2 Amb6645085 [0,1,0,0,0,0|2,0,0]=3 292 B16R2.88 CC(Nc1ncccn1)c2ccccc2 Amb6620029 [0,1,0,0,0,0|3,0,0]=4 293 B16R2.88 CN(Cc1ccccc1)c2ccccc2 Amb9787584 [0,1,0,0,0,0|1,0,0]=2 294 B16R2.88 CN(Cc1ccccc1)c2ccccn2 Amb17967451 [0,1,0,0,0,0|2,0,0]=3 295 B16R2.88 CN(Cc1ccccc1)c2cccnc2 Amb17967452 [0,1,0,0,0,0|2,0,0]=3 296 B16R2.88 C\C(=N/c1ccccc1)c2ccccc2 Amb17779517 [0,1,0,0,0,0|1,0,2]=4 297 B16R2.88 ClC(Cc1ccccc1)c2ccccc2 Amb9749535 [0,1,0,0,0,0|2,0,0]=3 298 B16R2.88 ClC(Cc1ccccn1)c2ccccc2 Amb27989133 [0,1,0,0,0,0|3,0,0]=4 299 B16R2.88 ClC(Cc1ccncc1)c2cccnc2 Amb27195491 [0,1,0,0,0,0|2,0,0]=3 300 B16R2.88 Cl\C(=N/c1cccnc1)c2ccccc2 Amb32668811 [0,1,0,0,0,0|2,0,0]=3 301 B16R2.88 N=C(Nc1ccccc1)c2ccccc2 Amb1644481 [0,1,0,0,0,0|1,0,1]=3 302 B16R2.88 NC(Cc1ccccc1)c2ccccc2 Amb1657727 [0,1,0,0,0,0|2,0,0]=3 303 B16R2.88 NC(Cc1ccccc1)c2ccccc2 Amb3431767 [0,1,0,0,0,0|2,0,0]=3 304 B16R2.88 NC(Cc1ccccc1)c2ccccn2 Amb10610594 [0,1,0,0,0,0|3,0,0]=4 305 B16R2.88 NC(Cc1ccccc1)c2cccnc2 Amb18289054 [0,1,0,0,0,0|1,0,0]=2 306 B16R2.88 NC(Cc1ccccc1)c2ccncc2 Amb18289050 [0,1,0,0,0,0|3,0,0]=4 307 B16R2.88 NC(Cc1ccccc1)c2nccnn2 Amb18864298 [0,1,0,0,0,0|3,0,0]=4 308 B16R2.88 NC(Cc1ccccn1)c2ccccc2 Amb32666135 [0,1,0,0,0,0|3,0,0]=4 309 B16R2.88 NC(Cc1ccccn1)c2ccccc2 Amb7772122 [0,1,0,0,0,0|3,0,0]=4 310 B16R2.88 NC(Cc1ccccn1)c2cccnc2 Amb33528629 [0,1,0,0,0,0|2,0,0]=3 311 B16R2.88 NN(Cc1ccccc1)c2ccccc2 Amb3620838 [0,1,0,0,0,0|1,0,0]=2 312 B16R2.88 NN(Cc1ccccc1)c2ccccc2 Amb4397512 [0,1,0,0,0,0|1,0,0]=2 313 B16R2.88 NN(Cc1ccccc1)c2ncccn2 Amb29848005 [0,1,0,0,0,0|3,0,0]=4 314 B16R2.88 N[C@@H](Cc1ccccn1)c2ccccc2 Amb26304416 [0,1,0,0,0,0|3,0,0]=4 315 B16R2.88 N[C@@H](Cc1ccccn1)c2ccccc2 Amb33140984 [0,1,0,0,0,0|3,0,0]=4 316 B16R2.88 N\C(=N/c1cccnc1)c2ccccc2 Amb33362314 [0,1,0,0,0,0|2,0,0]=3 317 B16R2.88 N\C(=N\c1ccccc1)c2ccccc2 Amb3318637 [0,1,0,0,0,0|1,0,2]=4 318 B16R2.88 O=C(C[n+]1ccccc1)c2ccccc2 Amb2228102 [0,1,0,0,0,0|3,0,0]=4 319 B16R2.88 O=C(Cc1ccccc1)c2ccccc2 Amb1205838 [0,1,0,0,0,0|2,0,0]=3 320 B16R2.88 O=C(Cc1ccccc1)c2ccccn2 Amb10554500 [0,1,0,0,0,0|3,0,0]=4 321 B16R2.88 O=C(Cc1ccccc1)c2cccnc2 Amb5720532 [0,1,0,0,0,0|1,0,1]=3 322 B16R2.88 O=C(Cc1ccccc1)c2ccncc2 Amb33534977 [0,1,0,0,0,0|3,0,0]=4 323 B16R2.88 O=C(Cc1ccccn1)c2ccccc2 Amb33529218 [0,1,0,0,0,0|3,0,0]=4 324 B16R2.88 O=C(Cc1ccccn1)c2cccnc2 Amb4017162 [0,1,0,0,0,0|2,0,1]=4 325 B16R2.88 O=C(Cc1cccnc1)c2ccccn2 Amb28322331 [0,1,0,0,0,0|2,0,0]=3 326 B16R2.88 O=C(Cc1cccnc1)c2ccncn2 Amb27797045 [0,1,0,0,0,0|3,0,0]=4 327 B16R2.88 O=C(Cc1cccnc1)c2cnccn2 Amb27948372 [0,1,0,0,0,0|3,0,0]=4 328 B16R2.88 O=C(Cc1ccncc1)c2ccccc2 Amb33530368 [0,1,0,0,0,0|3,0,0]=4 329 B16R2.88 O=C(Cc1ccncc1)c2cccnc2 Amb19083421 [0,1,0,0,0,0|2,0,1]=4 330 B16R2.88 O=C(Cc1cnccn1)c2ccccc2 Amb2691341 [0,1,0,0,0,0|2,0,0]=3 331 B16R2.88 O=C(Cc1cnccn1)c2ccccn2 Amb10566922 [0,1,0,0,0,0|3,0,0]=4 332 B16R2.88 O=C(Nc1ccccc1)c2ccccc2 Amb6346347 [0,1,0,0,0,0|1,0,1]=3 333 B16R2.88 O=C(Nc1ccccc1)c2ccccn2 Amb2617913 [0,1,0,0,0,0|2,0,1]=4 334 B16R2.88 O=C(Nc1ccccc1)c2cccnc2 Amb1195992 [0,1,0,0,0,0|0,0,1]=2 335 B16R2.88 O=C(Nc1ccccc1)c2ccncc2 Amb6443347 [0,1,0,0,0,0|2,0,1]=4 336 B16R2.88 O=C(Nc1ccccn1)c2ccccc2 Amb491228 [0,1,0,0,0,0|2,0,1]=4 337 B16R2.88 O=C(Nc1ccccn1)c2ccccc2 Amb7966466 [0,1,0,0,0,0|2,0,1]=4 338 B16R2.88 O=C(Nc1ccccn1)c2cccnc2 Amb1637280 [0,1,0,0,0,0|1,0,1]=3 339 B16R2.88 O=C(Nc1cccnc1)c2ccccc2 Amb3368143 [0,1,0,0,0,0|2,0,0]=3 340 B16R2.88 O=C(Nc1cccnc1)c2ccccn2 Amb10789930 [0,1,0,0,0,0|3,0,0]=4 341 B16R2.88 O=C(Nc1cccnc1)c2ccncc2 Amb3371395 [0,1,0,0,0,0|3,0,0]=4 342 B16R2.88 O=C(Nc1cccnc1)c2cnccn2 Amb9885837 [0,1,0,0,0,0|2,0,1]=4 343 B16R2.88 O=C(Nc1ccncc1)c2ccccc2 Amb2674634 [0,1,0,0,0,0|2,0,1]=4 344 B16R2.88 O=C(Nc1cncnc1)c2ccccc2 Amb24083885 [0,1,0,0,0,0|3,0,0]=4 345 B16R2.88 O=C(Oc1ccccc1)c2ccccc2 Amb2389283 [0,1,0,0,0,0|2,0,1]=4 346 B16R2.88 O=C(Oc1ccccc1)c2cccnc2 Amb4017594 [0,1,0,0,0,0|1,0,1]=3 347 B16R2.88 O=C(Oc1cccnc1)c2ccccc2 Amb2609761 [0,1,0,0,0,0|2,0,0]=3 348 B16R2.88 O=C(Sc1ccccc1)c2cnccn2 Amb2447236 [0,1,0,0,0,0|2,0,1]=4 349 B16R2.88 O=S(Cc1ccccc1)c2ccccc2 Amb2754572 [0,1,0,0,0,0|2,0,0]=3 350 B16R2.88 OC(C[n+]1ccccc1)c2ccccc2 Amb2613503 [0,1,0,0,0,0|3,0,0]=4 351 B16R2.88 OC(Cc1ccccc1)c2ccccc2 Amb9704347 [0,1,0,0,0,0|2,0,0]=3 352 B16R2.88 OC(Cc1ccccc1)c2ccccn2 Amb10567656 [0,1,0,0,0,0|3,0,0]=4 353 B16R2.88 OC(Cc1ccccc1)c2cccnc2 Amb17236934 [0,1,0,0,0,0|1,0,0]=2 354 B16R2.88 OC(Cc1ccccc1)c2ccncc2 Amb8439792 [0,1,0,0,0,0|3,0,0]=4 355 B16R2.88 OC(Cc1ccccn1)c2ccccc2 Amb10554546 [0,1,0,0,0,0|3,0,0]=4 356 B16R2.88 OC(Cc1cnccn1)c2ccccc2 Amb2691343 [0,1,0,0,0,0|2,0,0]=3 357 B16R2.88 ON(Cc1ccccc1)c2cccnc2 Amb27641916 [0,1,0,0,0,0|2,0,0]=3 358 B16R2.88 O[C@@H](Cc1ccccn1)c2ccccc2 Amb33249664 [0,1,0,0,0,0|3,0,0]=4 359 B16R2.88 S=C(Nc1ccccc1)c2ccccc2 Amb6337484 [0,1,0,0,0,0|1,0,1]=3 360 B16R2.88 SC(Cc1ccccc1)c2ccccc2 Amb7784738 [0,1,0,0,0,0|2,0,0]=3 361 B16R2.88 [NH2+]=C(Nc1ccccc1)c2ccccc2 Amb33513293 [0,1,0,0,0,0|1,0,1]=3 362 B16R2.88 [NH3+]C(Cc1ccccc1)c2ccccc2 Amb33513302 [0,1,0,0,0,0|2,0,0]=3 363 B16R2.88 [NH3+]N(Cc1ccccc1)c2ccccc2 Amb24113854 [0,1,0,0,0,0|1,0,0]=2 364 B16R2.88 [O-]\[N+](=N\c1cccnc1)c2cccnc2 Amb2609704 [0,1,0,0,0,0|2,0,1]=4 365 B16R2.132 Brc1ccc(C#Cc2ccccc2)cc1 Amb8447578 [0,1,0,0,0,0|2,0,1]=4 366 B16R2.132 Brc1ccc(CCc2nccnn2)cc1 Amb18883670 [0,1,0,0,0,0|3,0,0]=4 367 B16R2.132 Brc1ccc(CNc2ccccc2)cc1 Amb838971 [0,1,0,0,0,0|1,0,0]=2 368 B16R2.132 Brc1ccc(CNc2ccccn2)cc1 Amb3360975 [0,1,0,0,0,0|2,0,0]=3 369 B16R2.132 Brc1ccc(CNc2cccnc2)cc1 Amb6686461 [0,1,0,0,0,0|2,0,0]=3 370 B16R2.132 Brc1ccc(COc2ccccc2)cc1 Amb2710379 [0,1,0,0,0,0|2,0,0]=3 371 B16R2.132 Brc1ccc(COc2ccccc2)nc1 Amb28457102 [0,1,0,0,0,0|3,0,0]=4 372 B16R2.132 Brc1ccc(CSc2ccccc2)cc1 Amb22482416 [0,1,0,0,0,0|2,0,0]=3 373 B16R2.132 Brc1ccc(CSc2ccccc2)nc1 Amb27475623 [0,1,0,0,0,0|3,0,0]=4 374 B16R2.132 Brc1ccc(CSc2ccncc2)cc1 Amb27975232 [0,1,0,0,0,0|3,0,0]=4 375 B16R2.132 Brc1ccc(NCc2ccccc2)cc1 Amb33328969 [0,1,0,0,0,0|1,0,0]=2 376 B16R2.132 Brc1ccc(NCc2ccccc2)cc1 Amb839003 [0,1,0,0,0,0|1,0,0]=2 377 B16R2.132 Brc1ccc(NCc2ccccc2)nc1 Amb2618039 [0,1,0,0,0,0|2,0,0]=3 378 B16R2.132 Brc1ccc(NCc2ccccn2)cc1 Amb1897865 [0,1,0,0,0,0|2,0,0]=3 379 B16R2.132 Brc1ccc(NCc2ccccn2)nc1 Amb6642898 [0,1,0,0,0,0|3,0,0]=4 380 B16R2.132 Brc1ccc(NCc2cccnc2)cc1 Amb837638 [0,1,0,0,0,0|0,0,0]=1 381 B16R2.132 Brc1ccc(NCc2cccnc2)nc1 Amb6624058 [0,1,0,0,0,0|1,0,0]=2 382 B16R2.132 Brc1ccc(NCc2ccncc2)cc1 Amb837732 [0,1,0,0,0,0|2,0,0]=3 383 B16R2.132 Brc1ccc(NCc2ccncc2)nc1 Amb6646796 [0,1,0,0,0,0|3,0,0]=4 384 B16R2.132 Brc1ccc(NCc2cnccn2)nc1 Amb35654719 [0,1,0,0,0,0|2,0,0]=3 385 B16R2.132 Brc1ccc(NCc2cncnc2)cc1 Amb32951225 [0,1,0,0,0,0|1,0,0]=2 386 B16R2.132 Brc1ccc(OCc2ccccc2)cc1 Amb2447239 [0,1,0,0,0,0|2,0,0]=3 387 B16R2.132 Brc1ccc(OCc2ccccc2)cn1 Amb22498131 [0,1,0,0,0,0|2,0,0]=3 388 B16R2.132 Brc1ccc(OCc2ccccc2)nc1 Amb20241254 [0,1,0,0,0,0|3,0,0]=4 389 B16R2.132 Brc1ccc(OCc2ccccc2)nn1 Amb28125807 [0,1,0,0,0,0|3,0,0]=4 390 B16R2.132 Brc1ccc(OCc2cccnc2)cn1 Amb27414119 [0,1,0,0,0,0|2,0,0]=3 391 B16R2.132 Brc1ccc(OCc2cccnc2)nc1 Amb25113982 [0,1,0,0,0,0|2,0,0]=3 392 B16R2.132 Brc1ccc(OCc2ccncc2)cc1 Amb6270902 [0,1,0,0,0,0|3,0,0]=4 393 B16R2.132 Brc1ccc(OCc2cnccn2)cc1 Amb35700553 [0,1,0,0,0,0|2,0,0]=3 394 B16R2.132 Brc1ccc(OCc2cnccn2)cn1 Amb35723054 [0,1,0,0,0,0|3,0,0]=4 395 B16R2.132 Brc1ccc(SCc2ccccc2)cc1 Amb4012831 [0,1,0,0,0,0|2,0,0]=3 396 B16R2.132 Brc1ccc(SCc2ccccc2)nc1 Amb27610829 [0,1,0,0,0,0|3,0,0]=4 397 B16R2.132 Brc1ccc(\C=C\c2ccccc2)cc1 Amb4035121 [0,1,0,0,0,0|2,0,1]=4 398 B16R2.132 Brc1ccc(\N=C\c2ccccc2)cc1 Amb3725287 [0,1,0,0,0,0|1,0,2]=4 399 B16R2.132 Brc1ccc(\N=N\c2ccccc2)cc1 Amb21811992 [0,1,0,0,0,0|2,0,1]=4 400 B16R2.132 Brc1cnc(NCc2ccccc2)cn1 Amb27948723 [0,1,0,0,0,0|3,0,0]=4 401 B16R2.132 Brc1cnc(NCc2ccccc2)nc1 Amb4553621 [0,1,0,0,0,0|3,0,0]=4 402 B16R2.132 Brc1cnc(NCc2cccnc2)nc1 Amb18074044 [0,1,0,0,0,0|2,0,0]=3 403 B16R2.132 Brc1cnc(NCc2cccnn2)cn1 Amb27247338 [0,1,0,0,0,0|3,0,0]=4 404 B16R2.132 Brc1cnc(NCc2cnccn2)cn1 Amb30036278 [0,1,0,0,0,0|3,0,0]=4 405 B16R2.132 Brc1cnc(NCc2cnccn2)nc1 Amb35654668 [0,1,0,0,0,0|3,0,0]=4 406 B16R2.132 Brc1cnc(OCc2ccccc2)cn1 Amb20670538 [0,1,0,0,0,0|3,0,0]=4 407 B16R2.132 Brc1cnc(OCc2cccnc2)cn1 Amb24469877 [0,1,0,0,0,0|3,0,0]=4 408 B16R2.132 Brc1cnc(OCc2cccnc2)nc1 Amb27665509 [0,1,0,0,0,0|3,0,0]=4 409 B16R2.132 Brc1cnc(SCc2ccccc2)cn1 Amb28292794 [0,1,0,0,0,0|3,0,0]=4 410 B16R2.132 C[n+]1ccc(OCc2ccccc2)cc1 Amb28204063 [0,1,0,0,0,0|3,0,0]=4 411 B16R2.132 Cc1ccc(C#Cc2ccccc2)cc1 Amb8392048 [0,1,0,0,0,0|2,0,1]=4 412 B16R2.132 Cc1ccc(CCc2ccccc2)cc1 Amb26640344 [0,1,0,0,0,0|2,0,0]=3 413 B16R2.132 Cc1ccc(CNc2ccccc2)cc1 Amb3725174 [0,1,0,0,0,0|1,0,0]=2 414 B16R2.132 Cc1ccc(CNc2ccccn2)cc1 Amb2577761 [0,1,0,0,0,0|2,0,0]=3 415 B16R2.132 Cc1ccc(CNc2cccnc2)cc1 Amb2762686 [0,1,0,0,0,0|2,0,0]=3 416 B16R2.132 Cc1ccc(NCc2ccccc2)cc1 Amb1651808 [0,1,0,0,0,0|1,0,0]=2 417 B16R2.132 Cc1ccc(NCc2ccccc2)cn1 Amb25089853 [0,1,0,0,0,0|2,0,0]=3 418 B16R2.132 Cc1ccc(NCc2ccccc2)nn1 Amb18975341 [0,1,0,0,0,0|3,0,0]=4 419 B16R2.132 Cc1ccc(NCc2ccccn2)cc1 Amb6700874 [0,1,0,0,0,0|2,0,0]=3 420 B16R2.132 Cc1ccc(NCc2ccccn2)cn1 Amb33441975 [0,1,0,0,0,0|3,0,0]=4 421 B16R2.132 Cc1ccc(NCc2cccnc2)cc1 Amb837787 [0,1,0,0,0,0|0,0,0]=1 422 B16R2.132 Cc1ccc(NCc2cccnc2)cn1 Amb33441965 [0,1,0,0,0,0|1,0,0]=2 423 B16R2.132 Cc1ccc(NCc2ccncc2)cc1 Amb837947 [0,1,0,0,0,0|2,0,0]=3 424 B16R2.132 Cc1ccc(NCc2ccncc2)cn1 Amb33368934 [0,1,0,0,0,0|3,0,0]=4 425 B16R2.132 Cc1ccc(NCc2cncnc2)cn1 Amb33366718 [0,1,0,0,0,0|2,0,0]=3 426 B16R2.132 Cc1ccc(OCc2ccccc2)cc1 Amb4018566 [0,1,0,0,0,0|2,0,0]=3 427 B16R2.132 Cc1ccc(OCc2ccccc2)cn1 Amb26873852 [0,1,0,0,0,0|2,0,0]=3 428 B16R2.132 Cc1ccc(OCc2ccccc2)nn1 Amb22488645 [0,1,0,0,0,0|3,0,0]=4 429 B16R2.132 Cc1ccc(SCc2ccccc2)cn1 Amb32924644 [0,1,0,0,0,0|2,0,0]=3 430 B16R2.132 Cc1ccc(\C=C\c2ccccc2)cc1 Amb24323238 [0,1,0,0,0,0|2,0,1]=4 431 B16R2.132 Cc1ncc(NCc2ccccc2)cn1 Amb27818188 [0,1,0,0,0,0|3,0,0]=4 432 B16R2.132 Cc1ncc(OCc2ccccc2)cn1 Amb23412495 [0,1,0,0,0,0|3,0,0]=4 433 B16R2.132 Clc1ccc(C#Cc2ccccc2)cc1 Amb10554672 [0,1,0,0,0,0|2,0,1]=4 434 B16R2.132 Clc1ccc(CNc2ccccc2)cc1 Amb839008 [0,1,0,0,0,0|1,0,0]=2 435 B16R2.132 Clc1ccc(CNc2ccccn2)cc1 Amb1839885 [0,1,0,0,0,0|2,0,0]=3 436 B16R2.132 Clc1ccc(CNc2cccnc2)cc1 Amb22489636 [0,1,0,0,0,0|2,0,0]=3 437 B16R2.132 Clc1ccc(CNc2cccnc2)cc1 Amb2383001 [0,1,0,0,0,0|2,0,0]=3 438 B16R2.132 Clc1ccc(CNc2ccncc2)cc1 Amb22489637 [0,1,0,0,0,0|2,0,0]=3 439 B16R2.132 Clc1ccc(CNc2cncnc2)cc1 Amb18270137 [0,1,0,0,0,0|3,0,0]=4 440 B16R2.132 Clc1ccc(COc2ccccc2)cn1 Amb6247442 [0,1,0,0,0,0|1,0,0]=2 441 B16R2.132 Clc1ccc(COc2ccccn2)cc1 Amb10766366 [0,1,0,0,0,0|3,0,0]=4 442 B16R2.132 Clc1ccc(COc2ccccn2)cn1 Amb32670836 [0,1,0,0,0,0|2,0,0]=3 443 B16R2.132 Clc1ccc(CSc2ccccc2)cc1 Amb2610191 [0,1,0,0,0,0|2,0,0]=3 444 B16R2.132 Clc1ccc(CSc2ccccc2)cn1 Amb6675873 [0,1,0,0,0,0|1,0,0]=2 445 B16R2.132 Clc1ccc(CSc2ccccn2)cn1 Amb6675885 [0,1,0,0,0,0|2,0,0]=3 446 B16R2.132 Clc1ccc(CSc2ccncc2)nn1 Amb27440183 [0,1,0,0,0,0|3,0,0]=4 447 B16R2.132 Clc1ccc(NCc2ccccc2)cc1 Amb3765690 [0,1,0,0,0,0|1,0,0]=2 448 B16R2.132 Clc1ccc(NCc2ccccc2)cn1 Amb25831247 [0,1,0,0,0,0|2,0,0]=3 449 B16R2.132 Clc1ccc(NCc2ccccc2)nn1 Amb3092807 [0,1,0,0,0,0|3,0,0]=4 450 B16R2.132 Clc1ccc(NCc2ccccn2)cc1 Amb6695987 [0,1,0,0,0,0|2,0,0]=3 451 B16R2.132 Clc1ccc(NCc2ccccn2)cn1 Amb33442099 [0,1,0,0,0,0|3,0,0]=4 452 B16R2.132 Clc1ccc(NCc2cccnc2)cc1 Amb2222641 [0,1,0,0,0,0|0,0,0]=1 453 B16R2.132 Clc1ccc(NCc2cccnc2)nc1 Amb6633425 [0,1,0,0,0,0|1,0,0]=2 454 B16R2.132 Clc1ccc(NCc2cccnc2)nn1 Amb6651852 [0,1,0,0,0,0|2,0,0]=3 455 B16R2.132 Clc1ccc(NCc2ccncc2)cc1 Amb838090 [0,1,0,0,0,0|2,0,0]=3 456 B16R2.132 Clc1ccc(NCc2ccncc2)cn1 Amb33442102 [0,1,0,0,0,0|3,0,0]=4 457 B16R2.132 Clc1ccc(NCc2cnccn2)nn1 Amb30017714 [0,1,0,0,0,0|3,0,0]=4 458 B16R2.132 Clc1ccc(NCc2cncnc2)cc1 Amb18996453 [0,1,0,0,0,0|1,0,0]=2 459 B16R2.132 Clc1ccc(NCc2cncnc2)cn1 Amb33442098 [0,1,0,0,0,0|2,0,0]=3 460 B16R2.132 Clc1ccc(NNc2ccccc2)nn1 Amb29848690 [0,1,0,0,0,0|2,0,0]=3 461 B16R2.132 Clc1ccc(OCc2ccccc2)cc1 Amb2684651 [0,1,0,0,0,0|2,0,0]=3 462 B16R2.132 Clc1ccc(OCc2ccccc2)cn1 Amb22498130 [0,1,0,0,0,0|2,0,0]=3 463 B16R2.132 Clc1ccc(OCc2ccccc2)nc1 Amb24082317 [0,1,0,0,0,0|3,0,0]=4 464 B16R2.132 Clc1ccc(OCc2ccccc2)nn1 Amb6255403 [0,1,0,0,0,0|3,0,0]=4 465 B16R2.132 Clc1ccc(OCc2ccccn2)cn1 Amb27479742 [0,1,0,0,0,0|3,0,0]=4 466 B16R2.132 Clc1ccc(OCc2cnccn2)cn1 Amb35723053 [0,1,0,0,0,0|3,0,0]=4 467 B16R2.132 Clc1ccc(SCc2ccccc2)nn1 Amb8873141 [0,1,0,0,0,0|3,0,0]=4 468 B16R2.132 Clc1ccc(\C=C\c2ccccc2)cc1 Amb10568579 [0,1,0,0,0,0|2,0,1]=4 469 B16R2.132 Clc1ccc(\C=N\c2ccccc2)cc1 Amb2227970 [0,1,0,0,0,0|1,0,2]=4 470 B16R2.132 Clc1ccc(\N=N\c2ccccc2)cc1 Amb21811991 [0,1,0,0,0,0|2,0,1]=4 471 B16R2.132 Clc1cnc(CSc2ccncc2)cn1 Amb27873897 [0,1,0,0,0,0|3,0,0]=4 472 B16R2.132 Clc1cnc(NCc2ccccc2)nc1 Amb2796321 [0,1,0,0,0,0|3,0,0]=4 473 B16R2.132 Clc1cnc(NCc2cnccn2)cn1 Amb35654940 [0,1,0,0,0,0|3,0,0]=4 474 B16R2.132 Clc1cnc(OCc2cccnc2)cn1 Amb27210517 [0,1,0,0,0,0|3,0,0]=4 475 B16R2.132 Clc1cnc(SCc2ccccc2)cn1 Amb27640374 [0,1,0,0,0,0|3,0,0]=4 476 B16R2.132 Clc1ncc(OCc2ccccc2)cn1 Amb10602060 [0,1,0,0,0,0|3,0,0]=4 477 B16R2.132 Fc1ccc(C#Cc2ccccc2)cn1 Amb32412711 [0,1,0,0,0,0|1,0,1]=3 478 B16R2.132 Fc1ccc(CNc2ccccc2)cc1 Amb3725460 [0,1,0,0,0,0|1,0,0]=2 479 B16R2.132 Fc1ccc(CNc2ccccn2)cc1 Amb22489870 [0,1,0,0,0,0|2,0,0]=3 480 B16R2.132 Fc1ccc(CNc2ccccn2)cc1 Amb2382993 [0,1,0,0,0,0|2,0,0]=3 481 B16R2.132 Fc1ccc(NCc2ccccc2)cc1 Amb3726374 [0,1,0,0,0,0|1,0,0]=2 482 B16R2.132 Fc1ccc(NCc2ccccc2)nc1 Amb18975390 [0,1,0,0,0,0|2,0,0]=3 483 B16R2.132 Fc1ccc(NCc2ccccn2)cc1 Amb6696824 [0,1,0,0,0,0|2,0,0]=3 484 B16R2.132 Fc1ccc(NCc2cccnc2)cc1 Amb6336198 [0,1,0,0,0,0|0,0,0]=1 485 B16R2.132 Fc1ccc(NCc2ccncc2)cc1 Amb6351906 [0,1,0,0,0,0|2,0,0]=3 486 B16R2.132 Fc1ccc(NCc2cncnc2)cc1 Amb18996456 [0,1,0,0,0,0|1,0,0]=2 487 B16R2.132 Fc1ccc(OCc2ccccc2)cc1 Amb2684652 [0,1,0,0,0,0|2,0,0]=3 488 B16R2.132 Fc1ccc(OCc2ccccc2)cn1 Amb27774067 [0,1,0,0,0,0|2,0,0]=3 489 B16R2.132 Fc1ccc(OCc2ccccc2)nc1 Amb19959570 [0,1,0,0,0,0|3,0,0]=4 490 B16R2.132 Fc1ccc(OCc2ccccn2)cn1 Amb28040697 [0,1,0,0,0,0|3,0,0]=4 491 B16R2.132 Fc1ccc(OCc2cnccn2)cn1 Amb35723050 [0,1,0,0,0,0|3,0,0]=4 492 B16R2.132 Fc1ccc(\C=N\c2ccccc2)cc1 Amb2227967 [0,1,0,0,0,0|1,0,2]=4 493 B16R2.132 Fc1ccc(\N=N\c2ccccc2)cc1 Amb2390018 [0,1,0,0,0,0|2,0,1]=4 494 B16R2.132 Ic1ccc(C#Cc2ccccc2)cc1 Amb34914086 [0,1,0,0,0,0|2,0,1]=4 495 B16R2.132 Ic1ccc(CSc2ccccn2)cc1 Amb28341089 [0,1,0,0,0,0|3,0,0]=4 496 B16R2.132 Ic1ccc(CSc2ccncc2)cc1 Amb28076032 [0,1,0,0,0,0|3,0,0]=4 497 B16R2.132 Ic1ccc(CSc2cnccn2)cc1 Amb27403430 [0,1,0,0,0,0|3,0,0]=4 498 B16R2.132 Ic1ccc(NCc2ccccc2)cc1 Amb7760853 [0,1,0,0,0,0|1,0,0]=2 499 B16R2.132 Ic1ccc(NCc2ccccn2)cc1 Amb9208146 [0,1,0,0,0,0|2,0,0]=3 500 B16R2.132 Ic1ccc(NCc2cccnc2)cc1 Amb9204453 [0,1,0,0,0,0|0,0,0]=1 501 B16R2.132 Ic1ccc(NCc2ccncc2)cc1 Amb9203698 [0,1,0,0,0,0|2,0,0]=3 502 B16R2.132 Ic1ccc(OCc2ccccc2)cc1 Amb2684653 [0,1,0,0,0,0|2,0,0]=3 503 B16R2.132 Ic1ccc(OCc2ccccc2)cn1 Amb26380391 [0,1,0,0,0,0|2,0,0]=3 504 B16R2.132 Ic1ccc(OCc2ccccn2)cc1 Amb20627464 [0,1,0,0,0,0|3,0,0]=4 505 B16R2.132 Ic1ccc(OCc2cccnc2)cc1 Amb20626245 [0,1,0,0,0,0|1,0,0]=2 506 B16R2.132 Ic1ccc(OCc2ccncc2)cc1 Amb20627465 [0,1,0,0,0,0|3,0,0]=4 507 B16R2.132 Ic1ccc(OCc2cnccn2)cc1 Amb30018076 [0,1,0,0,0,0|2,0,0]=3 508 B16R2.132 Ic1cnc(NCc2ccccc2)nc1 Amb28140258 [0,1,0,0,0,0|3,0,0]=4 509 B16R2.132 Ic1cnc(NCc2cccnn2)nc1 Amb28046520 [0,1,0,0,0,0|3,0,0]=4 510 B16R2.132 Ic1cnc(NCc2cnccn2)nc1 Amb35654724 [0,1,0,0,0,0|3,0,0]=4 511 B16R2.132 Nc1ccc(C#Cc2ccccc2)cc1 Amb2416700 [0,1,0,0,0,0|2,0,1]=4 512 B16R2.132 Nc1ccc(CCc2ccccc2)cc1 Amb17101879 [0,1,0,0,0,0|2,0,0]=3 513 B16R2.132 Nc1ccc(CCc2ccccc2)cc1 Amb21954210 [0,1,0,0,0,0|2,0,0]=3 514 B16R2.132 Nc1ccc(CCc2ccccn2)cc1 Amb1102660 [0,1,0,0,0,0|3,0,0]=4 515 B16R2.132 Nc1ccc(CCc2ccccn2)cc1 Amb17622183 [0,1,0,0,0,0|3,0,0]=4 516 B16R2.132 Nc1ccc(CCc2ccncc2)cc1 Amb6335843 [0,1,0,0,0,0|3,0,0]=4 517 B16R2.132 Nc1ccc(CCc2nccnn2)cc1 Amb18864296 [0,1,0,0,0,0|3,0,0]=4 518 B16R2.132 Nc1ccc(CNc2ccccc2)cc1 Amb18972361 [0,1,0,0,0,0|1,0,0]=2 519 B16R2.132 Nc1ccc(CNc2ccccn2)cc1 Amb17100060 [0,1,0,0,0,0|2,0,0]=3 520 B16R2.132 Nc1ccc(COc2ccccc2)cc1 Amb1136463 [0,1,0,0,0,0|2,0,0]=3 521 B16R2.132 Nc1ccc(CSc2ccccc2)cc1 Amb2608452 [0,1,0,0,0,0|2,0,0]=3 522 B16R2.132 Nc1ccc(CSc2ccccn2)cc1 Amb6676759 [0,1,0,0,0,0|3,0,0]=4 523 B16R2.132 Nc1ccc(NCc2ccccc2)cc1 Amb4008914 [0,1,0,0,0,0|1,0,0]=2 524 B16R2.132 Nc1ccc(NCc2ccccc2)cc1 Amb836918 [0,1,0,0,0,0|1,0,0]=2 525 B16R2.132 Nc1ccc(NCc2ccccc2)cn1 Amb7767650 [0,1,0,0,0,0|2,0,0]=3 526 B16R2.132 Nc1ccc(NCc2ccccc2)nc1 Amb836910 [0,1,0,0,0,0|2,0,0]=3 527 B16R2.132 Nc1ccc(NCc2ccccn2)cc1 Amb9205291 [0,1,0,0,0,0|2,0,0]=3 528 B16R2.132 Nc1ccc(NCc2ccccn2)cn1 Amb7768027 [0,1,0,0,0,0|3,0,0]=4 529 B16R2.132 Nc1ccc(NCc2ccccn2)nc1 Amb7768034 [0,1,0,0,0,0|3,0,0]=4 530 B16R2.132 Nc1ccc(NCc2cccnc2)cc1 Amb7768123 [0,1,0,0,0,0|0,0,0]=1 531 B16R2.132 Nc1ccc(NCc2cccnc2)cn1 Amb7768119 [0,1,0,0,0,0|1,0,0]=2 532 B16R2.132 Nc1ccc(NCc2cccnc2)nc1 Amb7768125 [0,1,0,0,0,0|1,0,0]=2 533 B16R2.132 Nc1ccc(NCc2ccncc2)cc1 Amb9205306 [0,1,0,0,0,0|2,0,0]=3 534 B16R2.132 Nc1ccc(NCc2ccncc2)cn1 Amb7768109 [0,1,0,0,0,0|3,0,0]=4 535 B16R2.132 Nc1ccc(NCc2ccncc2)nc1 Amb7768115 [0,1,0,0,0,0|3,0,0]=4 536 B16R2.132 Nc1ccc(OCc2ccccc2)cc1 Amb22489506 [0,1,0,0,0,0|2,0,0]=3 537 B16R2.132 Nc1ccc(OCc2ccccc2)cc1 Amb2719847 [0,1,0,0,0,0|2,0,0]=3 538 B16R2.132 Nc1ccc(OCc2ccccc2)cc1 Amb6315574 [0,1,0,0,0,0|2,0,0]=3 539 B16R2.132 Nc1ccc(OCc2ccccc2)cn1 Amb30625649 [0,1,0,0,0,0|2,0,0]=3 540 B16R2.132 Nc1ccc(OCc2ccccc2)cn1 Amb6679789 [0,1,0,0,0,0|2,0,0]=3 541 B16R2.132 Nc1ccc(OCc2ccccc2)nc1 Amb1124881 [0,1,0,0,0,0|3,0,0]=4 542 B16R2.132 Nc1ccc(OCc2ccccn2)cc1 Amb1099016 [0,1,0,0,0,0|3,0,0]=4 543 B16R2.132 Nc1ccc(OCc2ccccn2)cc1 Amb22279532 [0,1,0,0,0,0|3,0,0]=4 544 B16R2.132 Nc1ccc(OCc2ccccn2)cn1 Amb31112291 [0,1,0,0,0,0|3,0,0]=4 545 B16R2.132 Nc1ccc(OCc2cccnc2)cc1 Amb1114707 [0,1,0,0,0,0|1,0,0]=2 546 B16R2.132 Nc1ccc(OCc2cccnc2)cc1 Amb24053231 [0,1,0,0,0,0|1,0,0]=2 547 B16R2.132 Nc1ccc(OCc2cccnc2)cn1 Amb31112292 [0,1,0,0,0,0|2,0,0]=3 548 B16R2.132 Nc1ccc(OCc2cccnc2)nc1 Amb31172508 [0,1,0,0,0,0|2,0,0]=3 549 B16R2.132 Nc1ccc(OCc2ccncc2)cc1 Amb1133349 [0,1,0,0,0,0|3,0,0]=4 550 B16R2.132 Nc1ccc(OCc2ccncc2)cn1 Amb31112293 [0,1,0,0,0,0|3,0,0]=4 551 B16R2.132 Nc1ccc(OCc2cnccn2)cc1 Amb17131789 [0,1,0,0,0,0|2,0,0]=3 552 B16R2.132 Nc1ccc(OCc2nccnn2)cc1 Amb18864519 [0,1,0,0,0,0|3,0,0]=4 553 B16R2.132 Nc1ccc(SCc2ccccc2)cc1 Amb6675929 [0,1,0,0,0,0|2,0,0]=3 554 B16R2.132 Nc1ccc(SCc2ccccc2)cn1 Amb6680021 [0,1,0,0,0,0|2,0,0]=3 555 B16R2.132 Nc1ccc(SCc2cccnc2)cc1 Amb86685 [0,1,0,0,0,0|1,0,0]=2 556 B16R2.132 Nc1ccc(\C=C\c2ccccc2)cc1 Amb33513281 [0,1,0,0,0,0|2,0,1]=4 557 B16R2.132 Nc1ccc(\N=N\c2ccccc2)cc1 Amb1348283 [0,1,0,0,0,0|2,0,1]=4 558 B16R2.132 Nc1cnc(CCc2cccnc2)nc1 Amb18566221 [0,1,0,0,0,0|3,0,0]=4 559 B16R2.132 Nc1cnc(NCc2ccccc2)nc1 Amb18290412 [0,1,0,0,0,0|3,0,0]=4 560 B16R2.132 Nc1cnc(OCc2ccccc2)cn1 Amb27175185 [0,1,0,0,0,0|3,0,0]=4 561 B16R2.132 O=C1C=CC(NCc2ccccc2)=CN1 Amb27851180 [0,1,0,0,0,0|2,0,0]=3 562 B16R2.132 O=C1N=CC(SCc2ccccc2)=CN1 Amb33038297 [0,1,0,0,0,0|3,0,0]=4 563 B16R2.132 Oc1ccc(C#Cc2ccccc2)cc1 Amb10610495 [0,1,0,0,0,0|2,0,1]=4 564 B16R2.132 Oc1ccc(CNc2ccccc2)cc1 Amb10609692 [0,1,0,0,0,0|1,0,0]=2 565 B16R2.132 Oc1ccc(CNc2ccccc2)cc1 Amb3544585 [0,1,0,0,0,0|1,0,0]=2 566 B16R2.132 Oc1ccc(CNc2ccccn2)cc1 Amb15694898 [0,1,0,0,0,0|2,0,0]=3 567 B16R2.132 Oc1ccc(NCc2ccccc2)cc1 Amb837935 [0,1,0,0,0,0|1,0,0]=2 568 B16R2.132 Oc1ccc(OCc2ccccc2)cc1 Amb1228378 [0,1,0,0,0,0|2,0,0]=3 569 B16R2.132 Oc1ccc(OCc2ccccc2)nc1 Amb2699422 [0,1,0,0,0,0|3,0,0]=4 570 B16R2.132 Oc1ccc(OCc2cccnc2)cc1 Amb33528796 [0,1,0,0,0,0|1,0,0]=2 571 B16R2.132 Oc1ccc(OCc2ccncc2)cc1 Amb9210957 [0,1,0,0,0,0|3,0,0]=4 572 B16R2.132 Oc1ccc(SCc2ccccc2)cc1 Amb30594452 [0,1,0,0,0,0|2,0,0]=3 573 B16R2.132 Oc1ccc(\C=C\c2ccccc2)cc1 Amb6357380 [0,1,0,0,0,0|2,0,1]=4 574 B16R2.132 Oc1ccc(\N=C\c2ccccc2)cc1 Amb2778379 [0,1,0,0,0,0|1,0,2]=4 575 B16R2.132 Oc1ccc(\N=C\c2cccnc2)cc1 Amb6344039 [0,1,0,0,0,0|0,0,2]=3 576 B16R2.132 Oc1ccc(\N=N\c2ccccc2)cc1 Amb8516757 [0,1,0,0,0,0|2,0,1]=4 577 B16R2.132 Sc1ccc(OCc2ccccc2)cc1 Amb27767077 [0,1,0,0,0,0|2,0,0]=3 578 B16R2.132 [NH3+]c1ccc(OCc2ccccc2)cc1 Amb24113829 [0,1,0,0,0,0|2,0,0]=3 579 B16R2.132 [O-][n+]1ccc(OCc2ccccc2)cc1 Amb2631918 [0,1,0,0,0,0|3,0,0]=4 580 B16R2.252 Brc1cc(NCc2ccccc2)ccn1 Amb27484913 [0,1,0,0,0,0|2,0,0]=3 581 B16R2.252 Brc1cc(NCc2ccccc2)ncn1 Amb27972947 [0,1,0,0,0,0|3,0,0]=4 582 B16R2.252 Brc1cc(NCc2cccnn2)ncn1 Amb27431267 [0,1,0,0,0,0|3,0,0]=4 583 B16R2.252 Brc1cc(NCc2cnccn2)ncn1 Amb30036279 [0,1,0,0,0,0|3,0,0]=4 584 B16R2.252 Brc1cc(OCc2ccccc2)ccn1 Amb23401282 [0,1,0,0,0,0|3,0,0]=4 585 B16R2.252 Brc1cc(OCc2cccnc2)ncn1 Amb27637551 [0,1,0,0,0,0|3,0,0]=4 586 B16R2.252 Brc1cccc(CCc2nccnn2)c1 Amb18883668 [0,1,0,0,0,0|3,0,0]=4 587 B16R2.252 Brc1cccc(CNc2ccccc2)c1 Amb838042 [0,1,0,0,0,0|1,0,0]=2 588 B16R2.252 Brc1cccc(CNc2ccccn2)c1 Amb17100055 [0,1,0,0,0,0|2,0,0]=3 589 B16R2.252 Brc1cccc(CNc2cccnc2)c1 Amb6686464 [0,1,0,0,0,0|2,0,0]=3 590 B16R2.252 Brc1cccc(COc2ccccc2)c1 Amb2724116 [0,1,0,0,0,0|2,0,0]=3 591 B16R2.252 Brc1cccc(CSc2ccccc2)c1 Amb5221073 [0,1,0,0,0,0|2,0,0]=3 592 B16R2.252 Brc1cccc(CSc2ccccc2)n1 Amb27196920 [0,1,0,0,0,0|3,0,0]=4 593 B16R2.252 Brc1cccc(NCc2ccccc2)c1 Amb838939 [0,1,0,0,0,0|1,0,0]=2 594 B16R2.252 Brc1cccc(NCc2ccccc2)n1 Amb19959441 [0,1,0,0,0,0|2,0,0]=3 595 B16R2.252 Brc1cccc(NCc2ccccn2)c1 Amb6696685 [0,1,0,0,0,0|2,0,0]=3 596 B16R2.252 Brc1cccc(NCc2cccnc2)c1 Amb6696594 [0,1,0,0,0,0|0,0,0]=1 597 B16R2.252 Brc1cccc(NCc2ccncc2)c1 Amb6696599 [0,1,0,0,0,0|2,0,0]=3 598 B16R2.252 Brc1cccc(NCc2cnccn2)n1 Amb30036276 [0,1,0,0,0,0|2,0,0]=3 599 B16R2.252 Brc1cccc(NCc2cncnc2)c1 Amb33212653 [0,1,0,0,0,0|1,0,0]=2 600 B16R2.252 Brc1cccc(OCc2ccccc2)c1 Amb2684648 [0,1,0,0,0,0|2,0,0]=3 601 B16R2.252 Brc1cccc(OCc2ccccc2)n1 Amb8388596 [0,1,0,0,0,0|3,0,0]=4 602 B16R2.252 Brc1cccc(OCc2ccccn2)c1 Amb6257056 [0,1,0,0,0,0|3,0,0]=4 603 B16R2.252 Brc1cccc(OCc2cccnc2)c1 Amb6272400 [0,1,0,0,0,0|1,0,0]=2 604 B16R2.252 Brc1cccc(OCc2cccnc2)n1 Amb27257120 [0,1,0,0,0,0|2,0,0]=3 605 B16R2.252 Brc1cccc(OCc2ccncc2)c1 Amb6260467 [0,1,0,0,0,0|3,0,0]=4 606 B16R2.252 Brc1cccc(OCc2cnccn2)c1 Amb35700554 [0,1,0,0,0,0|2,0,0]=3 607 B16R2.252 Brc1ccnc(NCc2ccccc2)c1 Amb19959554 [0,1,0,0,0,0|2,0,0]=3 608 B16R2.252 Brc1ccnc(OCc2ccccc2)c1 Amb19959540 [0,1,0,0,0,0|3,0,0]=4 609 B16R2.252 Brc1cncc(CNc2ccccc2)c1 Amb22276864 [0,1,0,0,0,0|0,0,0]=1 610 B16R2.252 Brc1cncc(CSc2cnccn2)c1 Amb27611426 [0,1,0,0,0,0|3,0,0]=4 611 B16R2.252 Brc1cncc(NCc2ccccc2)c1 Amb24079791 [0,1,0,0,0,0|2,0,0]=3 612 B16R2.252 Brc1cncc(NCc2ccccn2)c1 Amb28184596 [0,1,0,0,0,0|3,0,0]=4 613 B16R2.252 Brc1cncc(NCc2ccncc2)c1 Amb27263433 [0,1,0,0,0,0|3,0,0]=4 614 B16R2.252 Brc1cncc(NCc2ccncc2)c1 Amb32651934 [0,1,0,0,0,0|3,0,0]=4 615 B16R2.252 Brc1cncc(NCc2cnccn2)c1 Amb35686598 [0,1,0,0,0,0|2,0,0]=3 616 B16R2.252 Brc1cncc(OCc2ccccc2)c1 Amb10067157 [0,1,0,0,0,0|2,0,0]=3 617 B16R2.252 Brc1cncc(OCc2cnccn2)c1 Amb35723056 [0,1,0,0,0,0|3,0,0]=4 618 B16R2.252 Brc1cncc(SCc2ccccc2)c1 Amb28906204 [0,1,0,0,0,0|2,0,0]=3 619 B16R2.252 C[n+]1cccc(OCc2ccccc2)c1 Amb2609786 [0,1,0,0,0,0|2,0,1]=4 620 B16R2.252 Cc1cc(NCc2ccccc2)ncn1 Amb1349305 [0,1,0,0,0,0|3,0,0]=4 621 B16R2.252 Cc1cc(OCc2ccccc2)ccn1 Amb28291370 [0,1,0,0,0,0|3,0,0]=4 622 B16R2.252 Cc1cccc(CNc2ccccc2)c1 Amb4313246 [0,1,0,0,0,0|1,0,0]=2 623 B16R2.252 Cc1cccc(CNc2cccnc2)c1 Amb6686481 [0,1,0,0,0,0|2,0,0]=3 624 B16R2.252 Cc1cccc(NCc2ccccc2)c1 Amb419993 [0,1,0,0,0,0|1,0,0]=2 625 B16R2.252 Cc1cccc(NCc2ccccc2)c1 Amb6891897 [0,1,0,0,0,0|1,0,0]=2 626 B16R2.252 Cc1cccc(NCc2ccccc2)n1 Amb2221691 [0,1,0,0,0,0|2,0,0]=3 627 B16R2.252 Cc1cccc(NCc2ccccn2)c1 Amb6684530 [0,1,0,0,0,0|2,0,0]=3 628 B16R2.252 Cc1cccc(NCc2cccnc2)c1 Amb6684424 [0,1,0,0,0,0|0,0,0]=1 629 B16R2.252 Cc1cccc(NCc2ccncc2)c1 Amb6411080 [0,1,0,0,0,0|2,0,0]=3 630 B16R2.252 Cc1cccc(NCc2cncnc2)c1 Amb18996441 [0,1,0,0,0,0|1,0,0]=2 631 B16R2.252 Cc1cccc(OCc2ccccc2)c1 Amb20622231 [0,1,0,0,0,0|2,0,0]=3 632 B16R2.252 Cc1cccc(OCc2ccccc2)n1 Amb26873289 [0,1,0,0,0,0|3,0,0]=4 633 B16R2.252 Cc1ccnc(NCc2ccccc2)c1 Amb3940048 [0,1,0,0,0,0|2,0,0]=3 634 B16R2.252 Cc1ccnc(NCc2ccccc2)n1 Amb8425341 [0,1,0,0,0,0|3,0,0]=4 635 B16R2.252 Cc1ccnc(OCc2ccccc2)c1 Amb25369515 [0,1,0,0,0,0|3,0,0]=4 636 B16R2.252 Cc1cncc(NCc2cccnc2)n1 Amb33610254 [0,1,0,0,0,0|2,0,0]=3 637 B16R2.252 Cc1cncc(NCc2ccncc2)c1 Amb32952905 [0,1,0,0,0,0|3,0,0]=4 638 B16R2.252 Cc1cncc(OCc2ccccc2)c1 Amb22043749 [0,1,0,0,0,0|2,0,0]=3 639 B16R2.252 Cc1cncc(OCc2ccccc2)n1 Amb28369936 [0,1,0,0,0,0|3,0,0]=4 640 B16R2.252 Cc1cncc(SCc2ccccc2)c1 Amb32405893 [0,1,0,0,0,0|2,0,0]=3 641 B16R2.252 Cc1nccc(NCc2ccccc2)n1 Amb18997326 [0,1,0,0,0,0|3,0,0]=4 642 B16R2.252 Cc1nccc(NCc2cccnc2)n1 Amb18997334 [0,1,0,0,0,0|2,0,0]=3 643 B16R2.252 Clc1cc(NCc2ccccc2)ccn1 Amb23673540 [0,1,0,0,0,0|2,0,0]=3 644 B16R2.252 Clc1cc(NCc2ccccc2)ncn1 Amb4011817 [0,1,0,0,0,0|3,0,0]=4 645 B16R2.252 Clc1cc(NCc2ccccn2)ccn1 Amb27150857 [0,1,0,0,0,0|3,0,0]=4 646 B16R2.252 Clc1cc(NCc2cccnc2)ncn1 Amb18974431 [0,1,0,0,0,0|2,0,0]=3 647 B16R2.252 Clc1cc(NCc2cccnn2)ccn1 Amb27979077 [0,1,0,0,0,0|2,0,0]=3 648 B16R2.252 Clc1cc(NCc2ccncc2)ccn1 Amb24475441 [0,1,0,0,0,0|3,0,0]=4 649 B16R2.252 Clc1cc(NCc2cnccn2)ccn1 Amb30010726 [0,1,0,0,0,0|2,0,0]=3 650 B16R2.252 Clc1cc(NCc2cnccn2)ncn1 Amb30036275 [0,1,0,0,0,0|3,0,0]=4 651 B16R2.252 Clc1cc(OCc2ccccc2)ccn1 Amb20623632 [0,1,0,0,0,0|3,0,0]=4 652 B16R2.252 Clc1cc(OCc2ccccc2)cnn1 Amb22276668 [0,1,0,0,0,0|3,0,0]=4 653 B16R2.252 Clc1cc(OCc2cccnc2)ccn1 Amb27868705 [0,1,0,0,0,0|2,0,0]=3 654 B16R2.252 Clc1cc(SCc2ccccc2)ccn1 Amb9154883 [0,1,0,0,0,0|3,0,0]=4 655 B16R2.252 Clc1cccc(CNc2ccccc2)c1 Amb4304160 [0,1,0,0,0,0|1,0,0]=2 656 B16R2.252 Clc1cccc(CNc2ccccn2)c1 Amb1761673 [0,1,0,0,0,0|2,0,0]=3 657 B16R2.252 Clc1cccc(CNc2cccnc2)c1 Amb2383002 [0,1,0,0,0,0|2,0,0]=3 658 B16R2.252 Clc1cccc(CNc2ccncc2)c1 Amb24093907 [0,1,0,0,0,0|2,0,0]=3 659 B16R2.252 Clc1cccc(NCc2ccccc2)c1 Amb33328994 [0,1,0,0,0,0|1,0,0]=2 660 B16R2.252 Clc1cccc(NCc2ccccc2)c1 Amb838903 [0,1,0,0,0,0|1,0,0]=2 661 B16R2.252 Clc1cccc(NCc2ccccn2)c1 Amb6695737 [0,1,0,0,0,0|2,0,0]=3 662 B16R2.252 Clc1cccc(NCc2ccccn2)n1 Amb21959063 [0,1,0,0,0,0|3,0,0]=4 663 B16R2.252 Clc1cccc(NCc2cccnc2)c1 Amb6695669 [0,1,0,0,0,0|0,0,0]=1 664 B16R2.252 Clc1cccc(NCc2cccnc2)n1 Amb21959049 [0,1,0,0,0,0|1,0,0]=2 665 B16R2.252 Clc1cccc(NCc2ccncc2)c1 Amb4419812 [0,1,0,0,0,0|2,0,0]=3 666 B16R2.252 Clc1cccc(NCc2ccncc2)n1 Amb21959080 [0,1,0,0,0,0|3,0,0]=4 667 B16R2.252 Clc1cccc(NCc2cnccn2)n1 Amb35694426 [0,1,0,0,0,0|2,0,0]=3 668 B16R2.252 Clc1cccc(NCc2cncnc2)c1 Amb18996452 [0,1,0,0,0,0|1,0,0]=2 669 B16R2.252 Clc1cccc(OCc2ccccc2)c1 Amb2610190 [0,1,0,0,0,0|2,0,0]=3 670 B16R2.252 Clc1cccc(OCc2ccccc2)n1 Amb22432532 [0,1,0,0,0,0|3,0,0]=4 671 B16R2.252 Clc1ccnc(NCc2ccccc2)c1 Amb27774226 [0,1,0,0,0,0|2,0,0]=3 672 B16R2.252 Clc1ccnc(NCc2ccccc2)n1 Amb22749353 [0,1,0,0,0,0|3,0,0]=4 673 B16R2.252 Clc1ccnc(NCc2cccnc2)n1 Amb32644017 [0,1,0,0,0,0|2,0,0]=3 674 B16R2.252 Clc1ccnc(OCc2ccccc2)c1 Amb22236357 [0,1,0,0,0,0|3,0,0]=4 675 B16R2.252 Clc1ccnc(OCc2cccnc2)c1 Amb22276248 [0,1,0,0,0,0|2,0,0]=3 676 B16R2.252 Clc1ccnc(SCc2ccccc2)c1 Amb22236362 [0,1,0,0,0,0|3,0,0]=4 677 B16R2.252 Clc1ccnc(SCc2cccnc2)c1 Amb22276250 [0,1,0,0,0,0|2,0,0]=3 678 B16R2.252 Clc1cncc(NCc2ccccc2)c1 Amb29864985 [0,1,0,0,0,0|2,0,0]=3 679 B16R2.252 Clc1cncc(NCc2ccccc2)n1 Amb16230997 [0,1,0,0,0,0|3,0,0]=4 680 B16R2.252 Clc1cncc(NCc2cnccn2)n1 Amb30036270 [0,1,0,0,0,0|3,0,0]=4 681 B16R2.252 Clc1cncc(OCc2ccccc2)n1 Amb503286 [0,1,0,0,0,0|3,0,0]=4 682 B16R2.252 Clc1cncc(SCc2ccccc2)n1 Amb8873489 [0,1,0,0,0,0|3,0,0]=4 683 B16R2.252 Clc1nccc(NCc2ccccc2)n1 Amb2537104 [0,1,0,0,0,0|3,0,0]=4 684 B16R2.252 Clc1nccc(NCc2cccnc2)n1 Amb18988740 [0,1,0,0,0,0|2,0,0]=3 685 B16R2.252 Clc1nccc(NCc2cnccn2)n1 Amb30036274 [0,1,0,0,0,0|3,0,0]=4 686 B16R2.252 Fc1cc(NCc2ccccc2)ncn1 Amb27173543 [0,1,0,0,0,0|3,0,0]=4 687 B16R2.252 Fc1cc(NCc2cccnc2)ncn1 Amb27767012 [0,1,0,0,0,0|2,0,0]=3 688 B16R2.252 Fc1cc(NCc2cnccn2)ccn1 Amb30036268 [0,1,0,0,0,0|2,0,0]=3 689 B16R2.252 Fc1cc(NCc2cnccn2)ncn1 Amb30036269 [0,1,0,0,0,0|3,0,0]=4 690 B16R2.252 Fc1cc(OCc2ccccc2)ccn1 Amb22235139 [0,1,0,0,0,0|3,0,0]=4 691 B16R2.252 Fc1cc(SCc2ccccc2)ccn1 Amb27447085 [0,1,0,0,0,0|3,0,0]=4 692 B16R2.252 Fc1cccc(CNc2ccccc2)c1 Amb6685070 [0,1,0,0,0,0|1,0,0]=2 693 B16R2.252 Fc1cccc(CNc2ccccn2)c1 Amb7762026 [0,1,0,0,0,0|2,0,0]=3 694 B16R2.252 Fc1cccc(COc2ccccc2)c1 Amb2691208 [0,1,0,0,0,0|2,0,0]=3 695 B16R2.252 Fc1cccc(NCc2ccccc2)c1 Amb33328760 [0,1,0,0,0,0|1,0,0]=2 696 B16R2.252 Fc1cccc(NCc2ccccc2)c1 Amb6695891 [0,1,0,0,0,0|1,0,0]=2 697 B16R2.252 Fc1cccc(NCc2ccccc2)n1 Amb23606138 [0,1,0,0,0,0|2,0,0]=3 698 B16R2.252 Fc1cccc(NCc2ccccn2)c1 Amb6695901 [0,1,0,0,0,0|2,0,0]=3 699 B16R2.252 Fc1cccc(NCc2ccccn2)n1 Amb18973536 [0,1,0,0,0,0|3,0,0]=4 700 B16R2.252 Fc1cccc(NCc2cccnc2)c1 Amb6695785 [0,1,0,0,0,0|0,0,0]=1 701 B16R2.252 Fc1cccc(NCc2ccncc2)c1 Amb6695790 [0,1,0,0,0,0|2,0,0]=3 702 B16R2.252 Fc1cccc(NCc2ccncc2)n1 Amb18973538 [0,1,0,0,0,0|3,0,0]=4 703 B16R2.252 Fc1cccc(NCc2cnccn2)n1 Amb35686379 [0,1,0,0,0,0|2,0,0]=3 704 B16R2.252 Fc1cccc(NCc2cncnc2)c1 Amb18300792 [0,1,0,0,0,0|1,0,0]=2 705 B16R2.252 Fc1cccc(OCc2ccccc2)c1 Amb8392534 [0,1,0,0,0,0|2,0,0]=3 706 B16R2.252 Fc1cccc(SCc2ccccc2)n1 Amb27610813 [0,1,0,0,0,0|3,0,0]=4 707 B16R2.252 Fc1cncc(NCc2ccccc2)n1 Amb35708527 [0,1,0,0,0,0|3,0,0]=4 708 B16R2.252 Fc1cncc(NCc2cccnc2)n1 Amb35708528 [0,1,0,0,0,0|2,0,0]=3 709 B16R2.252 Fc1cncc(NCc2cccnn2)n1 Amb35708532 [0,1,0,0,0,0|3,0,0]=4 710 B16R2.252 Fc1cncc(NCc2cnccn2)n1 Amb35654741 [0,1,0,0,0,0|3,0,0]=4 711 B16R2.252 Fc1cncc(OCc2ccccc2)c1 Amb27825548 [0,1,0,0,0,0|2,0,0]=3 712 B16R2.252 Fc1cncc(OCc2ccccc2)n1 Amb35708399 [0,1,0,0,0,0|3,0,0]=4 713 B16R2.252 Fc1cncc(OCc2cccnc2)n1 Amb35708404 [0,1,0,0,0,0|3,0,0]=4 714 B16R2.252 Fc1cncc(SCc2ccccc2)n1 Amb35712142 [0,1,0,0,0,0|3,0,0]=4 715 B16R2.252 Fc1nccc(NCc2ccccc2)n1 Amb35671056 [0,1,0,0,0,0|3,0,0]=4 716 B16R2.252 Fc1nccc(NCc2cccnc2)n1 Amb35671057 [0,1,0,0,0,0|2,0,0]=3 717 B16R2.252 Fc1nccc(NCc2cccnn2)n1 Amb35671061 [0,1,0,0,0,0|3,0,0]=4 718 B16R2.252 Fc1nccc(NCc2cnccn2)n1 Amb35654740 [0,1,0,0,0,0|3,0,0]=4 719 B16R2.252 Fc1nccc(OCc2cccnc2)n1 Amb35670904 [0,1,0,0,0,0|3,0,0]=4 720 B16R2.252 Ic1cccc(NCc2ccccc2)c1 Amb7761234 [0,1,0,0,0,0|1,0,0]=2 721 B16R2.252 Ic1cccc(NCc2ccccn2)c1 Amb9208170 [0,1,0,0,0,0|2,0,0]=3 722 B16R2.252 Ic1cccc(NCc2cccnc2)c1 Amb9204454 [0,1,0,0,0,0|0,0,0]=1 723 B16R2.252 Ic1cccc(NCc2ccncc2)c1 Amb9203727 [0,1,0,0,0,0|2,0,0]=3 724 B16R2.252 Ic1cccc(NCc2cncnc2)c1 Amb33212676 [0,1,0,0,0,0|1,0,0]=2 725 B16R2.252 Ic1cccc(OCc2cccnc2)c1 Amb27861648 [0,1,0,0,0,0|1,0,0]=2 726 B16R2.252 Ic1cccc(OCc2cnccn2)c1 Amb30018074 [0,1,0,0,0,0|2,0,0]=3 727 B16R2.252 Ic1ccnc(OCc2ccccc2)c1 Amb22498332 [0,1,0,0,0,0|3,0,0]=4 728 B16R2.252 Ic1cncc(OCc2ccccc2)c1 Amb24329390 [0,1,0,0,0,0|2,0,0]=3 729 B16R2.252 Nc1cc(CCc2ccccc2)ccn1 Amb18652925 [0,1,0,0,0,0|3,0,0]=4 730 B16R2.252 Nc1cc(CCc2ccccc2)ccn1 Amb20622591 [0,1,0,0,0,0|3,0,0]=4 731 B16R2.252 Nc1cc(NCc2ccccc2)ncn1 Amb27231222 [0,1,0,0,0,0|3,0,0]=4 732 B16R2.252 Nc1cc(OCc2ccccc2)ccn1 Amb16233369 [0,1,0,0,0,0|3,0,0]=4 733 B16R2.252 Nc1cc(OCc2ccccc2)cnn1 Amb33521795 [0,1,0,0,0,0|3,0,0]=4 734 B16R2.252 Nc1cccc(C#Cc2ccccc2)c1 Amb1106348 [0,1,0,0,0,0|2,0,1]=4 735 B16R2.252 Nc1cccc(CCc2ccccn2)c1 Amb17762893 [0,1,0,0,0,0|3,0,0]=4 736 B16R2.252 Nc1cccc(CCc2ccncc2)c1 Amb6315608 [0,1,0,0,0,0|3,0,0]=4 737 B16R2.252 Nc1cccc(CCc2nccnn2)c1 Amb18864294 [0,1,0,0,0,0|3,0,0]=4 738 B16R2.252 Nc1cccc(COc2ccccc2)c1 Amb2724117 [0,1,0,0,0,0|2,0,0]=3 739 B16R2.252 Nc1cccc(COc2ccccc2)c1 Amb33164191 [0,1,0,0,0,0|2,0,0]=3 740 B16R2.252 Nc1cccc(COc2cccnc2)c1 Amb21965018 [0,1,0,0,0,0|2,0,0]=3 741 B16R2.252 Nc1cccc(CSc2ccccn2)c1 Amb6676721 [0,1,0,0,0,0|3,0,0]=4 742 B16R2.252 Nc1cccc(OCc2ccccc2)c1 Amb1119757 [0,1,0,0,0,0|2,0,0]=3 743 B16R2.252 Nc1cccc(OCc2ccccc2)n1 Amb26954004 [0,1,0,0,0,0|3,0,0]=4 744 B16R2.252 Nc1cccc(OCc2ccccn2)c1 Amb1119053 [0,1,0,0,0,0|3,0,0]=4 745 B16R2.252 Nc1cccc(OCc2ccccn2)c1 Amb6893101 [0,1,0,0,0,0|3,0,0]=4 746 B16R2.252 Nc1cccc(OCc2cccnc2)c1 Amb1116746 [0,1,0,0,0,0|1,0,0]=2 747 B16R2.252 Nc1cccc(OCc2ccncc2)c1 Amb1125338 [0,1,0,0,0,0|3,0,0]=4 748 B16R2.252 Nc1cccc(OCc2nccnn2)c1 Amb18864521 [0,1,0,0,0,0|3,0,0]=4 749 B16R2.252 Nc1cccc(\C=C\c2ccccc2)c1 Amb18137668 [0,1,0,0,0,0|2,0,1]=4 750 B16R2.252 Nc1cccc(\N=N\c2ccccc2)c1 Amb17595232 [0,1,0,0,0,0|2,0,1]=4 751 B16R2.252 Nc1ccnc(NCc2ccccc2)c1 Amb17337415 [0,1,0,0,0,0|2,0,0]=3 752 B16R2.252 Nc1ccnc(NCc2ccccc2)n1 Amb20248765 [0,1,0,0,0,0|3,0,0]=4 753 B16R2.252 Nc1ccnc(NCc2ccccn2)c1 Amb17337554 [0,1,0,0,0,0|3,0,0]=4 754 B16R2.252 Nc1ccnc(NCc2cccnc2)c1 Amb17337555 [0,1,0,0,0,0|1,0,0]=2 755 B16R2.252 Nc1ccnc(NCc2cccnc2)n1 Amb31116200 [0,1,0,0,0,0|2,0,0]=3 756 B16R2.252 Nc1ccnc(NCc2ccncc2)c1 Amb17337556 [0,1,0,0,0,0|3,0,0]=4 757 B16R2.252 Nc1ccnc(OCc2ccccc2)c1 Amb18981531 [0,1,0,0,0,0|3,0,0]=4 758 B16R2.252 Nc1ccnc(SCc2ccccc2)c1 Amb18981546 [0,1,0,0,0,0|3,0,0]=4 759 B16R2.252 Nc1cncc(OCc2ccccc2)c1 Amb21857185 [0,1,0,0,0,0|2,0,0]=3 760 B16R2.252 Nc1cncc(OCc2ccccc2)n1 Amb19664394 [0,1,0,0,0,0|3,0,0]=4 761 B16R2.252 Nc1nccc(NCc2ccccc2)n1 Amb27830409 [0,1,0,0,0,0|3,0,0]=4 762 B16R2.252 O=C1C=C(CCc2ccccc2)C=CN1 Amb35744393 [0,1,0,0,0,0|3,0,0]=4 763 B16R2.252 O=C1C=C(NCc2ccccc2)C=CN1 Amb22276456 [0,1,0,0,0,0|2,0,0]=3 764 B16R2.252 O=C1C=C(NCc2ccccc2)N=CN1 Amb27224729 [0,1,0,0,0,0|3,0,0]=4 765 B16R2.252 O=C1C=C(NCc2cccnc2)CCC1 Amb8472884 [0,1,0,0,0,0|0,0,3]=4 766 B16R2.252 O=C1C=C(OCc2ccccc2)C=CN1 Amb19892336 [0,1,0,0,0,0|3,0,0]=4 767 B16R2.252 O=C1C=C(OCc2ccccc2)C=NN1 Amb22276670 [0,1,0,0,0,0|3,0,0]=4 768 B16R2.252 O=C1C=CC=C(OCc2ccccc2)N1 Amb27222379 [0,1,0,0,0,0|3,0,0]=4 769 B16R2.252 O=C1C=CN=C(NCc2ccccc2)N1 Amb18363839 [0,1,0,0,0,0|3,0,0]=4 770 B16R2.252 Oc1cccc(CCc2ccccc2)c1 Amb8388641 [0,1,0,0,0,0|2,0,0]=3 771 B16R2.252 Oc1cccc(CNc2ccccc2)c1 Amb3546319 [0,1,0,0,0,0|1,0,0]=2 772 B16R2.252 Oc1cccc(CNc2ccccn2)c1 Amb17100057 [0,1,0,0,0,0|2,0,0]=3 773 B16R2.252 Oc1cccc(CNc2cccnc2)c1 Amb6686630 [0,1,0,0,0,0|2,0,0]=3 774 B16R2.252 Oc1cccc(COc2ccccc2)c1 Amb23443322 [0,1,0,0,0,0|2,0,0]=3 775 B16R2.252 Oc1cccc(NCc2ccccc2)c1 Amb6734931 [0,1,0,0,0,0|1,0,0]=2 776 B16R2.252 Oc1cccc(NCc2ccccc2)n1 Amb27767162 [0,1,0,0,0,0|2,0,0]=3 777 B16R2.252 Oc1cccc(OCc2ccccc2)c1 Amb33528500 [0,1,0,0,0,0|2,0,0]=3 778 B16R2.252 Oc1cccc(\C=C\c2ccccc2)c1 Amb6296671 [0,1,0,0,0,0|2,0,1]=4 779 B16R2.252 Oc1cccc(\N=N\c2ccccc2)c1 Amb21812045 [0,1,0,0,0,0|2,0,1]=4 780 B16R2.252 Oc1cncc(OCc2ccccc2)c1 Amb25903369 [0,1,0,0,0,0|2,0,0]=3 781 B16R2.252 Sc1cccc(OCc2ccccc2)c1 Amb22723410 [0,1,0,0,0,0|2,0,0]=3 782 B16R2.252 [O-][n+]1cccc(OCc2ccccc2)c1 Amb27169161 [0,1,0,0,0,0|2,0,1]=4 783 B14R1.123 N#C\C=C/C=C\NCc1ccccc1 Amb18648938 [0,0,1,0,0,0|2,0,1]=4 784 B14R1.123 O=C\C=C\C=C\NCc1ccccc1 Amb27632389 [0,0,1,0,0,0|2,0,0]=3 785 B14R1.979 C=CC(\C=C\C)NCc1ccccc1 Amb27830561 [0,0,1,0,0,0|1,0,2]=4 786 B14R1.979 C=C[C@@H](\C=C\C)NCc1ccccc1 Amb28135386 [0,0,1,0,0,0|1,0,2]=4 787 B16R3.9 c1cc2c(ccc3cnccc32)cn1 Amb32620546 [0,0,0,1,0,0|2,0,1]=4 788 B16R3.9 c1ccc-2c(c1)CCc3ccccc32 Amb17672017 [0,0,0,1,0,0|2,0,0]=3 789 B16R3.9 c1ccc-2c(c1)CCc3cncnc32 Amb23401185 [0,0,0,1,0,0|2,0,0]=3 790 B16R3.9 c1ccc-2c(c1)CCc3ncccc32 Amb27402349 [0,0,0,1,0,0|3,0,0]=4 791 B16R3.9 c1ccc-2c(c1)CNc3ccccc32 Amb32665195 [0,0,0,1,0,0|1,0,0]=2 792 B16R3.9 c1ccc-2c(c1)CNc3ccccc32 Amb9201095 [0,0,0,1,0,0|1,0,0]=2 793 B16R3.9 c1ccc-2c(c1)NCc3cnccc32 Amb27412036 [0,0,0,1,0,0|0,0,0]=1 794 B16R3.9 c1ccc-2c(c1)NCc3cncnc32 Amb26313182 [0,0,0,1,0,0|1,0,0]=2 795 B16R3.9 c1ccc-2c(c1)SSc3ccccc32 Amb27756332 [0,0,0,1,0,0|3,0,0]=4 796 B16R3.9 c1ccc2c(c1)ccc3ccccc32 Amb6297759 [0,0,0,1,0,0|2,0,1]=4 797 B16R3.9 c1ccc2c(c1)ccc3cccnc32 Amb8513497 [0,0,0,1,0,0|1,0,1]=3 798 B16R3.9 c1ccc2c(c1)ccc3cnccc32 Amb27752422 [0,0,0,1,0,0|1,0,1]=3 799 B16R3.9 c1ccc2c(c1)ccc3nccnc32 Amb27387429 [0,0,0,1,0,0|2,0,1]=4 800 B16R3.9 c1ccc2c(c1)cnc3ccccc32 Amb2609985 [0,0,0,1,0,0|1,0,2]=4 801 B16R3.9 c1ccc2c(c1)cnc3ccnnc32 Amb27762858 [0,0,0,1,0,0|3,0,0]=4 802 B16R3.9 c1ccc2c(c1)ncc3cnncc32 Amb27881685 [0,0,0,1,0,0|1,0,2]=4 803 B16R3.9 c1ccc2c(c1)nnc3ccccc32 Amb2746830 [0,0,0,1,0,0|2,0,1]=4 804 B16R3.9 c1cnc-2c(c1)COc3ccccc32 Amb28347446 [0,0,0,1,0,0|1,0,0]=2 805 B16R3.9 c1cnc2c(c1)ccc3ccc[nH+]c32 Amb20661604 [0,0,0,1,0,0|2,0,1]=4 806 B16R3.9 c1cnc2c(c1)ccc3cccnc32 Amb1196120 [0,0,0,1,0,0|2,0,1]=4 807 B16R3.9 c1cnc2c(c1)ccc3cccnc32 Amb22336341 [0,0,0,1,0,0|2,0,1]=4 808 B16R3.9 c1cnc2c(c1)ccc3cccnc32 Amb2384019 [0,0,0,1,0,0|2,0,1]=4 809 B16R3.9 c1cnc2c(c1)ccc3cccnc32 Amb2384020 [0,0,0,1,0,0|2,0,1]=4 810 B16R3.9 c1cnc2c(c1)ccc3cccnc32 Amb2384024 [0,0,0,1,0,0|2,0,1]=4 811 B16R3.9 c1cnc2c(c1)ccc3cccnc32 Amb2690232 [0,0,0,1,0,0|2,0,1]=4 812 B16R3.9 c1cnc2c(c1)ccc3cccnc32 Amb2747999 [0,0,0,1,0,0|2,0,1]=4 813 B16R3.9 c1cnc2c(c1)ccc3cccnc32 Amb33329023 [0,0,0,1,0,0|2,0,1]=4 814 B16R3.9 c1cnc2c(c1)ccc3ncccc32 Amb2609979 [0,0,0,1,0,0|2,0,1]=4 815 B16R3.9 c1cnc2c(c1)nnc3cccnc32 Amb25336338 [0,0,0,1,0,0|2,0,1]=4 816 B16R3.1783 c1ccc(C2Cc3ccccc32)cc1 Amb17778867 [0,0,0,1,0,0|2,0,0]=3 817 B16R3.1783 c1ccc(C2Cc3ccccc32)nc1 Amb17778880 [0,0,0,1,0,0|3,0,0]=4 818 B14R2.6 C1=CN=C(Nc2ccccc2)OC1 Amb28397477 [0,0,0,0,1,0|3,0,0]=4 819 B14R2.6 c1cc(Cc2ccncc2)ccn1 Amb25336509 [0,0,0,0,1,0|3,0,0]=4 820 B14R2.6 c1cc(Nc2ccncc2)ccn1 Amb2732578 [0,0,0,0,1,0|3,0,0]=4 821 B14R2.6 c1cc[n+](Cc2ccccn2)cc1 Amb2613484 [0,0,0,0,1,0|3,0,0]=4 822 B14R2.6 c1cc[n+](Cc2ccccn2)cc1 Amb4005979 [0,0,0,0,1,0|3,0,0]=4 823 B14R2.6 c1ccc(C[n+]2ccccc2)cc1 Amb4009585 [0,0,0,0,1,0|2,0,0]=3 824 B14R2.6 c1ccc(Cc2cc[nH+]cc2)cc1 Amb4027559 [0,0,0,0,1,0|2,0,0]=3 825 B14R2.6 c1ccc(Cc2ccccc2)cc1 Amb6357390 [0,0,0,0,1,0|1,0,0]=2 826 B14R2.6 c1ccc(Cc2ccccn2)cc1 Amb2610000 [0,0,0,0,1,0|2,0,0]=3 827 B14R2.6 c1ccc(Cc2cccnc2)cc1 Amb5718939 [0,0,0,0,1,0|0,0,0]=1 828 B14R2.6 c1ccc(Cc2ccncc2)cc1 Amb2609983 [0,0,0,0,1,0|2,0,0]=3 829 B14R2.6 c1ccc(Cc2cnccn2)cc1 Amb22263670 [0,0,0,0,1,0|1,0,0]=2 830 B14R2.6 c1ccc(Nc2ccccc2)cc1 Amb1215248 [0,0,0,0,1,0|1,0,0]=2 831 B14R2.6 c1ccc(Nc2ccccc2)cc1 Amb6365657 [0,0,0,0,1,0|1,0,0]=2 832 B14R2.6 c1ccc(Nc2ccccn2)cc1 Amb1151333 [0,0,0,0,1,0|2,0,0]=3 833 B14R2.6 c1ccc(Nc2ccccn2)nc1 Amb6456603 [0,0,0,0,1,0|3,0,0]=4 834 B14R2.6 c1ccc(Nc2cccnc2)nc1 Amb18932030 [0,0,0,0,1,0|1,0,0]=2 835 B14R2.6 c1ccc(Nc2ccncc2)cc1 Amb6296876 [0,0,0,0,1,0|2,0,0]=3 836 B14R2.6 c1ccc(Nc2ccncn2)cc1 Amb26899716 [0,0,0,0,1,0|3,0,0]=4 837 B14R2.6 c1ccc(Nc2cnccn2)cc1 Amb26537959 [0,0,0,0,1,0|1,0,0]=2 838 B14R2.6 c1ccc(Nc2cncnc2)nc1 Amb18269185 [0,0,0,0,1,0|2,0,0]=3 839 B14R2.6 c1ccc(Nc2ncccn2)cc1 Amb8630964 [0,0,0,0,1,0|3,0,0]=4 840 B14R2.6 c1ccc(Nc2nccnn2)cc1 Amb24754013 [0,0,0,0,1,0|2,0,0]=3 841 B14R2.6 c1ccc(Nc2nccnn2)nc1 Amb28128465 [0,0,0,0,1,0|3,0,0]=4 842 B14R2.6 c1ccc(Oc2ccccc2)cc1 Amb6355877 [0,0,0,0,1,0|2,0,0]=3 843 B14R2.6 c1ccc(Oc2ccccc2)cc1 Amb8516759 [0,0,0,0,1,0|2,0,0]=3 844 B14R2.6 c1ccc(Oc2ccccn2)cc1 Amb10553559 [0,0,0,0,1,0|3,0,0]=4 845 B14R2.6 c1ccc(Oc2cccnc2)cc1 Amb8394912 [0,0,0,0,1,0|1,0,0]=2 846 B14R2.6 c1ccc(Oc2cccnn2)cc1 Amb24441314 [0,0,0,0,1,0|2,0,0]=3 847 B14R2.6 c1ccc(Oc2ccncc2)cc1 Amb2610105 [0,0,0,0,1,0|3,0,0]=4 848 B14R2.6 c1ccc(Oc2ccnnc2)cc1 Amb23592135 [0,0,0,0,1,0|2,0,0]=3 849 B14R2.6 c1ccc(Oc2cncnc2)cc1 Amb24098659 [0,0,0,0,1,0|2,0,0]=3 850 B14R2.6 c1ccc(Pc2ccccc2)cc1 Amb6365840 [0,0,0,0,1,0|1,1,0]=3 851 B14R2.6 c1ccc(Pc2ccccn2)cc1 Amb27254129 [0,0,0,0,1,0|2,1,0]=4 852 B14R2.6 c1ccc(Sc2ccccc2)cc1 Amb6608801 [0,0,0,0,1,0|2,0,0]=3 853 B14R2.6 c1ccc(Sc2ccccn2)cc1 Amb2610106 [0,0,0,0,1,0|3,0,0]=4 854 B14R2.6 c1ccc(Sc2cccnc2)cc1 Amb10573261 [0,0,0,0,1,0|1,0,0]=2 855 B14R2.6 c1ccc([I+]c2ccccc2)cc1 Amb10601891 [0,0,0,0,1,0|2,0,0]=3 856 B14R2.6 c1ccc([I+]c2ccccc2)cc1 Amb10840230 [0,0,0,0,1,0|2,0,0]=3 857 B14R2.6 c1ccc([I+]c2ccccc2)cc1 Amb10841525 [0,0,0,0,1,0|2,0,0]=3 858 B14R2.6 c1ccc([I+]c2ccccc2)cc1 Amb22263754 [0,0,0,0,1,0|2,0,0]=3 859 B14R2.6 c1ccc([I+]c2ccccc2)cc1 Amb32620366 [0,0,0,0,1,0|2,0,0]=3 860 B14R2.6 c1ccc([I+]c2ccccc2)cc1 Amb4006513 [0,0,0,0,1,0|2,0,0]=3 861 B14R2.6 c1ccc([I+]c2ccccc2)cc1 Amb6296651 [0,0,0,0,1,0|2,0,0]=3 862 B14R2.6 c1ccc([I+]c2ccccc2)cc1 Amb6366850 [0,0,0,0,1,0|2,0,0]=3 863 B14R2.6 c1ccc([Pt]c2ccccc2)cc1 Amb22234096 [0,0,0,0,1,0|2,0,0]=3 864 B14R2.6 c1ccc([Se]c2ccccc2)cc1 Amb8515146 [0,0,0,0,1,0|2,0,0]=3 865 B14R2.6 c1ccc([SiH2]c2ccccc2)cc1 Amb8515711 [0,0,0,0,1,0|1,1,0]=3 866 B14R2.6 c1cncc(Nc2cccnc2)c1 Amb18930867 [0,0,0,0,1,0|1,0,0]=2 867 B14R2.6 c1cncc(Nc2ccncc2)c1 Amb2609706 [0,0,0,0,1,0|1,0,0]=2 868 B14R2.6 c1cncc(Nc2cnccn2)c1 Amb27827867 [0,0,0,0,1,0|2,0,0]=3 869 B14R2.6 c1cncc(Nc2cncnc2)c1 Amb18267815 [0,0,0,0,1,0|2,0,0]=3 870 B14R2.6 c1cncc(Oc2cccnn2)c1 Amb27660429 [0,0,0,0,1,0|3,0,0]=4 871 B14R2.6 c1cncc(Oc2cnccn2)c1 Amb28204823 [0,0,0,0,1,0|3,0,0]=4 872 B14R2.6 c1cnnc(Sc2ccncc2)c1 Amb27406594 [0,0,0,0,1,0|3,0,0]=4 873 B14R2.101 C(#Cc1cccs1)c2ccccc2 Amb1017421 [0,0,0,0,1,0|2,0,1]=4 874 B14R2.101 C(#Cc1cncs1)c2ccccc2 Amb27163211 [0,0,0,0,1,0|2,0,1]=4 875 B14R2.101 C(#Cc1cscn1)c2ccccc2 Amb27954706 [0,0,0,0,1,0|2,0,1]=4 876 B14R2.101 C(=C\c1ccco1)/c2ccccc2 Amb26498528 [0,0,0,0,1,0|2,0,1]=4 877 B14R2.101 C(=C\c1cccs1)/c2ccccc2 Amb1060407 [0,0,0,0,1,0|2,0,1]=4 878 B14R2.101 C(=C\c1ccsc1)/c2ccccc2 Amb2642856 [0,0,0,0,1,0|2,0,1]=4 879 B14R2.101 C(=C\n1ccnc1)/c2ccccc2 Amb26390906 [0,0,0,0,1,0|2,0,1]=4 880 B14R2.101 C(=N\c1ccccc1)/c2cccs2 Amb2425844 [0,0,0,0,1,0|1,0,2]=4 881 B14R2.101 C1=C(CNc2ccccc2)CCC1 Amb27233641 [0,0,0,0,1,0|0,0,3]=4 882 B14R2.101 C1=C(CNc2ccccc2)CSC1 Amb35622742 [0,0,0,0,1,0|1,0,2]=4 883 B14R2.101 C1=C(CNc2ccccc2)OCC1 Amb27873530 [0,0,0,0,1,0|1,0,2]=4 884 B14R2.101 C1=CC(NCc2cccnc2)CC1 Amb30006979 [0,0,0,0,1,0|0,0,3]=4 885 B14R2.101 c1cc(CCc2ccsc2)ccn1 Amb25999102 [0,0,0,0,1,0|3,0,0]=4 886 B14R2.101 c1cc(NCc2ccno2)ccn1 Amb27984422 [0,0,0,0,1,0|2,0,0]=3 887 B14R2.101 c1cc(NCc2ccno2)ncn1 Amb27760775 [0,0,0,0,1,0|3,0,0]=4 888 B14R2.101 c1cc(NCc2ccns2)ccn1 Amb35719861 [0,0,0,0,1,0|2,0,0]=3 889 B14R2.101 c1cc(NCc2ccns2)ncn1 Amb35719686 [0,0,0,0,1,0|3,0,0]=4 890 B14R2.101 c1cc(NCc2ccon2)ccn1 Amb27585450 [0,0,0,0,1,0|2,0,0]=3 891 B14R2.101 c1cc(NCc2cncs2)ccn1 Amb27415045 [0,0,0,0,1,0|2,0,0]=3 892 B14R2.101 c1cc(NCc2cocn2)ncn1 Amb27785017 [0,0,0,0,1,0|3,0,0]=4 893 B14R2.101 c1cc(NCc2cscn2)ncn1 Amb27442233 [0,0,0,0,1,0|3,0,0]=4 894 B14R2.101 c1cc(NCc2csnn2)ccn1 Amb27644801 [0,0,0,0,1,0|3,0,0]=4 895 B14R2.101 c1cc(OCc2nccs2)ccn1 Amb28182707 [0,0,0,0,1,0|3,0,0]=4 896 B14R2.101 c1cc(SCc2ccno2)ccn1 Amb28065590 [0,0,0,0,1,0|3,0,0]=4 897 B14R2.101 c1ccc(CCc2cnco2)cc1 Amb22753570 [0,0,0,0,1,0|2,0,0]=3 898 B14R2.101 c1ccc(CCc2nccs2)cc1 Amb28122204 [0,0,0,0,1,0|2,0,0]=3 899 B14R2.101 c1ccc(CCc2nccs2)nc1 Amb30007530 [0,0,0,0,1,0|3,0,0]=4 900 B14R2.101 c1ccc(CCc2ncon2)cc1 Amb27951724 [0,0,0,0,1,0|3,0,0]=4 901 B14R2.101 c1ccc(CCn2cccc2)cc1 Amb1067085 [0,0,0,0,1,0|2,0,0]=3 902 B14R2.101 c1ccc(CCn2cccn2)cc1 Amb20622458 [0,0,0,0,1,0|2,0,0]=3 903 B14R2.101 c1ccc(CCn2cccn2)nc1 Amb27786219 [0,0,0,0,1,0|3,0,0]=4 904 B14R2.101 c1ccc(CCn2ccnc2)cc1 Amb10179875 [0,0,0,0,1,0|2,0,0]=3 905 B14R2.101 c1ccc(CCn2ccnn2)cc1 Amb27652775 [0,0,0,0,1,0|3,0,0]=4 906 B14R2.101 c1ccc(CCn2cncn2)cc1 Amb20622454 [0,0,0,0,1,0|3,0,0]=4 907 B14R2.101 c1ccc(CNc2ccco2)cc1 Amb25380740 [0,0,0,0,1,0|2,0,0]=3 908 B14R2.101 c1ccc(CNc2cnoc2)cc1 Amb8393408 [0,0,0,0,1,0|3,0,0]=4 909 B14R2.101 c1ccc(CNc2cnsc2)cc1 Amb24496928 [0,0,0,0,1,0|3,0,0]=4 910 B14R2.101 c1ccc(CNc2ncco2)cc1 Amb2382982 [0,0,0,0,1,0|3,0,0]=4 911 B14R2.101 c1ccc(CNc2nccs2)cc1 Amb6649022 [0,0,0,0,1,0|3,0,0]=4 912 B14R2.101 c1ccc(COc2ccsn2)cc1 Amb24179171 [0,0,0,0,1,0|3,0,0]=4 913 B14R2.101 c1ccc(COc2nccs2)cc1 Amb26059375 [0,0,0,0,1,0|3,0,0]=4 914 B14R2.101 c1ccc(COn2cccn2)cc1 Amb10067877 [0,0,0,0,1,0|3,0,0]=4 915 B14R2.101 c1ccc(CSc2cccs2)cc1 Amb27753630 [0,0,0,0,1,0|3,0,0]=4 916 B14R2.101 c1ccc(CSc2ccno2)cc1 Amb27412825 [0,0,0,0,1,0|3,0,0]=4 917 B14R2.101 c1ccc(CSc2ccsc2)cc1 Amb8444986 [0,0,0,0,1,0|3,0,0]=4 918 B14R2.101 c1ccc(NCC2=NCCN2)cc1 Amb27593487 [0,0,0,0,1,0|1,0,2]=4 919 B14R2.101 c1ccc(NCC2=NCCN2)cc1 Amb32835540 [0,0,0,0,1,0|1,0,2]=4 920 B14R2.101 c1ccc(NCc2ccco2)cc1 Amb1669289 [0,0,0,0,1,0|1,0,0]=2 921 B14R2.101 c1ccc(NCc2ccco2)nc1 Amb1763150 [0,0,0,0,1,0|2,0,0]=3 922 B14R2.101 c1ccc(NCc2ccco2)nc1 Amb8191018 [0,0,0,0,1,0|2,0,0]=3 923 B14R2.101 c1ccc(NCc2cccs2)cc1 Amb4399614 [0,0,0,0,1,0|1,0,0]=2 924 B14R2.101 c1ccc(NCc2cccs2)nc1 Amb2578438 [0,0,0,0,1,0|2,0,0]=3 925 B14R2.101 c1ccc(NCc2ccno2)nc1 Amb28280420 [0,0,0,0,1,0|2,0,0]=3 926 B14R2.101 c1ccc(NCc2ccns2)cc1 Amb35682531 [0,0,0,0,1,0|1,0,0]=2 927 B14R2.101 c1ccc(NCc2ccns2)nc1 Amb35719509 [0,0,0,0,1,0|2,0,0]=3 928 B14R2.101 c1ccc(NCc2ccsc2)cc1 Amb13952328 [0,0,0,0,1,0|1,0,0]=2 929 B14R2.101 c1ccc(NCc2ccsc2)cc1 Amb6685084 [0,0,0,0,1,0|1,0,0]=2 930 B14R2.101 c1ccc(NCc2cncs2)cc1 Amb18996498 [0,0,0,0,1,0|1,0,0]=2 931 B14R2.101 c1ccc(NCc2cnns2)cc1 Amb27807836 [0,0,0,0,1,0|2,0,0]=3 932 B14R2.101 c1ccc(NCc2cscn2)cc1 Amb18972441 [0,0,0,0,1,0|1,0,0]=2 933 B14R2.101 c1ccc(NCc2ncco2)cc1 Amb18825238 [0,0,0,0,1,0|1,0,0]=2 934 B14R2.101 c1ccc(NCc2nccs2)cc1 Amb7541898 [0,0,0,0,1,0|1,0,0]=2 935 B14R2.101 c1ccc(NCc2ncno2)cc1 Amb18290399 [0,0,0,0,1,0|2,0,0]=3 936 B14R2.101 c1ccc(NCn2cncn2)nc1 Amb8503535 [0,0,0,0,1,0|3,0,0]=4 937 B14R2.101 c1ccc(OCc2ccco2)cc1 Amb1352023 [0,0,0,0,1,0|2,0,0]=3 938 B14R2.101 c1ccc(OCc2ccno2)nc1 Amb27485533 [0,0,0,0,1,0|3,0,0]=4 939 B14R2.101 c1ccc(OCc2ccns2)cc1 Amb35651544 [0,0,0,0,1,0|2,0,0]=3 940 B14R2.101 c1ccc(OCc2ccon2)nc1 Amb28208056 [0,0,0,0,1,0|3,0,0]=4 941 B14R2.101 c1ccc(OCc2ccsc2)cc1 Amb27263375 [0,0,0,0,1,0|2,0,0]=3 942 B14R2.101 c1ccc(OCc2cncs2)nc1 Amb33610431 [0,0,0,0,1,0|3,0,0]=4 943 B14R2.101 c1ccc(OCc2cnoc2)nc1 Amb27254856 [0,0,0,0,1,0|3,0,0]=4 944 B14R2.101 c1ccc(OCc2cnsn2)cc1 Amb27435930 [0,0,0,0,1,0|3,0,0]=4 945 B14R2.101 c1ccc(OCn2ccnc2)cc1 Amb27956452 [0,0,0,0,1,0|2,0,0]=3 946 B14R2.101 c1ccc(SCc2cccs2)cc1 Amb26436043 [0,0,0,0,1,0|2,0,0]=3 947 B14R2.101 c1ccc(SCc2ccno2)cc1 Amb27163326 [0,0,0,0,1,0|2,0,0]=3 948 B14R2.101 c1ccc(SCc2ccon2)cc1 Amb27443456 [0,0,0,0,1,0|2,0,0]=3 949 B14R2.101 c1ccc(SCc2cocn2)nc1 Amb33618006 [0,0,0,0,1,0|3,0,0]=4 950 B14R2.101 c1ccc(SCc2ncno2)cc1 Amb27979255 [0,0,0,0,1,0|3,0,0]=4 951 B14R2.101 c1ccn(NCc2ccncc2)c1 Amb27880209 [0,0,0,0,1,0|3,0,0]=4 952 B14R2.101 c1ccn(NCc2cnccn2)c1 Amb27869062 [0,0,0,0,1,0|2,0,0]=3 953 B14R2.101 c1cnc(CNc2cnsc2)cn1 Amb35699482 [0,0,0,0,1,0|3,0,0]=4 954 B14R2.101 c1cnc(NCc2ccco2)nc1 Amb6611844 [0,0,0,0,1,0|3,0,0]=4 955 B14R2.101 c1cnc(NCc2ccno2)nc1 Amb27755670 [0,0,0,0,1,0|3,0,0]=4 956 B14R2.101 c1cnc(NCc2ccns2)cn1 Amb35719580 [0,0,0,0,1,0|3,0,0]=4 957 B14R2.101 c1cnc(NCc2ccns2)nc1 Amb35719679 [0,0,0,0,1,0|3,0,0]=4 958 B14R2.101 c1cnc(NCc2ccoc2)cn1 Amb28043520 [0,0,0,0,1,0|3,0,0]=4 959 B14R2.101 c1cnc(NCc2cncs2)nc1 Amb28319411 [0,0,0,0,1,0|3,0,0]=4 960 B14R2.101 c1cnc(NCc2cscn2)cn1 Amb27412215 [0,0,0,0,1,0|3,0,0]=4 961 B14R2.101 c1cnc(NCc2cscn2)nc1 Amb27232417 [0,0,0,0,1,0|3,0,0]=4 962 B14R2.101 c1cnc(NCc2nccs2)cn1 Amb18972592 [0,0,0,0,1,0|3,0,0]=4 963 B14R2.101 c1cncc(CCn2cccn2)c1 Amb27253912 [0,0,0,0,1,0|3,0,0]=4 964 B14R2.101 c1cncc(CCn2ccnc2)c1 Amb27459919 [0,0,0,0,1,0|3,0,0]=4 965 B14R2.101 c1cncc(CNc2ccon2)c1 Amb23505741 [0,0,0,0,1,0|2,0,0]=3 966 B14R2.101 c1cncc(CNc2ccsc2)c1 Amb27238344 [0,0,0,0,1,0|1,0,0]=2 967 B14R2.101 c1cncc(CNc2cnsc2)c1 Amb35699474 [0,0,0,0,1,0|2,0,0]=3 968 B14R2.101 c1cncc(CNc2ncco2)c1 Amb2382985 [0,0,0,0,1,0|2,0,0]=3 969 B14R2.101 c1cncc(CNc2nccs2)c1 Amb6649300 [0,0,0,0,1,0|2,0,0]=3 970 B14R2.101 c1cncc(CNn2cccc2)c1 Amb27410726 [0,0,0,0,1,0|1,0,0]=2 971 B14R2.101 c1cncc(CNn2cnnc2)c1 Amb2011455 [0,0,0,0,1,0|3,0,0]=4 972 B14R2.101 c1cncc(COn2cccn2)c1 Amb32423494 [0,0,0,0,1,0|3,0,0]=4 973 B14R2.101 c1cncc(CSc2cccs2)c1 Amb27652815 [0,0,0,0,1,0|2,0,0]=3 974 B14R2.101 c1cncc(CSc2ncco2)c1 Amb27980285 [0,0,0,0,1,0|3,0,0]=4 975 B14R2.101 c1cncc(NCc2ccco2)c1 Amb426860 [0,0,0,0,1,0|2,0,0]=3 976 B14R2.101 c1cncc(NCc2cccs2)c1 Amb6686502 [0,0,0,0,1,0|2,0,0]=3 977 B14R2.101 c1cncc(NCc2ccns2)c1 Amb35682532 [0,0,0,0,1,0|2,0,0]=3 978 B14R2.101 c1cncc(NCc2ccoc2)c1 Amb27982042 [0,0,0,0,1,0|2,0,0]=3 979 B14R2.101 c1cncc(NCc2ccsc2)c1 Amb6686510 [0,0,0,0,1,0|2,0,0]=3 980 B14R2.101 c1cncc(NCc2cncs2)c1 Amb18996499 [0,0,0,0,1,0|2,0,0]=3 981 B14R2.101 c1cncc(NCc2cscn2)c1 Amb18290515 [0,0,0,0,1,0|2,0,0]=3 982 B14R2.101 c1cncc(NCc2csnn2)c1 Amb9528987 [0,0,0,0,1,0|3,0,0]=4 983 B14R2.101 c1cncc(OCc2cccs2)c1 Amb27850522 [0,0,0,0,1,0|3,0,0]=4 984 B14R2.101 c1cncc(OCc2ccns2)c1 Amb35651545 [0,0,0,0,1,0|3,0,0]=4 985 B14R2.101 c1cncc(OCc2ccoc2)c1 Amb27479924 [0,0,0,0,1,0|3,0,0]=4 986 B14R2.101 c1cnn(CCc2ccncc2)c1 Amb28314054 [0,0,0,0,1,0|3,0,0]=4 987 B14R2.101 c1cnnc(NCc2ccns2)c1 Amb35719687 [0,0,0,0,1,0|3,0,0]=4 988 B14R2.101 c1cnnc(NCc2cncs2)c1 Amb27872834 [0,0,0,0,1,0|3,0,0]=4 989 B14R2.101 c1cnnc(NCc2nccs2)c1 Amb18991569 [0,0,0,0,1,0|3,0,0]=4 990 B14R2.101 c1coc(CNc2ccncc2)c1 Amb6640341 [0,0,0,0,1,0|2,0,0]=3 991 B14R2.101 c1csc(CNc2cnccn2)c1 Amb9022472 [0,0,0,0,1,0|3,0,0]=4 992 B14R2.101 c1ncc(CNc2cnsc2)cn1 Amb35699483 [0,0,0,0,1,0|3,0,0]=4 993 B14R2.101 c1ncc(CNc2ncco2)cn1 Amb28454629 [0,0,0,0,1,0|3,0,0]=4 994 B14R2.101 c1ncc(NCc2ccns2)cn1 Amb35682533 [0,0,0,0,1,0|3,0,0]=4 995 B14R2.101 c1ncc(NCc2ccsc2)cn1 Amb27244731 [0,0,0,0,1,0|3,0,0]=4 996 B14R2.101 c1ncc(NCc2cocn2)cn1 Amb27192032 [0,0,0,0,1,0|3,0,0]=4 997 B16R2.2256 C(#Cc1ccccc1)Nc2ccccc2 Amb24081250 [0,0,0,0,0,1|1,0,1]=3 998 B16R2.2256 C(=N/c1ccccc1)/Nc2ccccc2 Amb22350571 [0,0,0,0,0,1|1,0,1]=3 999 B16R2.2256 C(=N\Cc1ccccc1)/c2ccccc2 Amb33513282 [0,0,0,0,0,1|1,0,1]=3 1000 B16R2.2256 C(=N\Nc1ccccc1)/c2ccccc2 Amb5720542 [0,0,0,0,0,1|1,0,1]=3 1001 B16R2.2256 C(=N\c1ccccc1)/Nc2ccccc2 Amb6298318 [0,0,0,0,0,1|1,0,1]=3 1002 B16R2.2256 c1cc(CNCc2ccncc2)ccn1 Amb6729586 [0,0,0,0,0,1|3,0,0]=4 1003 B16R2.2256 c1cc(CNCc2ccncc2)ccn1 Amb6864949 [0,0,0,0,0,1|3,0,0]=4 1004 B16R2.2256 c1cc(CNCc2cnccn2)ccn1 Amb18314232 [0,0,0,0,0,1|2,0,0]=3 1005 B16R2.2256 c1ccc(CCCc2ccccc2)cc1 Amb2721029 [0,0,0,0,0,1|2,0,0]=3 1006 B16R2.2256 c1ccc(CCCc2ccccn2)cc1 Amb5718975 [0,0,0,0,0,1|3,0,0]=4 1007 B16R2.2256 c1ccc(CCNc2ccccc2)cc1 Amb2693183 [0,0,0,0,0,1|1,0,0]=2 1008 B16R2.2256 c1ccc(CCOc2ccccc2)cc1 Amb2720867 [0,0,0,0,0,1|2,0,0]=3 1009 B16R2.2256 c1ccc(CNCc2ccccc2)cc1 Amb17743700 [0,0,0,0,0,1|1,0,0]=2 1010 B16R2.2256 c1ccc(CNCc2ccccn2)cc1 Amb6356033 [0,0,0,0,0,1|2,0,0]=3 1011 B16R2.2256 c1ccc(CNCc2ccccn2)nc1 Amb33622775 [0,0,0,0,0,1|3,0,0]=4 1012 B16R2.2256 c1ccc(CNCc2ccccn2)nc1 Amb3939204 [0,0,0,0,0,1|3,0,0]=4 1013 B16R2.2256 c1ccc(CNCc2cccnc2)cc1 Amb6356030 [0,0,0,0,0,1|0,0,0]=1 1014 B16R2.2256 c1ccc(CNCc2cccnc2)nc1 Amb6699051 [0,0,0,0,0,1|1,0,0]=2 1015 B16R2.2256 c1ccc(CNCc2ccncc2)cc1 Amb6356034 [0,0,0,0,0,1|2,0,0]=3 1016 B16R2.2256 c1ccc(CNCc2ccncc2)nc1 Amb6699053 [0,0,0,0,0,1|3,0,0]=4 1017 B16R2.2256 c1ccc(CNCc2ccncn2)cc1 Amb19030316 [0,0,0,0,0,1|3,0,0]=4 1018 B16R2.2256 c1ccc(CNCc2cnccn2)nc1 Amb18314224 [0,0,0,0,0,1|2,0,0]=3 1019 B16R2.2256 c1ccc(CNCc2cncnc2)cc1 Amb18314258 [0,0,0,0,0,1|1,0,0]=2 1020 B16R2.2256 c1ccc(CNCc2cncnc2)cc1 Amb33457833 [0,0,0,0,0,1|1,0,0]=2 1021 B16R2.2256 c1ccc(NCCc2ccccn2)cc1 Amb4020684 [0,0,0,0,0,1|2,0,0]=3 1022 B16R2.2256 c1ccc(SCCc2ccncc2)cc1 Amb583020 [0,0,0,0,0,1|3,0,0]=4 1023 B16R2.2256 c1ccc(SCSc2ccccc2)cc1 Amb2684782 [0,0,0,0,0,1|2,0,0]=3 1024 B16R2.2256 c1ccc(\N=N\Nc2ccccc2)cc1 Amb7809237 [0,0,0,0,0,1|2,0,0]=3 1025 B16R2.2256 c1cncc(CNCc2cccnc2)c1 Amb6316094 [0,0,0,0,0,1|1,0,0]=2 1026 B16R2.2256 c1cncc(CNCc2ccncc2)c1 Amb6332138 [0,0,0,0,0,1|1,0,0]=2 1027 B16R2.2256 c1cncc(CNCc2cnccn2)c1 Amb18314228 [0,0,0,0,0,1|2,0,0]=3 1028 B13R1.28 C=C\C=C\CNCc1ccccc1 Amb18127120 [1,0,1,0,0,0|1,0,1]=4 1029 B13R1.28 O=C\C=C\C=C\Nc1ccccc1 Amb27667120 [1,0,1,0,0,0|1,0,1]=4 1030 B13R1.28 O=C\C=C\C=N\Nc1ccccc1 Amb28255727 [1,0,1,0,0,0|2,0,0]=4 1031 B15R1.962 C\C(C=O)=C\C=C\NCc1ccccc1 Amb27964528 [0,1,1,0,0,0|2,0,0]=4 1032 B15R1.5919 O=C(O)\C=C\C(=O)NCc1cccnc1 Amb33531666 [0,1,1,0,0,0|2,0,0]=4 1033 B15R2.29 Brc1ccc(Cc2ccccc2)cc1 Amb2685151 [0,1,0,0,1,0|1,0,0]=3 1034 B15R2.29 Brc1ccc(Cc2ccccc2)cn1 Amb26504906 [0,1,0,0,1,0|0,0,0]=2 1035 B15R2.29 Brc1ccc(Cc2ccccc2)nc1 Amb25673195 [0,1,0,0,1,0|2,0,0]=4 1036 B15R2.29 Brc1ccc(Cc2ccccn2)cc1 Amb25168108 [0,1,0,0,1,0|2,0,0]=4 1037 B15R2.29 Brc1ccc(Cc2nccnn2)cc1 Amb18870485 [0,1,0,0,1,0|2,0,0]=4 1038 B15R2.29 Brc1ccc(Nc2ccccc2)cc1 Amb8392748 [0,1,0,0,1,0|1,0,0]=3 1039 B15R2.29 Brc1ccc(Nc2ccccc2)nc1 Amb20618853 [0,1,0,0,1,0|2,0,0]=4 1040 B15R2.29 Brc1ccc(Nc2ccccn2)cc1 Amb24072330 [0,1,0,0,1,0|2,0,0]=4 1041 B15R2.29 Brc1ccc(Nc2cccnc2)cc1 Amb26576940 [0,1,0,0,1,0|0,0,0]=2 1042 B15R2.29 Brc1ccc(Nc2ccncc2)cn1 Amb27631420 [0,1,0,0,1,0|1,0,0]=3 1043 B15R2.29 Brc1ccc(Oc2ccccc2)cc1 Amb3939305 [0,1,0,0,1,0|2,0,0]=4 1044 B15R2.29 Brc1ccc(Oc2cccnc2)cc1 Amb25692611 [0,1,0,0,1,0|1,0,0]=3 1045 B15R2.29 Brc1ccc(Oc2cccnc2)nc1 Amb21856230 [0,1,0,0,1,0|2,0,0]=4 1046 B15R2.29 Brc1ccc(Oc2cccnn2)cc1 Amb19515099 [0,1,0,0,1,0|2,0,0]=4 1047 B15R2.29 Brc1ccc(Oc2cnccn2)cc1 Amb6258369 [0,1,0,0,1,0|2,0,0]=4 1048 B15R2.29 Brc1ccc(Sc2ccccc2)cc1 Amb4021424 [0,1,0,0,1,0|2,0,0]=4 1049 B15R2.29 Brc1ccc(Sc2ccccc2)cn1 Amb27749674 [0,1,0,0,1,0|1,0,0]=3 1050 B15R2.29 Brc1cnc(Cc2ccccc2)cn1 Amb28995365 [0,1,0,0,1,0|1,0,0]=3 1051 B15R2.29 Brc1cnc(Nc2ccccc2)cn1 Amb27850457 [0,1,0,0,1,0|1,0,0]=3 1052 B15R2.29 Brc1cnc(Oc2ccccc2)cn1 Amb22371159 [0,1,0,0,1,0|2,0,0]=4 1053 B15R2.29 Cc1cc[n+](Cc2ccccc2)cc1 Amb2694549 [0,1,0,0,1,0|2,0,0]=4 1054 B15R2.29 Cc1ccc(Nc2ccccc2)cc1 Amb2617130 [0,1,0,0,1,0|1,0,0]=3 1055 B15R2.29 Cc1ccc(Nc2ccccc2)cn1 Amb27828069 [0,1,0,0,1,0|0,0,0]=2 1056 B15R2.29 Cc1ccc(Nc2ccccc2)nc1 Amb10573738 [0,1,0,0,1,0|2,0,0]=4 1057 B15R2.29 Cc1ccc(Nc2ccccc2)nn1 Amb2761327 [0,1,0,0,1,0|1,0,0]=3 1058 B15R2.29 Cc1ccc(Nc2ccccn2)cc1 Amb24335974 [0,1,0,0,1,0|2,0,0]=4 1059 B15R2.29 Cc1ccc(Nc2cccnc2)cc1 Amb27956988 [0,1,0,0,1,0|0,0,0]=2 1060 B15R2.29 Cc1ccc(Nc2ccncc2)cc1 Amb26856006 [0,1,0,0,1,0|2,0,0]=4 1061 B15R2.29 Cc1ccc(Nc2cnccn2)cc1 Amb24356748 [0,1,0,0,1,0|1,0,0]=3 1062 B15R2.29 Cc1ccc(Oc2ccccc2)cc1 Amb17689430 [0,1,0,0,1,0|2,0,0]=4 1063 B15R2.29 Cc1ccc(Sc2ccccc2)cc1 Amb4010046 [0,1,0,0,1,0|2,0,0]=4 1064 B15R2.29 Cc1cnc(Oc2ccccc2)cn1 Amb28205333 [0,1,0,0,1,0|2,0,0]=4 1065 B15R2.29 Cc1ncc(Oc2ccccc2)cn1 Amb23412476 [0,1,0,0,1,0|2,0,0]=4 1066 B15R2.29 Clc1ccc(C[n+]2ccccc2)cc1 Amb10554478 [0,1,0,0,1,0|2,0,0]=4 1067 B15R2.29 Clc1ccc(Cc2ccccc2)cc1 Amb2685895 [0,1,0,0,1,0|1,0,0]=3 1068 B15R2.29 Clc1ccc(Cc2ccccc2)cn1 Amb21927408 [0,1,0,0,1,0|0,0,0]=2 1069 B15R2.29 Clc1ccc(Cc2ccccc2)nn1 Amb2427199 [0,1,0,0,1,0|1,0,0]=3 1070 B15R2.29 Clc1ccc(Cc2ccccn2)cc1 Amb4018998 [0,1,0,0,1,0|2,0,0]=4 1071 B15R2.29 Clc1ccc(Cc2ccncc2)cc1 Amb4018997 [0,1,0,0,1,0|2,0,0]=4 1072 B15R2.29 Clc1ccc(Nc2ccccc2)cc1 Amb3583470 [0,1,0,0,1,0|1,0,0]=3 1073 B15R2.29 Clc1ccc(Nc2ccccc2)nn1 Amb681885 [0,1,0,0,1,0|1,0,0]=3 1074 B15R2.29 Clc1ccc(Nc2ccccn2)cc1 Amb4465817 [0,1,0,0,1,0|2,0,0]=4 1075 B15R2.29 Clc1ccc(Nc2ccccn2)nn1 Amb25906364 [0,1,0,0,1,0|2,0,0]=4 1076 B15R2.29 Clc1ccc(Nc2cccnc2)cc1 Amb18932003 [0,1,0,0,1,0|0,0,0]=2 1077 B15R2.29 Clc1ccc(Nc2ccncc2)cc1 Amb18269087 [0,1,0,0,1,0|2,0,0]=4 1078 B15R2.29 Clc1ccc(Nc2cncnc2)cc1 Amb18268650 [0,1,0,0,1,0|1,0,0]=3 1079 B15R2.29 Clc1ccc(Oc2ccccc2)cc1 Amb2685893 [0,1,0,0,1,0|2,0,0]=4 1080 B15R2.29 Clc1ccc(Oc2ccccc2)cn1 Amb27452497 [0,1,0,0,1,0|1,0,0]=3 1081 B15R2.29 Clc1ccc(Oc2ccccc2)nn1 Amb4397987 [0,1,0,0,1,0|2,0,0]=4 1082 B15R2.29 Clc1ccc(Sc2ccccc2)cc1 Amb20242737 [0,1,0,0,1,0|2,0,0]=4 1083 B15R2.29 Clc1ccc(Sc2ccccc2)nn1 Amb8873146 [0,1,0,0,1,0|2,0,0]=4 1084 B15R2.29 Clc1ccc([SiH2]c2ccccc2)cc1 Amb4008789 [0,1,0,0,1,0|1,1,0]=4 1085 B15R2.29 Clc1cnc(Cc2ccccc2)cn1 Amb32698808 [0,1,0,0,1,0|1,0,0]=3 1086 B15R2.29 Clc1cnc(Cc2cccnc2)cn1 Amb28142106 [0,1,0,0,1,0|2,0,0]=4 1087 B15R2.29 Clc1cnc(Cc2ccncc2)cn1 Amb27488834 [0,1,0,0,1,0|2,0,0]=4 1088 B15R2.29 Clc1cnc(Nc2ccccc2)cn1 Amb27205258 [0,1,0,0,1,0|1,0,0]=3 1089 B15R2.29 Clc1ncc(Cc2ccccc2)cn1 Amb25669105 [0,1,0,0,1,0|1,0,0]=3 1090 B15R2.29 Clc1ncc(Oc2ccccc2)cn1 Amb22489990 [0,1,0,0,1,0|2,0,0]=4 1091 B15R2.29 Fc1ccc(Cc2ccccc2)cc1 Amb2688097 [0,1,0,0,1,0|1,0,0]=3 1092 B15R2.29 Fc1ccc(Cc2ccccc2)nc1 Amb24517032 [0,1,0,0,1,0|2,0,0]=4 1093 B15R2.29 Fc1ccc(Nc2ccccc2)cc1 Amb10576197 [0,1,0,0,1,0|1,0,0]=3 1094 B15R2.29 Fc1ccc(Nc2ccccn2)cc1 Amb4014342 [0,1,0,0,1,0|2,0,0]=4 1095 B15R2.29 Fc1ccc(Nc2ccncc2)cc1 Amb18269110 [0,1,0,0,1,0|2,0,0]=4 1096 B15R2.29 Fc1ccc(Nc2cnccn2)cc1 Amb33619277 [0,1,0,0,1,0|1,0,0]=3 1097 B15R2.29 Fc1ccc(Nc2cncnc2)cc1 Amb18268882 [0,1,0,0,1,0|1,0,0]=3 1098 B15R2.29 Fc1ccc(Oc2ccccc2)cc1 Amb2688095 [0,1,0,0,1,0|2,0,0]=4 1099 B15R2.29 Fc1ccc(Oc2ccccc2)cn1 Amb33330901 [0,1,0,0,1,0|1,0,0]=3 1100 B15R2.29 Fc1ccc(Oc2cccnc2)cc1 Amb28409887 [0,1,0,0,1,0|1,0,0]=3 1101 B15R2.29 Fc1cnc(Nc2ccccc2)cn1 Amb32938515 [0,1,0,0,1,0|1,0,0]=3 1102 B15R2.29 Ic1ccc(Cc2ccncc2)cc1 Amb27845577 [0,1,0,0,1,0|2,0,0]=4 1103 B15R2.29 Ic1ccc(Nc2ccccc2)cc1 Amb4017462 [0,1,0,0,1,0|1,0,0]=3 1104 B15R2.29 Ic1ccc(Nc2ccccc2)nc1 Amb23556454 [0,1,0,0,1,0|2,0,0]=4 1105 B15R2.29 Ic1ccc(Oc2ccccc2)cc1 Amb2688846 [0,1,0,0,1,0|2,0,0]=4 1106 B15R2.29 Ic1ccc(Sc2ccccc2)cc1 Amb27494645 [0,1,0,0,1,0|2,0,0]=4 1107 B15R2.29 Ic1cnc(Nc2cccnc2)nc1 Amb28072469 [0,1,0,0,1,0|2,0,0]=4 1108 B15R2.29 N=C1C=CN(Cc2ccccc2)C=C1 Amb21950201 [0,1,0,0,1,0|2,0,0]=4 1109 B15R2.29 Nc1ccc(C[n+]2ccccc2)cc1 Amb31127654 [0,1,0,0,1,0|2,0,0]=4 1110 B15R2.29 Nc1ccc(Cc2ccccc2)cc1 Amb19960014 [0,1,0,0,1,0|1,0,0]=3 1111 B15R2.29 Nc1ccc(Cc2ccccc2)cc1 Amb2684621 [0,1,0,0,1,0|1,0,0]=3 1112 B15R2.29 Nc1ccc(Cc2ccccc2)cn1 Amb18648928 [0,1,0,0,1,0|0,0,0]=2 1113 B15R2.29 Nc1ccc(Cc2ccccc2)nc1 Amb18191583 [0,1,0,0,1,0|2,0,0]=4 1114 B15R2.29 Nc1ccc(Cc2ccccc2)nn1 Amb18822485 [0,1,0,0,1,0|1,0,0]=3 1115 B15R2.29 Nc1ccc(Cc2ccccn2)cc1 Amb1071165 [0,1,0,0,1,0|2,0,0]=4 1116 B15R2.29 Nc1ccc(Cc2ccccn2)cc1 Amb2100015 [0,1,0,0,1,0|2,0,0]=4 1117 B15R2.29 Nc1ccc(Cc2cccnc2)cn1 Amb28322329 [0,1,0,0,1,0|1,0,0]=3 1118 B15R2.29 Nc1ccc(Cc2ccncc2)cc1 Amb6333057 [0,1,0,0,1,0|2,0,0]=4 1119 B15R2.29 Nc1ccc(Cc2nccnn2)cc1 Amb18863176 [0,1,0,0,1,0|2,0,0]=4 1120 B15R2.29 Nc1ccc(Nc2ccccc2)cc1 Amb2720052 [0,1,0,0,1,0|1,0,0]=3 1121 B15R2.29 Nc1ccc(Nc2ccccc2)cc1 Amb836911 [0,1,0,0,1,0|1,0,0]=3 1122 B15R2.29 Nc1ccc(Nc2ccccc2)cn1 Amb32666575 [0,1,0,0,1,0|0,0,0]=2 1123 B15R2.29 Nc1ccc(Nc2ccccc2)cn1 Amb7802315 [0,1,0,0,1,0|0,0,0]=2 1124 B15R2.29 Nc1ccc(Nc2ccccc2)nc1 Amb1112205 [0,1,0,0,1,0|2,0,0]=4 1125 B15R2.29 Nc1ccc(Nc2ccccc2)nc1 Amb24081335 [0,1,0,0,1,0|2,0,0]=4 1126 B15R2.29 Nc1ccc(Nc2ccccc2)nn1 Amb24553859 [0,1,0,0,1,0|1,0,0]=3 1127 B15R2.29 Nc1ccc(Nc2ccccn2)cc1 Amb32882483 [0,1,0,0,1,0|2,0,0]=4 1128 B15R2.29 Nc1ccc(Nc2ccccn2)cc1 Amb6260377 [0,1,0,0,1,0|2,0,0]=4 1129 B15R2.29 Nc1ccc(Nc2cccnn2)cc1 Amb18961841 [0,1,0,0,1,0|1,0,0]=3 1130 B15R2.29 Nc1ccc(Nc2ccncc2)cc1 Amb32664447 [0,1,0,0,1,0|2,0,0]=4 1131 B15R2.29 Nc1ccc(Nc2ccncc2)cc1 Amb32664470 [0,1,0,0,1,0|2,0,0]=4 1132 B15R2.29 Nc1ccc(Nc2ccncc2)cc1 Amb33532825 [0,1,0,0,1,0|2,0,0]=4 1133 B15R2.29 Nc1ccc(Nc2cnccn2)cc1 Amb6268447 [0,1,0,0,1,0|1,0,0]=3 1134 B15R2.29 Nc1ccc(Oc2ccccc2)cc1 Amb1790314 [0,1,0,0,1,0|2,0,0]=4 1135 B15R2.29 Nc1ccc(Oc2ccccc2)cn1 Amb6679874 [0,1,0,0,1,0|1,0,0]=3 1136 B15R2.29 Nc1ccc(Oc2cccnc2)cc1 Amb1098994 [0,1,0,0,1,0|1,0,0]=3 1137 B15R2.29 Nc1ccc(Oc2cccnc2)nc1 Amb2730204 [0,1,0,0,1,0|2,0,0]=4 1138 B15R2.29 Nc1ccc(Oc2cccnc2)nc1 Amb32693407 [0,1,0,0,1,0|2,0,0]=4 1139 B15R2.29 Nc1ccc(Oc2cccnn2)cc1 Amb18962473 [0,1,0,0,1,0|2,0,0]=4 1140 B15R2.29 Nc1ccc(Oc2cnccn2)cc1 Amb33536540 [0,1,0,0,1,0|2,0,0]=4 1141 B15R2.29 Nc1ccc(Oc2cncnc2)cc1 Amb19882230 [0,1,0,0,1,0|2,0,0]=4 1142 B15R2.29 Nc1ccc(Sc2ccccc2)cc1 Amb6358058 [0,1,0,0,1,0|2,0,0]=4 1143 B15R2.29 Nc1ccc(Sc2cccnc2)cc1 Amb27622183 [0,1,0,0,1,0|1,0,0]=3 1144 B15R2.29 Nc1ccc(Sc2ccncc2)cn1 Amb27182426 [0,1,0,0,1,0|2,0,0]=4 1145 B15R2.29 Nc1ccc(Sc2cncnc2)cc1 Amb19882234 [0,1,0,0,1,0|2,0,0]=4 1146 B15R2.29 Nc1ccc([SH2]c2ccccc2)cc1 Amb18540788 [0,1,0,0,1,0|2,0,0]=4 1147 B15R2.29 Nc1cnc(Cc2ccccn2)cn1 Amb27389967 [0,1,0,0,1,0|2,0,0]=4 1148 B15R2.29 Nc1cnc(Nc2ccccc2)cn1 Amb27612458 [0,1,0,0,1,0|1,0,0]=3 1149 B15R2.29 Nc1cnc(Oc2ccccc2)cn1 Amb24412467 [0,1,0,0,1,0|2,0,0]=4 1150 B15R2.29 Nc1cnc(Sc2ccccc2)cn1 Amb28184589 [0,1,0,0,1,0|2,0,0]=4 1151 B15R2.29 Nc1ncc(Cc2ccccn2)cn1 Amb26499249 [0,1,0,0,1,0|2,0,0]=4 1152 B15R2.29 Nc1ncc(Oc2ccccc2)cn1 Amb23590956 [0,1,0,0,1,0|2,0,0]=4 1153 B15R2.29 O=C1C=CC(Cc2ccccc2)=CO1 Amb27755369 [0,1,0,0,1,0|1,0,0]=3 1154 B15R2.29 O=C1C=CN(Cc2ccccc2)C=C1 Amb27860209 [0,1,0,0,1,0|2,0,0]=4 1155 B15R2.29 O=C1C=CN(Cc2cnccn2)C=C1 Amb30007790 [0,1,0,0,1,0|2,0,0]=4 1156 B15R2.29 O=C1N=CC(Oc2ccccc2)=CN1 Amb25857088 [0,1,0,0,1,0|2,0,0]=4 1157 B15R2.29 Oc1ccc(Cc2ccccc2)cc1 Amb2041131 [0,1,0,0,1,0|1,0,0]=3 1158 B15R2.29 Oc1ccc(Cc2ccccc2)nc1 Amb18649107 [0,1,0,0,1,0|2,0,0]=4 1159 B15R2.29 Oc1ccc(Cc2ccccn2)cc1 Amb18649106 [0,1,0,0,1,0|2,0,0]=4 1160 B15R2.29 Oc1ccc(Cc2cccnc2)cc1 Amb25320180 [0,1,0,0,1,0|0,0,0]=2 1161 B15R2.29 Oc1ccc(Cc2ccncc2)cc1 Amb4362720 [0,1,0,0,1,0|2,0,0]=4 1162 B15R2.29 Oc1ccc(Nc2ccccc2)cc1 Amb1332212 [0,1,0,0,1,0|1,0,0]=3 1163 B15R2.29 Oc1ccc(Nc2cccnc2)cc1 Amb18931861 [0,1,0,0,1,0|0,0,0]=2 1164 B15R2.29 Oc1ccc(Nc2ccncc2)cc1 Amb17594816 [0,1,0,0,1,0|2,0,0]=4 1165 B15R2.29 Oc1ccc(Oc2ccccc2)cc1 Amb2609982 [0,1,0,0,1,0|2,0,0]=4 1166 B15R2.29 Oc1ccc(Oc2cccnc2)cc1 Amb27612561 [0,1,0,0,1,0|1,0,0]=3 1167 B15R2.29 Oc1ccc(Sc2ccccc2)cc1 Amb24079606 [0,1,0,0,1,0|2,0,0]=4 1168 B15R2.29 Oc1cnc(Cc2ccccc2)cn1 Amb32698828 [0,1,0,0,1,0|1,0,0]=3 1169 B15R2.29 S=C1C=CN(Cc2ccccc2)C=C1 Amb27189988 [0,1,0,0,1,0|2,0,0]=4 1170 B15R2.29 S=C1C=NC(Cc2cccnc2)=CN1 Amb27411031 [0,1,0,0,1,0|2,0,0]=4 1171 B15R2.29 Sc1ccc(Cc2ccccc2)cc1 Amb27483640 [0,1,0,0,1,0|1,0,0]=3 1172 B15R2.29 Sc1ccc(Oc2ccccc2)cc1 Amb2690257 [0,1,0,0,1,0|2,0,0]=4 1173 B15R2.29 Sc1ncc(Oc2ccccc2)cn1 Amb33328445 [0,1,0,0,1,0|2,0,0]=4 1174 B15R2.31 Brc1cc(Cc2ccccc2)ccn1 Amb28200138 [0,1,0,0,1,0|2,0,0]=4 1175 B15R2.31 Brc1cc(Nc2ccccc2)ccn1 Amb28437239 [0,1,0,0,1,0|2,0,0]=4 1176 B15R2.31 Brc1cc(Nc2cccnc2)ccn1 Amb27412025 [0,1,0,0,1,0|1,0,0]=3 1177 B15R2.31 Brc1ccc[n+](Cc2ccccc2)c1 Amb13887014 [0,1,0,0,1,0|2,0,0]=4 1178 B15R2.31 Brc1cccc(Cc2ccccc2)c1 Amb22234434 [0,1,0,0,1,0|1,0,0]=3 1179 B15R2.31 Brc1cccc(Cc2ccccc2)n1 Amb26068735 [0,1,0,0,1,0|2,0,0]=4 1180 B15R2.31 Brc1cccc(Cc2nccnn2)c1 Amb18876320 [0,1,0,0,1,0|2,0,0]=4 1181 B15R2.31 Brc1cccc(Nc2ccccc2)c1 Amb33548822 [0,1,0,0,1,0|1,0,0]=3 1182 B15R2.31 Brc1cccc(Oc2ccccc2)c1 Amb2227541 [0,1,0,0,1,0|2,0,0]=4 1183 B15R2.31 Brc1cccc(Oc2cnccn2)c1 Amb32686933 [0,1,0,0,1,0|2,0,0]=4 1184 B15R2.31 Brc1cccc(Sc2ccccc2)c1 Amb27267295 [0,1,0,0,1,0|2,0,0]=4 1185 B15R2.31 Brc1ccnc(Nc2cnccn2)c1 Amb28994603 [0,1,0,0,1,0|2,0,0]=4 1186 B15R2.31 Brc1cncc(Cc2ccccc2)c1 Amb25104327 [0,1,0,0,1,0|0,0,0]=2 1187 B15R2.31 Brc1cncc(Nc2ccccc2)c1 Amb28323079 [0,1,0,0,1,0|0,0,0]=2 1188 B15R2.31 Brc1cncc(Oc2ccccc2)c1 Amb20241431 [0,1,0,0,1,0|1,0,0]=3 1189 B15R2.31 Brc1cncc(Oc2cccnc2)c1 Amb27593284 [0,1,0,0,1,0|2,0,0]=4 1190 B15R2.31 Brc1cncc(Sc2ccccc2)c1 Amb27945853 [0,1,0,0,1,0|1,0,0]=3 1191 B15R2.31 Cc1cc(Nc2ccccc2)ccn1 Amb28202611 [0,1,0,0,1,0|2,0,0]=4 1192 B15R2.31 Cc1ccc[n+](Cc2ccccc2)c1 Amb6337489 [0,1,0,0,1,0|2,0,0]=4 1193 B15R2.31 Cc1cccc(Cc2ccccc2)c1 Amb22641538 [0,1,0,0,1,0|1,0,0]=3 1194 B15R2.31 Cc1cccc(Nc2ccccc2)c1 Amb1649099 [0,1,0,0,1,0|1,0,0]=3 1195 B15R2.31 Cc1cccc(Nc2ccncc2)c1 Amb27182459 [0,1,0,0,1,0|2,0,0]=4 1196 B15R2.31 Cc1cccc(Nc2nccnn2)c1 Amb27864081 [0,1,0,0,1,0|2,0,0]=4 1197 B15R2.31 Cc1cccc(Oc2ccccc2)c1 Amb4037036 [0,1,0,0,1,0|2,0,0]=4 1198 B15R2.31 Cc1cncc(Nc2ccccc2)n1 Amb28123169 [0,1,0,0,1,0|1,0,0]=3 1199 B15R2.31 Cc1cncc(Nc2ccccn2)n1 Amb33618072 [0,1,0,0,1,0|2,0,0]=4 1200 B15R2.31 Cc1cncc(Nc2ccncc2)n1 Amb31202539 [0,1,0,0,1,0|2,0,0]=4 1201 B15R2.31 Cc1cncc(Oc2ccccc2)c1 Amb28192451 [0,1,0,0,1,0|1,0,0]=3 1202 B15R2.31 Clc1cc(Cc2ccccc2)ccn1 Amb27865747 [0,1,0,0,1,0|2,0,0]=4 1203 B15R2.31 Clc1cc(Nc2cccnc2)ncn1 Amb8496630 [0,1,0,0,1,0|2,0,0]=4 1204 B15R2.31 Clc1cccc(C[n+]2ccccc2)c1 Amb24309099 [0,1,0,0,1,0|2,0,0]=4 1205 B15R2.31 Clc1cccc(Cc2ccccc2)n1 Amb2424371 [0,1,0,0,1,0|2,0,0]=4 1206 B15R2.31 Clc1cccc(Nc2ccccc2)c1 Amb4065351 [0,1,0,0,1,0|1,0,0]=3 1207 B15R2.31 Clc1cccc(Nc2ccccc2)n1 Amb21958898 [0,1,0,0,1,0|2,0,0]=4 1208 B15R2.31 Clc1cccc(Nc2ccccn2)c1 Amb18269162 [0,1,0,0,1,0|2,0,0]=4 1209 B15R2.31 Clc1cccc(Nc2cccnc2)n1 Amb25805286 [0,1,0,0,1,0|1,0,0]=3 1210 B15R2.31 Clc1cccc(Nc2ccncc2)c1 Amb18269100 [0,1,0,0,1,0|2,0,0]=4 1211 B15R2.31 Clc1cccc(Nc2cnccn2)c1 Amb27387863 [0,1,0,0,1,0|1,0,0]=3 1212 B15R2.31 Clc1cccc(Oc2ccccc2)c1 Amb25181727 [0,1,0,0,1,0|2,0,0]=4 1213 B15R2.31 Clc1cccc(Sc2ccccc2)c1 Amb10555878 [0,1,0,0,1,0|2,0,0]=4 1214 B15R2.31 Clc1cncc(Cc2ccccc2)n1 Amb27791027 [0,1,0,0,1,0|1,0,0]=3 1215 B15R2.31 Clc1cncc(Nc2ccccc2)n1 Amb21958895 [0,1,0,0,1,0|1,0,0]=3 1216 B15R2.31 Clc1cncc(Nc2cccnc2)n1 Amb28128749 [0,1,0,0,1,0|2,0,0]=4 1217 B15R2.31 Clc1cncc(Oc2ccccc2)c1 Amb27589761 [0,1,0,0,1,0|1,0,0]=3 1218 B15R2.31 Clc1cncc(Oc2ccccc2)n1 Amb4325648 [0,1,0,0,1,0|2,0,0]=4 1219 B15R2.31 Fc1cc(Nc2cccnc2)ccn1 Amb28251070 [0,1,0,0,1,0|1,0,0]=3 1220 B15R2.31 Fc1cccc(Cc2ccccc2)c1 Amb26444152 [0,1,0,0,1,0|1,0,0]=3 1221 B15R2.31 Fc1cccc(Cc2cccnc2)c1 Amb28409962 [0,1,0,0,1,0|0,0,0]=2 1222 B15R2.31 Fc1cccc(Nc2ccccc2)c1 Amb10839326 [0,1,0,0,1,0|1,0,0]=3 1223 B15R2.31 Fc1cccc(Nc2ccccn2)c1 Amb18269167 [0,1,0,0,1,0|2,0,0]=4 1224 B15R2.31 Fc1cccc(Nc2cccnc2)c1 Amb18269150 [0,1,0,0,1,0|0,0,0]=2 1225 B15R2.31 Fc1cccc(Nc2ccncc2)c1 Amb18931987 [0,1,0,0,1,0|2,0,0]=4 1226 B15R2.31 Fc1cccc(Nc2cncnc2)c1 Amb18268248 [0,1,0,0,1,0|1,0,0]=3 1227 B15R2.31 Fc1cccc(Oc2ccccc2)c1 Amb21856676 [0,1,0,0,1,0|2,0,0]=4 1228 B15R2.31 Fc1cccc(Sc2ccccc2)c1 Amb27181992 [0,1,0,0,1,0|2,0,0]=4 1229 B15R2.31 Fc1ccnc(Cc2cccnc2)n1 Amb30030610 [0,1,0,0,1,0|2,0,0]=4 1230 B15R2.31 Fc1cncc(Nc2ccccc2)n1 Amb35693512 [0,1,0,0,1,0|1,0,0]=3 1231 B15R2.31 Fc1cncc(Oc2ccccc2)n1 Amb35700009 [0,1,0,0,1,0|2,0,0]=4 1232 B15R2.31 Fc1cncc(Sc2ccccc2)n1 Amb35712117 [0,1,0,0,1,0|2,0,0]=4 1233 B15R2.31 Ic1cccc(Cc2ccccc2)c1 Amb35751028 [0,1,0,0,1,0|1,0,0]=3 1234 B15R2.31 Ic1cccc(Oc2ccccc2)c1 Amb28139096 [0,1,0,0,1,0|2,0,0]=4 1235 B15R2.31 Nc1cc(Cc2ccccc2)ccn1 Amb18191588 [0,1,0,0,1,0|2,0,0]=4 1236 B15R2.31 Nc1cc(Cc2cnccn2)ccn1 Amb27436765 [0,1,0,0,1,0|2,0,0]=4 1237 B15R2.31 Nc1cc(Nc2ccccc2)ccn1 Amb1052798 [0,1,0,0,1,0|2,0,0]=4 1238 B15R2.31 Nc1cc(Nc2ccccc2)ccn1 Amb19960007 [0,1,0,0,1,0|2,0,0]=4 1239 B15R2.31 Nc1cccc(C[n+]2ccccc2)c1 Amb31127659 [0,1,0,0,1,0|2,0,0]=4 1240 B15R2.31 Nc1cccc(Cc2ccccc2)c1 Amb2684620 [0,1,0,0,1,0|1,0,0]=3 1241 B15R2.31 Nc1cccc(Cc2ccccc2)c1 Amb33999408 [0,1,0,0,1,0|1,0,0]=3 1242 B15R2.31 Nc1cccc(Cc2ccccc2)n1 Amb8630259 [0,1,0,0,1,0|2,0,0]=4 1243 B15R2.31 Nc1cccc(Cc2nccnn2)c1 Amb18863174 [0,1,0,0,1,0|2,0,0]=4 1244 B15R2.31 Nc1cccc(Nc2ccccc2)c1 Amb1033077 [0,1,0,0,1,0|1,0,0]=3 1245 B15R2.31 Nc1cccc(Nc2ccccc2)c1 Amb19478 [0,1,0,0,1,0|1,0,0]=3 1246 B15R2.31 Nc1cccc(Nc2ccccc2)n1 Amb26856622 [0,1,0,0,1,0|2,0,0]=4 1247 B15R2.31 Nc1cccc(Nc2ccccn2)c1 Amb6263319 [0,1,0,0,1,0|2,0,0]=4 1248 B15R2.31 Nc1cccc(Nc2cccnc2)c1 Amb25053851 [0,1,0,0,1,0|0,0,0]=2 1249 B15R2.31 Nc1cccc(Nc2ccncc2)c1 Amb10609511 [0,1,0,0,1,0|2,0,0]=4 1250 B15R2.31 Nc1cccc(Nc2ccncc2)c1 Amb6264530 [0,1,0,0,1,0|2,0,0]=4 1251 B15R2.31 Nc1cccc(Nc2cncnc2)n1 Amb27603660 [0,1,0,0,1,0|2,0,0]=4 1252 B15R2.31 Nc1cccc(Oc2ccccc2)c1 Amb3940158 [0,1,0,0,1,0|2,0,0]=4 1253 B15R2.31 Nc1cccc(Oc2cccnc2)c1 Amb23597483 [0,1,0,0,1,0|1,0,0]=3 1254 B15R2.31 Nc1cccc(Oc2cccnn2)c1 Amb18286297 [0,1,0,0,1,0|2,0,0]=4 1255 B15R2.31 Nc1cccc(Oc2cccnn2)c1 Amb19375347 [0,1,0,0,1,0|2,0,0]=4 1256 B15R2.31 Nc1cccc(Oc2cnccn2)c1 Amb33526862 [0,1,0,0,1,0|2,0,0]=4 1257 B15R2.31 Nc1cccc(Oc2cncnc2)c1 Amb19882235 [0,1,0,0,1,0|2,0,0]=4 1258 B15R2.31 Nc1cccc(Pc2ccccc2)c1 Amb28190640 [0,1,0,0,1,0|1,1,0]=4 1259 B15R2.31 Nc1cccc(Sc2ccccc2)c1 Amb13953200 [0,1,0,0,1,0|2,0,0]=4 1260 B15R2.31 Nc1cccc(Sc2ccccc2)c1 Amb32667321 [0,1,0,0,1,0|2,0,0]=4 1261 B15R2.31 Nc1cccc(Sc2cccnn2)c1 Amb28396757 [0,1,0,0,1,0|2,0,0]=4 1262 B15R2.31 Nc1cccc(Sc2cnccn2)c1 Amb27753815 [0,1,0,0,1,0|2,0,0]=4 1263 B15R2.31 Nc1cccc(Sc2cncnc2)c1 Amb19882236 [0,1,0,0,1,0|2,0,0]=4 1264 B15R2.31 Nc1ccnc(Cc2cccnc2)n1 Amb18962278 [0,1,0,0,1,0|2,0,0]=4 1265 B15R2.31 Nc1ccnc(Nc2ccccc2)c1 Amb17335751 [0,1,0,0,1,0|2,0,0]=4 1266 B15R2.31 Nc1ccnc(Oc2cccnc2)c1 Amb18956433 [0,1,0,0,1,0|2,0,0]=4 1267 B15R2.31 Nc1cncc(Cc2ccccc2)c1 Amb18191581 [0,1,0,0,1,0|0,0,0]=2 1268 B15R2.31 Nc1cncc(Nc2ccccc2)n1 Amb27668410 [0,1,0,0,1,0|1,0,0]=3 1269 B15R2.31 Nc1cncc(Oc2ccccc2)c1 Amb27425484 [0,1,0,0,1,0|1,0,0]=3 1270 B15R2.31 Nc1cncc(Oc2ccccc2)n1 Amb28346699 [0,1,0,0,1,0|2,0,0]=4 1271 B15R2.31 Nc1cncc(Oc2cccnc2)c1 Amb27606601 [0,1,0,0,1,0|2,0,0]=4 1272 B15R2.31 O=C1C=C(Cc2ccccc2)C=CN1 Amb26560310 [0,1,0,0,1,0|2,0,0]=4 1273 B15R2.31 O=C1C=C(Nc2ccccc2)C=CN1 Amb20417741 [0,1,0,0,1,0|2,0,0]=4 1274 B15R2.31 O=C1C=CC=C(Nc2ccccc2)N1 Amb28364951 [0,1,0,0,1,0|2,0,0]=4 1275 B15R2.31 O=C1C=NC=C(Cc2cccnc2)N1 Amb28348144 [0,1,0,0,1,0|2,0,0]=4 1276 B15R2.31 O=C1C=NN=C(Nc2ccccc2)N1 Amb18525635 [0,1,0,0,1,0|2,0,0]=4 1277 B15R2.31 O=C1N=C(Nc2ccccc2)C=NN1 Amb18001706 [0,1,0,0,1,0|2,0,0]=4 1278 B15R2.31 Oc1ccc[n+](Cc2ccccc2)c1 Amb9809789 [0,1,0,0,1,0|2,0,0]=4 1279 B15R2.31 Oc1cccc(Cc2ccccc2)c1 Amb10602238 [0,1,0,0,1,0|1,0,0]=3 1280 B15R2.31 Oc1cccc(Cc2ccccc2)n1 Amb4450119 [0,1,0,0,1,0|2,0,0]=4 1281 B15R2.31 Oc1cccc(Nc2ccccc2)c1 Amb3940309 [0,1,0,0,1,0|1,0,0]=3 1282 B15R2.31 Oc1cccc(Nc2ccccn2)c1 Amb18931893 [0,1,0,0,1,0|2,0,0]=4 1283 B15R2.31 Oc1cccc(Nc2cccnc2)c1 Amb18268941 [0,1,0,0,1,0|0,0,0]=2 1284 B15R2.31 Oc1cccc(Nc2ccncc2)c1 Amb18931901 [0,1,0,0,1,0|2,0,0]=4 1285 B15R2.31 Oc1cccc(Oc2ccccc2)c1 Amb1154174 [0,1,0,0,1,0|2,0,0]=4 1286 B15R2.31 Oc1cccc(Oc2cccnc2)c1 Amb25782172 [0,1,0,0,1,0|1,0,0]=3 1287 B15R2.31 Oc1cccc(Oc2cccnn2)c1 Amb19077108 [0,1,0,0,1,0|2,0,0]=4 1288 B15R2.31 Oc1cccc(Oc2cnccn2)c1 Amb19059649 [0,1,0,0,1,0|2,0,0]=4 1289 B15R2.31 Oc1cccc(Sc2ccccc2)c1 Amb26554645 [0,1,0,0,1,0|2,0,0]=4 1290 B15R2.31 Oc1cccc(Sc2cnccn2)c1 Amb27399222 [0,1,0,0,1,0|2,0,0]=4 1291 B15R2.31 Oc1ccnc(Cc2cccnc2)c1 Amb27628895 [0,1,0,0,1,0|1,0,0]=3 1292 B15R2.31 Oc1cncc(Cc2ccccc2)c1 Amb4466318 [0,1,0,0,1,0|0,0,0]=2 1293 B15R2.31 Oc1cncc(Cc2ccccn2)c1 Amb27196556 [0,1,0,0,1,0|1,0,0]=3 1294 B15R2.31 Oc1cncc(Cc2ccncc2)c1 Amb26964361 [0,1,0,0,1,0|1,0,0]=3 1295 B15R2.31 S=C1C=NC=C(Cc2cccnc2)N1 Amb28132131 [0,1,0,0,1,0|2,0,0]=4 1296 B15R2.31 S=C1N=C(Cc2cccnc2)C=CN1 Amb27854857 [0,1,0,0,1,0|2,0,0]=4 1297 B15R2.31 Sc1cccc(Oc2ccccc2)c1 Amb25970587 [0,1,0,0,1,0|2,0,0]=4 1298 B15R2.31 [O-][n+]1cccc(Oc2ccccc2)c1 Amb27241213 [0,1,0,0,1,0|1,0,1]=4 1299 B15R2.38 Brc1ccccc1Cc2ccccc2 Amb2685150 [0,1,0,0,1,0|1,0,0]=3 1300 B15R2.38 Brc1ccccc1Cc2nccnn2 Amb18876318 [0,1,0,0,1,0|2,0,0]=4 1301 B15R2.38 Brc1ccccc1Nc2ccccc2 Amb24104087 [0,1,0,0,1,0|1,0,0]=3 1302 B15R2.38 Brc1ccccc1Oc2ccccc2 Amb1818840 [0,1,0,0,1,0|2,0,0]=4 1303 B15R2.38 Brc1ccccc1Oc2cccnn2 Amb20668374 [0,1,0,0,1,0|2,0,0]=4 1304 B15R2.38 Brc1ccccc1Oc2cnccn2 Amb6268482 [0,1,0,0,1,0|2,0,0]=4 1305 B15R2.38 Brc1ccccc1Sc2ccccc2 Amb25047292 [0,1,0,0,1,0|2,0,0]=4 1306 B15R2.38 Brc1cccnc1Nc2ccccc2 Amb22058944 [0,1,0,0,1,0|2,0,0]=4 1307 B15R2.38 Brc1cnccc1Nc2cncnc2 Amb28191356 [0,1,0,0,1,0|2,0,0]=4 1308 B15R2.38 Brc1cnccc1Oc2cccnc2 Amb27596390 [0,1,0,0,1,0|2,0,0]=4 1309 B15R2.38 Brc1ncccc1Oc2ccccn2 Amb10601230 [0,1,0,0,1,0|2,0,0]=4 1310 B15R2.38 Brc1ncccc1Sc2ccccc2 Amb28191217 [0,1,0,0,1,0|1,0,0]=3 1311 B15R2.38 C=C1C=CC=CC1Nc2ccccc2 Amb27875096 [0,1,0,0,1,0|1,0,1]=4 1312 B15R2.38 C[n+]1ccccc1Cc2ccccc2 Amb4014180 [0,1,0,0,1,0|2,0,0]=4 1313 B15R2.38 Cc1cccc[n+]1Cc2ccccc2 Amb1147302 [0,1,0,0,1,0|2,0,0]=4 1314 B15R2.38 Cc1ccccc1Nc2ccccc2 Amb22228899 [0,1,0,0,1,0|1,0,0]=3 1315 B15R2.38 Cc1ccccc1Nc2ccccn2 Amb24444380 [0,1,0,0,1,0|2,0,0]=4 1316 B15R2.38 Cc1ccccc1Nc2cccnc2 Amb26658596 [0,1,0,0,1,0|0,0,0]=2 1317 B15R2.38 Cc1ccccc1Nc2cnccn2 Amb26601977 [0,1,0,0,1,0|1,0,0]=3 1318 B15R2.38 Cc1ccccc1Oc2cccnn2 Amb22461699 [0,1,0,0,1,0|2,0,0]=4 1319 B15R2.38 Cc1ccccc1[SiH2]c2ccccc2 Amb22366579 [0,1,0,0,1,0|1,1,0]=4 1320 B15R2.38 Cc1cccnc1Nc2ccccc2 Amb10573517 [0,1,0,0,1,0|2,0,0]=4 1321 B15R2.38 Cc1ccncc1Sc2ccccc2 Amb27986257 [0,1,0,0,1,0|1,0,0]=3 1322 B15R2.38 Cc1ncccc1Cc2ccccc2 Amb27749713 [0,1,0,0,1,0|0,0,0]=2 1323 B15R2.38 Cc1nccnc1Nc2ccccn2 Amb31202537 [0,1,0,0,1,0|2,0,0]=4 1324 B15R2.38 Clc1ccccc1Nc2ccccc2 Amb8392089 [0,1,0,0,1,0|1,0,0]=3 1325 B15R2.38 Clc1ccccc1Nc2ccccn2 Amb18269170 [0,1,0,0,1,0|2,0,0]=4 1326 B15R2.38 Clc1ccccc1Nc2cccnc2 Amb18269089 [0,1,0,0,1,0|0,0,0]=2 1327 B15R2.38 Clc1ccccc1Nc2ccncc2 Amb18269103 [0,1,0,0,1,0|2,0,0]=4 1328 B15R2.38 Clc1ccccc1Nc2cncnc2 Amb18931608 [0,1,0,0,1,0|1,0,0]=3 1329 B15R2.38 Clc1ccccc1Oc2ccccc2 Amb15692539 [0,1,0,0,1,0|2,0,0]=4 1330 B15R2.38 Clc1ccccc1Sc2ccccc2 Amb22451340 [0,1,0,0,1,0|2,0,0]=4 1331 B15R2.38 Clc1cccnc1Nc2ccccc2 Amb27592965 [0,1,0,0,1,0|2,0,0]=4 1332 B15R2.38 Clc1cccnc1Nc2cccnc2 Amb27827873 [0,1,0,0,1,0|1,0,0]=3 1333 B15R2.38 Clc1ccncc1Oc2ccccc2 Amb23412253 [0,1,0,0,1,0|1,0,0]=3 1334 B15R2.38 Clc1ncccc1Nc2ccccc2 Amb22750111 [0,1,0,0,1,0|0,0,0]=2 1335 B15R2.38 Clc1ncccc1Nc2cccnc2 Amb28384563 [0,1,0,0,1,0|1,0,0]=3 1336 B15R2.38 Clc1nccnc1Oc2ccccc2 Amb19747403 [0,1,0,0,1,0|2,0,0]=4 1337 B15R2.38 Clc1nccnc1Sc2ccccc2 Amb19747261 [0,1,0,0,1,0|2,0,0]=4 1338 B15R2.38 Clc1ncncc1Cc2ccccc2 Amb28125814 [0,1,0,0,1,0|1,0,0]=3 1339 B15R2.38 Clc1nnccc1Oc2ccccc2 Amb23402476 [0,1,0,0,1,0|2,0,0]=4 1340 B15R2.38 Fc1ccccc1Cc2ccccc2 Amb2688096 [0,1,0,0,1,0|1,0,0]=3 1341 B15R2.38 Fc1ccccc1Nc2ccccc2 Amb33544278 [0,1,0,0,1,0|1,0,0]=3 1342 B15R2.38 Fc1ccccc1Nc2ccccn2 Amb18932029 [0,1,0,0,1,0|2,0,0]=4 1343 B15R2.38 Fc1ccccc1Nc2cccnc2 Amb18269151 [0,1,0,0,1,0|0,0,0]=2 1344 B15R2.38 Fc1ccccc1Nc2ccncc2 Amb18269108 [0,1,0,0,1,0|2,0,0]=4 1345 B15R2.38 Fc1ccccc1Sc2ccccc2 Amb27951645 [0,1,0,0,1,0|2,0,0]=4 1346 B15R2.38 Fc1ncccc1Cc2ccccc2 Amb28369922 [0,1,0,0,1,0|0,0,0]=2 1347 B15R2.38 Fc1nccnc1Nc2ccccc2 Amb29866394 [0,1,0,0,1,0|1,0,0]=3 1348 B15R2.38 Fc1nccnc1Oc2ccccc2 Amb35729109 [0,1,0,0,1,0|2,0,0]=4 1349 B15R2.38 Fc1nccnc1Sc2ccccc2 Amb29850571 [0,1,0,0,1,0|2,0,0]=4 1350 B15R2.38 Ic1ccccc1Oc2ccccc2 Amb8392772 [0,1,0,0,1,0|2,0,0]=4 1351 B15R2.38 N=C1C=CC=CN1Cc2ccccc2 Amb19372454 [0,1,0,0,1,0|2,0,0]=4 1352 B15R2.38 Nc1ccccc1Cc2ccccc2 Amb1233198 [0,1,0,0,1,0|1,0,0]=3 1353 B15R2.38 Nc1ccccc1Cc2ccccn2 Amb18648930 [0,1,0,0,1,0|2,0,0]=4 1354 B15R2.38 Nc1ccccc1Cc2cccnc2 Amb18648933 [0,1,0,0,1,0|0,0,0]=2 1355 B15R2.38 Nc1ccccc1Cc2cccnc2 Amb32916287 [0,1,0,0,1,0|0,0,0]=2 1356 B15R2.38 Nc1ccccc1Cc2ccncc2 Amb18648931 [0,1,0,0,1,0|2,0,0]=4 1357 B15R2.38 Nc1ccccc1Cc2nccnn2 Amb18863172 [0,1,0,0,1,0|2,0,0]=4 1358 B15R2.38 Nc1ccccc1Nc2ccccc2 Amb6334845 [0,1,0,0,1,0|1,0,0]=3 1359 B15R2.38 Nc1ccccc1Nc2ccccc2 Amb6876351 [0,1,0,0,1,0|1,0,0]=3 1360 B15R2.38 Nc1ccccc1Nc2ccccn2 Amb2556136 [0,1,0,0,1,0|2,0,0]=4 1361 B15R2.38 Nc1ccccc1Nc2cccnc2 Amb25710815 [0,1,0,0,1,0|0,0,0]=2 1362 B15R2.38 Nc1ccccc1Nc2ccncc2 Amb17607878 [0,1,0,0,1,0|2,0,0]=4 1363 B15R2.38 Nc1ccccc1Oc2ccccc2 Amb1201281 [0,1,0,0,1,0|2,0,0]=4 1364 B15R2.38 Nc1ccccc1Oc2cccnc2 Amb2783831 [0,1,0,0,1,0|1,0,0]=3 1365 B15R2.38 Nc1ccccc1Oc2cnccn2 Amb1117669 [0,1,0,0,1,0|2,0,0]=4 1366 B15R2.38 Nc1ccccc1Sc2ccccc2 Amb5722135 [0,1,0,0,1,0|2,0,0]=4 1367 B15R2.38 Nc1ccccc1Sc2cccnc2 Amb27169483 [0,1,0,0,1,0|1,0,0]=3 1368 B15R2.38 Nc1ccccc1Sc2cnccn2 Amb2446191 [0,1,0,0,1,0|2,0,0]=4 1369 B15R2.38 Nc1ccccc1Sc2cncnc2 Amb19882238 [0,1,0,0,1,0|2,0,0]=4 1370 B15R2.38 Nc1ccccc1[SH2]c2ccccc2 Amb18540789 [0,1,0,0,1,0|2,0,0]=4 1371 B15R2.38 Nc1cccnc1Cc2cccnc2 Amb27433263 [0,1,0,0,1,0|1,0,0]=3 1372 B15R2.38 Nc1cccnc1Nc2ccccc2 Amb17772571 [0,1,0,0,1,0|2,0,0]=4 1373 B15R2.38 Nc1cccnc1Oc2cccnc2 Amb9211220 [0,1,0,0,1,0|2,0,0]=4 1374 B15R2.38 Nc1ccncc1Cc2ccccc2 Amb25671149 [0,1,0,0,1,0|0,0,0]=2 1375 B15R2.38 Nc1ccncc1Cc2cnccn2 Amb27630322 [0,1,0,0,1,0|2,0,0]=4 1376 B15R2.38 Nc1ccncc1Nc2ccccc2 Amb17933171 [0,1,0,0,1,0|0,0,0]=2 1377 B15R2.38 Nc1ccncc1Oc2ccccc2 Amb22886506 [0,1,0,0,1,0|1,0,0]=3 1378 B15R2.38 Nc1ccncc1Sc2ccncc2 Amb27968559 [0,1,0,0,1,0|2,0,0]=4 1379 B15R2.38 Nc1cnccc1Cc2ccccc2 Amb18191590 [0,1,0,0,1,0|2,0,0]=4 1380 B15R2.38 Nc1cnccc1Nc2ccccc2 Amb33532065 [0,1,0,0,1,0|2,0,0]=4 1381 B15R2.38 Nc1cnccc1Nc2cccnc2 Amb28070153 [0,1,0,0,1,0|1,0,0]=3 1382 B15R2.38 Nc1ncccc1Cc2ccncc2 Amb27487791 [0,1,0,0,1,0|1,0,0]=3 1383 B15R2.38 Nc1ncccc1Nc2ccccc2 Amb26576731 [0,1,0,0,1,0|0,0,0]=2 1384 B15R2.38 Nc1ncccc1Nc2ccccn2 Amb27387666 [0,1,0,0,1,0|1,0,0]=3 1385 B15R2.38 Nc1ncccc1Oc2ccccc2 Amb22886505 [0,1,0,0,1,0|1,0,0]=3 1386 B15R2.38 Nc1ncccc1Oc2ccccn2 Amb25995316 [0,1,0,0,1,0|2,0,0]=4 1387 B15R2.38 Nc1ncccc1Sc2ccccc2 Amb18654050 [0,1,0,0,1,0|1,0,0]=3 1388 B15R2.38 Nc1nnccc1Cc2ccccc2 Amb27748380 [0,1,0,0,1,0|1,0,0]=3 1389 B15R2.38 O=C1C=CC=CN1Cc2ccccc2 Amb21862599 [0,1,0,0,1,0|2,0,0]=4 1390 B15R2.38 O=C1C=CC=CN1Cc2cnccn2 Amb30036334 [0,1,0,0,1,0|2,0,0]=4 1391 B15R2.38 O=C1C=CC=NN1Cc2cccnc2 Amb31199895 [0,1,0,0,1,0|2,0,0]=4 1392 B15R2.38 O=C1C=CN=CN1Cc2ccccn2 Amb27183013 [0,1,0,0,1,0|2,0,0]=4 1393 B15R2.38 O=C1NC=NC=C1Cc2ccccc2 Amb26064275 [0,1,0,0,1,0|1,0,0]=3 1394 B15R2.38 O=C1NC=NC=C1Cc2cccnc2 Amb27465531 [0,1,0,0,1,0|2,0,0]=4 1395 B15R2.38 Oc1ccccc1Cc2ccccc2 Amb3939545 [0,1,0,0,1,0|1,0,0]=3 1396 B15R2.38 Oc1ccccc1Cc2ccncc2 Amb28347528 [0,1,0,0,1,0|2,0,0]=4 1397 B15R2.38 Oc1ccccc1Nc2ccncc2 Amb18931935 [0,1,0,0,1,0|2,0,0]=4 1398 B15R2.38 Oc1ccccc1Nc2cncnc2 Amb18269014 [0,1,0,0,1,0|1,0,0]=3 1399 B15R2.38 Oc1ccccc1Oc2ccccc2 Amb2416831 [0,1,0,0,1,0|2,0,0]=4 1400 B15R2.38 Oc1ccccc1Oc2cccnc2 Amb26425548 [0,1,0,0,1,0|1,0,0]=3 1401 B15R2.38 Oc1ccccc1Oc2cccnn2 Amb18329838 [0,1,0,0,1,0|2,0,0]=4 1402 B15R2.38 Oc1ccccc1Sc2ccccc2 Amb17595381 [0,1,0,0,1,0|2,0,0]=4 1403 B15R2.38 S=C1C=CC=CN1Cc2ccccc2 Amb27441713 [0,1,0,0,1,0|2,0,0]=4 1404 B15R2.38 S=C1NC=CN=C1Cc2cccnc2 Amb27828754 [0,1,0,0,1,0|2,0,0]=4 1405 B15R2.38 Sc1ccccc1Nc2ccccn2 Amb25797409 [0,1,0,0,1,0|2,0,0]=4 1406 B15R2.38 Sc1ccccc1Oc2ccccc2 Amb4012136 [0,1,0,0,1,0|2,0,0]=4 1407 B15R2.38 Sc1ncccc1Nc2ccccn2 Amb28388593 [0,1,0,0,1,0|1,0,0]=3 1408 B15R2.2226 BrC(c1ccccc1)c2ccccc2 Amb3939706 [0,1,0,0,1,0|1,0,0]=3 1409 B15R2.2226 BrC(c1ccccc1)c2ccccn2 Amb8835438 [0,1,0,0,1,0|2,0,0]=4 1410 B15R2.2226 BrP(c1ccccc1)c2ccccc2 Amb27597653 [0,1,0,0,1,0|1,1,0]=4 1411 B15R2.2226 C=C(c1ccccc1)c2ccccc2 Amb2583298 [0,1,0,0,1,0|1,0,1]=4 1412 B15R2.2226 C=C(c1cccnc1)c2cccnc2 Amb28191215 [0,1,0,0,1,0|1,0,1]=4 1413 B15R2.2226 C=S(c1ccccc1)c2ccccc2 Amb25858897 [0,1,0,0,1,0|2,0,0]=4 1414 B15R2.2226 CC(c1ccccc1)c2cccnc2 Amb27946077 [0,1,0,0,1,0|0,0,0]=2 1415 B15R2.2226 CC(c1ccccc1)c2ccncc2 Amb27189791 [0,1,0,0,1,0|2,0,0]=4 1416 B15R2.2226 CN(c1ccccc1)c2ccccc2 Amb2227586 [0,1,0,0,1,0|1,0,0]=3 1417 B15R2.2226 CN(c1ccccc1)c2ccncc2 Amb18452400 [0,1,0,0,1,0|2,0,0]=4 1418 B15R2.2226 CN(c1ccccc1)c2cncnc2 Amb17967661 [0,1,0,0,1,0|1,0,0]=3 1419 B15R2.2226 CP(c1ccccc1)c2ccccc2 Amb6365621 [0,1,0,0,1,0|1,1,0]=4 1420 B15R2.2226 C[S+](c1ccccc1)c2ccccc2 Amb6365953 [0,1,0,0,1,0|2,0,0]=4 1421 B15R2.2226 ClB(c1ccccc1)c2ccccc2 Amb27788360 [0,1,0,0,1,0|2,0,0]=4 1422 B15R2.2226 ClC(c1ccccc1)c2ccccc2 Amb2793025 [0,1,0,0,1,0|1,0,0]=3 1423 B15R2.2226 ClC(c1ccccc1)c2ccncc2 Amb9280624 [0,1,0,0,1,0|2,0,0]=4 1424 B15R2.2226 ClP(c1ccccc1)c2ccccc2 Amb6365767 [0,1,0,0,1,0|1,1,0]=4 1425 B15R2.2226 N=C(c1ccccc1)c2ccccc2 Amb22002426 [0,1,0,0,1,0|1,0,1]=4 1426 B15R2.2226 N=C(c1ccccc1)c2ccccc2 Amb6356324 [0,1,0,0,1,0|1,0,1]=4 1427 B15R2.2226 N=S(c1ccccc1)c2ccccc2 Amb3993376 [0,1,0,0,1,0|2,0,0]=4 1428 B15R2.2226 NC(c1ccccc1)c2ccccc2 Amb1195834 [0,1,0,0,1,0|1,0,0]=3 1429 B15R2.2226 NC(c1ccccc1)c2ccccc2 Amb534956 [0,1,0,0,1,0|1,0,0]=3 1430 B15R2.2226 NC(c1ccccc1)c2ccccn2 Amb2778511 [0,1,0,0,1,0|2,0,0]=4 1431 B15R2.2226 NC(c1ccccc1)c2ccccn2 Amb30449 [0,1,0,0,1,0|2,0,0]=4 1432 B15R2.2226 NC(c1ccccc1)c2ccccn2 Amb9703490 [0,1,0,0,1,0|2,0,0]=4 1433 B15R2.2226 NC(c1ccccc1)c2cccnc2 Amb9747746 [0,1,0,0,1,0|0,0,0]=2 1434 B15R2.2226 NC(c1ccccc1)c2ccncc2 Amb1107507 [0,1,0,0,1,0|2,0,0]=4 1435 B15R2.2226 NC(c1ccccc1)c2ccncc2 Amb6891902 [0,1,0,0,1,0|2,0,0]=4 1436 B15R2.2226 NC(c1ccccc1)c2cnccn2 Amb5752982 [0,1,0,0,1,0|1,0,0]=3 1437 B15R2.2226 NC(c1ccccc1)c2nccnn2 Amb18863182 [0,1,0,0,1,0|2,0,0]=4 1438 B15R2.2226 NC(c1ccccn1)c2cnccn2 Amb27167792 [0,1,0,0,1,0|2,0,0]=4 1439 B15R2.2226 NC(c1cccnc1)c2cccnc2 Amb17320322 [0,1,0,0,1,0|1,0,0]=3 1440 B15R2.2226 NC(c1cccnc1)c2cncnc2 Amb18286309 [0,1,0,0,1,0|2,0,0]=4 1441 B15R2.2226 NC(c1cccnc1)c2ncccn2 Amb18950473 [0,1,0,0,1,0|2,0,0]=4 1442 B15R2.2226 NC(c1ccncc1)c2cnccn2 Amb25842879 [0,1,0,0,1,0|2,0,0]=4 1443 B15R2.2226 NC(c1cncnc1)c2ccccn2 Amb18286327 [0,1,0,0,1,0|2,0,0]=4 1444 B15R2.2226 NN(c1ccccc1)c2ccccc2 Amb1154151 [0,1,0,0,1,0|1,0,0]=3 1445 B15R2.2226 NN(c1ccccc1)c2ccccc2 Amb534135 [0,1,0,0,1,0|1,0,0]=3 1446 B15R2.2226 N[C@H](c1ccccc1)c2cccnc2 Amb27265967 [0,1,0,0,1,0|0,0,0]=2 1447 B15R2.2226 N[NH+](c1ccccc1)c2ccccc2 Amb22269901 [0,1,0,0,1,0|1,0,1]=4 1448 B15R2.2226 O=C(c1ccccc1)c2ccccc2 Amb2793048 [0,1,0,0,1,0|1,0,1]=4 1449 B15R2.2226 O=C(c1ccccc1)c2cccnc2 Amb1694828 [0,1,0,0,1,0|0,0,1]=3 1450 B15R2.2226 O=C(c1ccccc1)c2cccnn2 Amb22754174 [0,1,0,0,1,0|1,0,1]=4 1451 B15R2.2226 O=C(c1ccccc1)c2cncnc2 Amb13891251 [0,1,0,0,1,0|1,0,1]=4 1452 B15R2.2226 O=C(c1cccnc1)c2ccccn2 Amb5638080 [0,1,0,0,1,0|1,0,1]=4 1453 B15R2.2226 O=C(c1cccnc1)c2cccnc2 Amb2616680 [0,1,0,0,1,0|1,0,1]=4 1454 B15R2.2226 O=C(c1ccncc1)c2cccnc2 Amb18322803 [0,1,0,0,1,0|1,0,1]=4 1455 B15R2.2226 O=S(c1ccccc1)c2ccccc2 Amb2618723 [0,1,0,0,1,0|2,0,0]=4 1456 B15R2.2226 O=[P+](c1ccccc1)c2ccccc2 Amb15692810 [0,1,0,0,1,0|1,1,0]=4 1457 B15R2.2226 O=[PH](c1ccccc1)c2ccccc2 Amb2712941 [0,1,0,0,1,0|1,1,0]=4 1458 B15R2.2226 O=[Se](c1ccccc1)c2ccccc2 Amb2386871 [0,1,0,0,1,0|2,0,0]=4 1459 B15R2.2226 O=[Si](c1ccccc1)c2ccccc2 Amb28131409 [0,1,0,0,1,0|1,1,0]=4 1460 B15R2.2226 O=[Te](c1ccccc1)c2ccccc2 Amb2386875 [0,1,0,0,1,0|2,0,0]=4 1461 B15R2.2226 OC(c1ccccc1)c2ccccc2 Amb4605834 [0,1,0,0,1,0|1,0,0]=3 1462 B15R2.2226 OC(c1ccccc1)c2ccccn2 Amb1110809 [0,1,0,0,1,0|2,0,0]=4 1463 B15R2.2226 OC(c1ccccc1)c2cccnc2 Amb18538517 [0,1,0,0,1,0|0,0,0]=2 1464 B15R2.2226 OC(c1ccccc1)c2cccnn2 Amb27196762 [0,1,0,0,1,0|1,0,0]=3 1465 B15R2.2226 OC(c1ccccc1)c2ccncc2 Amb9704440 [0,1,0,0,1,0|2,0,0]=4 1466 B15R2.2226 OC(c1cccnc1)c2cncnc2 Amb19076418 [0,1,0,0,1,0|2,0,0]=4 1467 B15R2.2226 O[C@@H](c1ccccc1)c2ccccn2 Amb28321359 [0,1,0,0,1,0|2,0,0]=4 1468 B15R2.2226 O[C@@H](c1ccccc1)c2ccncc2 Amb28370062 [0,1,0,0,1,0|2,0,0]=4 1469 B15R2.2226 O[C@H](c1ccccc1)c2ccncc2 Amb28344673 [0,1,0,0,1,0|2,0,0]=4 1470 B15R2.2226 S=C(c1ccccc1)c2ccccc2 Amb17672303 [0,1,0,0,1,0|1,0,1]=4 1471 B15R2.2226 SC(c1ccccc1)c2ccccc2 Amb6660004 [0,1,0,0,1,0|1,0,0]=3 1472 B15R2.2226 SC(c1ccccc1)c2ccccn2 Amb7784762 [0,1,0,0,1,0|2,0,0]=4 1473 B15R2.2226 SC(c1ccccc1)c2ccncc2 Amb9472134 [0,1,0,0,1,0|2,0,0]=4 1474 B15R2.2226 [NH3+]C(c1ccccc1)c2ccccc2 Amb6365963 [0,1,0,0,1,0|1,0,0]=3 1475 B15R2.55 Brc1ccoc1CNc2ccccc2 Amb27656393 [0,1,0,0,1,0|1,0,0]=3 1476 B15R2.55 Brc1ccsc1CNc2ccccc2 Amb24376814 [0,1,0,0,1,0|1,0,0]=3 1477 B15R2.55 Brc1ccsc1CNc2cccnc2 Amb25360526 [0,1,0,0,1,0|2,0,0]=4 1478 B15R2.55 Brc1ccsc1COc2ccccc2 Amb27461183 [0,1,0,0,1,0|2,0,0]=4 1479 B15R2.55 Brc1cscc1CNc2ccccc2 Amb25323014 [0,1,0,0,1,0|1,0,0]=3 1480 B15R2.55 Brc1cscc1CNc2ccccn2 Amb28207581 [0,1,0,0,1,0|2,0,0]=4 1481 B15R2.55 Brc1csnc1CNc2ccccc2 Amb35637871 [0,1,0,0,1,0|1,0,0]=3 1482 B15R2.55 Brc1nccn1CCc2ccccc2 Amb17413309 [0,1,0,0,1,0|2,0,0]=4 1483 B15R2.55 Brc1occc1CNc2ccccc2 Amb27773124 [0,1,0,0,1,0|1,0,0]=3 1484 B15R2.55 Brc1sccc1COc2ccccc2 Amb28254992 [0,1,0,0,1,0|2,0,0]=4 1485 B15R2.55 Brc1sccc1CSc2ccccc2 Amb27266293 [0,1,0,0,1,0|2,0,0]=4 1486 B15R2.55 Brc1scnc1CNc2ccccc2 Amb35661069 [0,1,0,0,1,0|1,0,0]=3 1487 B15R2.55 Cc1ccnn1CCc2ccccc2 Amb27637544 [0,1,0,0,1,0|2,0,0]=4 1488 B15R2.55 Cc1ccoc1CNc2ccncc2 Amb28251965 [0,1,0,0,1,0|2,0,0]=4 1489 B15R2.55 Cc1conc1CNc2ccccc2 Amb32678236 [0,1,0,0,1,0|1,0,0]=3 1490 B15R2.55 Cc1cscc1NCc2cncnc2 Amb27661956 [0,1,0,0,1,0|2,0,0]=4 1491 B15R2.55 Cc1ncsc1CNc2cccnc2 Amb24713741 [0,1,0,0,1,0|2,0,0]=4 1492 B15R2.55 Cc1nocc1CNc2ccccn2 Amb27407195 [0,1,0,0,1,0|2,0,0]=4 1493 B15R2.55 Cc1nonc1CNc2ccccc2 Amb26875744 [0,1,0,0,1,0|2,0,0]=4 1494 B15R2.55 Cc1oncc1NCc2cccnc2 Amb27419066 [0,1,0,0,1,0|2,0,0]=4 1495 B15R2.55 Clc1ccsc1COc2ccccc2 Amb28239830 [0,1,0,0,1,0|2,0,0]=4 1496 B15R2.55 Clc1cscc1CNc2ccccn2 Amb27973800 [0,1,0,0,1,0|2,0,0]=4 1497 B15R2.55 Clc1sccc1CNc2ccncc2 Amb27760576 [0,1,0,0,1,0|2,0,0]=4 1498 B15R2.55 Clc1sccc1COc2ccccc2 Amb29882834 [0,1,0,0,1,0|2,0,0]=4 1499 B15R2.55 Clc1sccc1NCc2ccccc2 Amb27983091 [0,1,0,0,1,0|2,0,0]=4 1500 B15R2.55 Clc1snnc1CNc2ccccc2 Amb2420818 [0,1,0,0,1,0|2,0,0]=4 1501 B15R2.55 Cn1cccc1CNc2ccccc2 Amb7759742 [0,1,0,0,1,0|0,0,1]=3 1502 B15R2.55 Cn1cccc1CNc2cccnc2 Amb7796004 [0,1,0,0,1,0|1,0,1]=4 1503 B15R2.55 Cn1ccnc1CNc2ccccn2 Amb18933223 [0,1,0,0,1,0|2,0,0]=4 1504 B15R2.55 Cn1nccc1CNc2ccccc2 Amb2716293 [0,1,0,0,1,0|1,0,0]=3 1505 B15R2.55 Cn1nccc1CNc2ccccn2 Amb27955748 [0,1,0,0,1,0|2,0,0]=4 1506 B15R2.55 Cn1nccc1CNc2cccnc2 Amb9528269 [0,1,0,0,1,0|2,0,0]=4 1507 B15R2.55 Ic1ccsc1CNc2ccccc2 Amb27479770 [0,1,0,0,1,0|1,0,0]=3 1508 B15R2.55 Nc1ccnn1CCc2ccccc2 Amb1141535 [0,1,0,0,1,0|2,0,0]=4 1509 B15R2.55 Nc1ccsc1CNc2ccccc2 Amb27387575 [0,1,0,0,1,0|1,0,0]=3 1510 B15R2.55 Nc1ccsc1CNc2cccnc2 Amb27425457 [0,1,0,0,1,0|2,0,0]=4 1511 B15R2.55 Nc1cnoc1CCc2ccccc2 Amb18821053 [0,1,0,0,1,0|2,0,0]=4 1512 B15R2.55 Nc1cnsc1CCc2ccccc2 Amb28048263 [0,1,0,0,1,0|2,0,0]=4 1513 B15R2.55 Nc1nccn1CCc2ccccc2 Amb18969052 [0,1,0,0,1,0|2,0,0]=4 1514 B15R2.55 Nn1ccnc1CCc2ccccc2 Amb27772137 [0,1,0,0,1,0|2,0,0]=4 1515 B15R2.55 O=C1CCC=C1CNc2ccccc2 Amb27483058 [0,1,0,0,1,0|0,0,2]=4 1516 B15R2.55 Sc1nccn1CCc2ccccc2 Amb6339218 [0,1,0,0,1,0|2,0,0]=4 1517 B15R2.64 CC(Nc1ccccc1)c2ccco2 Amb6685122 [0,1,0,0,1,0|1,0,0]=3 1518 B15R2.64 CC(Nc1ccccc1)c2cccs2 Amb6685113 [0,1,0,0,1,0|1,0,0]=3 1519 B15R2.64 CC(Nc1ccccc1)c2ccoc2 Amb27166440 [0,1,0,0,1,0|1,0,0]=3 1520 B15R2.64 CC(Nc1ccccc1)c2cscn2 Amb27809923 [0,1,0,0,1,0|1,0,0]=3 1521 B15R2.64 CC(Nc1ccccc1)c2nccs2 Amb24577204 [0,1,0,0,1,0|1,0,0]=3 1522 B15R2.64 CC(Nc1ccccn1)c2ccco2 Amb9703310 [0,1,0,0,1,0|2,0,0]=4 1523 B15R2.64 CC(Nc1ccccn1)c2ccoc2 Amb27751625 [0,1,0,0,1,0|2,0,0]=4 1524 B15R2.64 CC(Nc1ccccn1)c2ccsc2 Amb18998969 [0,1,0,0,1,0|2,0,0]=4 1525 B15R2.64 CC(Nc1ccccn1)c2cncs2 Amb27981356 [0,1,0,0,1,0|2,0,0]=4 1526 B15R2.64 CC(Nc1ccccn1)c2cscn2 Amb27652710 [0,1,0,0,1,0|2,0,0]=4 1527 B15R2.64 CC(Nc1cccnc1)c2ccoc2 Amb27951406 [0,1,0,0,1,0|2,0,0]=4 1528 B15R2.64 CC(Nc1cccnc1)c2nccs2 Amb27417548 [0,1,0,0,1,0|2,0,0]=4 1529 B15R2.64 CC(Nc1ccncc1)c2cscn2 Amb35612353 [0,1,0,0,1,0|2,0,0]=4 1530 B15R2.64 CN(Cc1ccccc1)c2cccs2 Amb34154245 [0,1,0,0,1,0|2,0,0]=4 1531 B15R2.64 C[C@H](Nc1ccccc1)c2ccco2 Amb27223864 [0,1,0,0,1,0|1,0,0]=3 1532 B15R2.64 C[C@H](Nc1ccncc1)c2cccs2 Amb27226580 [0,1,0,0,1,0|2,0,0]=4 1533 B15R2.64 ClC(Cc1ccccc1)c2cccs2 Amb27978126 [0,1,0,0,1,0|2,0,0]=4 1534 B15R2.64 N=C(Nc1ccccc1)c2cscn2 Amb24103022 [0,1,0,0,1,0|1,0,1]=4 1535 B15R2.64 N=C(Nc1ccccc1)c2cscn2 Amb25059904 [0,1,0,0,1,0|1,0,1]=4 1536 B15R2.64 NC(Cc1ccccc1)c2ccco2 Amb5736369 [0,1,0,0,1,0|2,0,0]=4 1537 B15R2.64 NC(Cc1ccccc1)c2cccs2 Amb19374325 [0,1,0,0,1,0|2,0,0]=4 1538 B15R2.64 NC(Cc1ccccc1)c2cccs2 Amb5736370 [0,1,0,0,1,0|2,0,0]=4 1539 B15R2.64 NC(Cc1ccccc1)c2ccns2 Amb27787350 [0,1,0,0,1,0|2,0,0]=4 1540 B15R2.64 NC(Cc1ccccc1)c2ccon2 Amb27747919 [0,1,0,0,1,0|2,0,0]=4 1541 B15R2.64 NC(Cc1ccccc1)c2ccsc2 Amb18968295 [0,1,0,0,1,0|2,0,0]=4 1542 B15R2.64 NC(Cc1ccccc1)c2ccsn2 Amb27628661 [0,1,0,0,1,0|2,0,0]=4 1543 B15R2.64 NC(Cc1ccccc1)c2cnsc2 Amb35715841 [0,1,0,0,1,0|2,0,0]=4 1544 B15R2.64 NC(Cc1ccccc1)c2cscn2 Amb18783857 [0,1,0,0,1,0|2,0,0]=4 1545 B15R2.64 NC(Cc1ccccc1)c2ncco2 Amb18061838 [0,1,0,0,1,0|2,0,0]=4 1546 B15R2.64 NC(Cc1ccccc1)c2ncco2 Amb28750816 [0,1,0,0,1,0|2,0,0]=4 1547 B15R2.64 NC(Cc1ccccc1)c2nccs2 Amb5740592 [0,1,0,0,1,0|2,0,0]=4 1548 B15R2.64 N[C@@H](Cc1ccccc1)c2nccs2 Amb27882853 [0,1,0,0,1,0|2,0,0]=4 1549 B15R2.64 N[C@H](Cc1ccccc1)c2ncco2 Amb33872276 [0,1,0,0,1,0|2,0,0]=4 1550 B15R2.64 N[C@H](Cc1ccccc1)c2nccs2 Amb27585785 [0,1,0,0,1,0|2,0,0]=4 1551 B15R2.64 O=C(Cc1cccnc1)c2ccoc2 Amb28186821 [0,1,0,0,1,0|2,0,0]=4 1552 B15R2.64 O=C(Nc1ccccc1)C2=CC=CC2 Amb27765490 [0,1,0,0,1,0|0,0,2]=4 1553 B15R2.64 O=C(Nc1ccccc1)c2ccco2 Amb6358779 [0,1,0,0,1,0|1,0,1]=4 1554 B15R2.64 O=C(Nc1ccccc1)c2ccno2 Amb2771175 [0,1,0,0,1,0|1,0,1]=4 1555 B15R2.64 O=C(Nc1ccccc1)c2ccsc2 Amb2645615 [0,1,0,0,1,0|1,0,1]=4 1556 B15R2.64 O=C(Nc1ccccc1)c2cscn2 Amb16894702 [0,1,0,0,1,0|1,0,1]=4 1557 B15R2.64 O=C(Nc1ccccc1)c2ncco2 Amb27758819 [0,1,0,0,1,0|1,0,1]=4 1558 B15R2.64 O=C(Nc1ccccc1)n2ccnc2 Amb9823912 [0,1,0,0,1,0|1,0,1]=4 1559 B15R2.64 OC(Cc1ccccc1)c2ccco2 Amb17234504 [0,1,0,0,1,0|2,0,0]=4 1560 B15R2.64 OC(Cc1ccccc1)c2cccs2 Amb17238162 [0,1,0,0,1,0|2,0,0]=4 1561 B15R2.64 OC(Cc1ccccc1)c2ccns2 Amb27879974 [0,1,0,0,1,0|2,0,0]=4 1562 B15R2.64 OC(Cc1ccccc1)c2cnsc2 Amb35715820 [0,1,0,0,1,0|2,0,0]=4 1563 B15R2.64 OC(Cc1ccccc1)c2nccs2 Amb28430542 [0,1,0,0,1,0|2,0,0]=4 1564 B15R2.64 OC(Cc1cccnc1)c2cccs2 Amb28457819 [0,1,0,0,1,0|2,0,0]=4 1565 B15R2.64 O[C@H](Cc1ccccc1)c2nccs2 Amb27166720 [0,1,0,0,1,0|2,0,0]=4 1566 B15R2.100 Brc1ccc(CCc2ncco2)cc1 Amb18228114 [0,1,0,0,1,0|2,0,0]=4 1567 B15R2.100 Brc1ccc(CCc2nccs2)cc1 Amb18231870 [0,1,0,0,1,0|2,0,0]=4 1568 B15R2.100 Brc1ccc(CNc2ccsc2)cc1 Amb27668226 [0,1,0,0,1,0|2,0,0]=4 1569 B15R2.100 Brc1ccc(NCc2ccco2)cc1 Amb4086236 [0,1,0,0,1,0|1,0,0]=3 1570 B15R2.100 Brc1ccc(NCc2ccco2)nc1 Amb6616964 [0,1,0,0,1,0|2,0,0]=4 1571 B15R2.100 Brc1ccc(NCc2cccs2)cc1 Amb837985 [0,1,0,0,1,0|1,0,0]=3 1572 B15R2.100 Brc1ccc(NCc2ccno2)nc1 Amb28073941 [0,1,0,0,1,0|2,0,0]=4 1573 B15R2.100 Brc1ccc(NCc2ccns2)cc1 Amb35742399 [0,1,0,0,1,0|1,0,0]=3 1574 B15R2.100 Brc1ccc(NCc2ccns2)cn1 Amb35742400 [0,1,0,0,1,0|2,0,0]=4 1575 B15R2.100 Brc1ccc(NCc2ccns2)nc1 Amb35682581 [0,1,0,0,1,0|2,0,0]=4 1576 B15R2.100 Brc1ccc(NCc2ccoc2)cc1 Amb26521722 [0,1,0,0,1,0|1,0,0]=3 1577 B15R2.100 Brc1ccc(NCc2ccoc2)cn1 Amb27760748 [0,1,0,0,1,0|2,0,0]=4 1578 B15R2.100 Brc1ccc(NCc2ccsc2)cc1 Amb6696491 [0,1,0,0,1,0|1,0,0]=3 1579 B15R2.100 Brc1ccc(NCc2ccsc2)cn1 Amb27753593 [0,1,0,0,1,0|2,0,0]=4 1580 B15R2.100 Brc1ccc(NCc2cncs2)cc1 Amb27777689 [0,1,0,0,1,0|1,0,0]=3 1581 B15R2.100 Brc1ccc(NCc2cocn2)cc1 Amb27813932 [0,1,0,0,1,0|1,0,0]=3 1582 B15R2.100 Brc1ccc(NCc2cscn2)nc1 Amb27666619 [0,1,0,0,1,0|2,0,0]=4 1583 B15R2.100 Brc1ccc(NCc2csnn2)cc1 Amb9529098 [0,1,0,0,1,0|2,0,0]=4 1584 B15R2.100 Brc1ccc(NCc2nccs2)cc1 Amb17362862 [0,1,0,0,1,0|1,0,0]=3 1585 B15R2.100 Brc1ccc(NCc2nccs2)cn1 Amb28397027 [0,1,0,0,1,0|2,0,0]=4 1586 B15R2.100 Brc1ccc(NCc2ncno2)cc1 Amb27199210 [0,1,0,0,1,0|2,0,0]=4 1587 B15R2.100 Brc1ccc(OCc2ccco2)cc1 Amb9210909 [0,1,0,0,1,0|2,0,0]=4 1588 B15R2.100 Brc1ccc(OCc2ccns2)cc1 Amb35650192 [0,1,0,0,1,0|2,0,0]=4 1589 B15R2.100 Brc1ccc(OCc2ccoc2)cc1 Amb28318515 [0,1,0,0,1,0|2,0,0]=4 1590 B15R2.100 Brc1ccc(OCc2nccs2)cc1 Amb28140268 [0,1,0,0,1,0|2,0,0]=4 1591 B15R2.100 Cc1ccc(CCc2cnco2)cc1 Amb35647913 [0,1,0,0,1,0|2,0,0]=4 1592 B15R2.100 Cc1ccc(CNc2ccsc2)cc1 Amb28041237 [0,1,0,0,1,0|2,0,0]=4 1593 B15R2.100 Cc1ccc(CNc2ccsc2)cn1 Amb27395766 [0,1,0,0,1,0|1,0,0]=3 1594 B15R2.100 Cc1ccc(CNc2cnsc2)cn1 Amb35699654 [0,1,0,0,1,0|2,0,0]=4 1595 B15R2.100 Cc1ccc(NCc2ccco2)cc1 Amb1106843 [0,1,0,0,1,0|1,0,0]=3 1596 B15R2.100 Cc1ccc(NCc2ccco2)cn1 Amb25040417 [0,1,0,0,1,0|2,0,0]=4 1597 B15R2.100 Cc1ccc(NCc2cccs2)cc1 Amb3765816 [0,1,0,0,1,0|1,0,0]=3 1598 B15R2.100 Cc1ccc(NCc2cccs2)cn1 Amb25297787 [0,1,0,0,1,0|2,0,0]=4 1599 B15R2.100 Cc1ccc(NCc2cccs2)nc1 Amb8866991 [0,1,0,0,1,0|2,0,0]=4 1600 B15R2.100 Cc1ccc(NCc2ccno2)nc1 Amb27855799 [0,1,0,0,1,0|2,0,0]=4 1601 B15R2.100 Cc1ccc(NCc2ccns2)cc1 Amb35742406 [0,1,0,0,1,0|1,0,0]=3 1602 B15R2.100 Cc1ccc(NCc2ccns2)cn1 Amb35742409 [0,1,0,0,1,0|2,0,0]=4 1603 B15R2.100 Cc1ccc(NCc2ccns2)nc1 Amb29868151 [0,1,0,0,1,0|2,0,0]=4 1604 B15R2.100 Cc1ccc(NCc2ccoc2)cn1 Amb27222388 [0,1,0,0,1,0|2,0,0]=4 1605 B15R2.100 Cc1ccc(NCc2ccsc2)cc1 Amb6700779 [0,1,0,0,1,0|1,0,0]=3 1606 B15R2.100 Cc1ccc(NCc2ccsc2)cn1 Amb25713842 [0,1,0,0,1,0|2,0,0]=4 1607 B15R2.100 Cc1ccc(NCc2ccsc2)nc1 Amb27765378 [0,1,0,0,1,0|2,0,0]=4 1608 B15R2.100 Cc1ccc(NCc2cncs2)cc1 Amb18996525 [0,1,0,0,1,0|1,0,0]=3 1609 B15R2.100 Cc1ccc(NCc2cncs2)cn1 Amb26521890 [0,1,0,0,1,0|2,0,0]=4 1610 B15R2.100 Cc1ccc(NCc2cscn2)nc1 Amb28075809 [0,1,0,0,1,0|2,0,0]=4 1611 B15R2.100 Cc1ccc(NCc2nccs2)cc1 Amb17338179 [0,1,0,0,1,0|1,0,0]=3 1612 B15R2.100 Cc1ccc(NCc2ncno2)cc1 Amb18290397 [0,1,0,0,1,0|2,0,0]=4 1613 B15R2.100 Cc1ccc(OCc2ccno2)cc1 Amb27181504 [0,1,0,0,1,0|2,0,0]=4 1614 B15R2.100 Cc1ccc(OCc2ccns2)cc1 Amb35651547 [0,1,0,0,1,0|2,0,0]=4 1615 B15R2.100 Cc1ccc(OCc2ccoc2)cc1 Amb27170129 [0,1,0,0,1,0|2,0,0]=4 1616 B15R2.100 Cc1ccc(OCc2ccsc2)cc1 Amb22482259 [0,1,0,0,1,0|2,0,0]=4 1617 B15R2.100 Cc1ccc(OCc2nccs2)cc1 Amb27587989 [0,1,0,0,1,0|2,0,0]=4 1618 B15R2.100 Cc1cnc(CNc2ccsc2)cn1 Amb30007668 [0,1,0,0,1,0|2,0,0]=4 1619 B15R2.100 Cc1cnc(CNn2cccc2)cn1 Amb30007665 [0,1,0,0,1,0|2,0,0]=4 1620 B15R2.100 Clc1ccc(CCn2cccc2)cc1 Amb27746759 [0,1,0,0,1,0|2,0,0]=4 1621 B15R2.100 Clc1ccc(CNc2ccon2)cn1 Amb28369711 [0,1,0,0,1,0|2,0,0]=4 1622 B15R2.100 Clc1ccc(CNc2nccs2)cn1 Amb24721427 [0,1,0,0,1,0|2,0,0]=4 1623 B15R2.100 Clc1ccc(NCc2ccco2)cc1 Amb27167937 [0,1,0,0,1,0|1,0,0]=3 1624 B15R2.100 Clc1ccc(NCc2ccco2)cc1 Amb534493 [0,1,0,0,1,0|1,0,0]=3 1625 B15R2.100 Clc1ccc(NCc2ccco2)cn1 Amb25675613 [0,1,0,0,1,0|2,0,0]=4 1626 B15R2.100 Clc1ccc(NCc2cccs2)cc1 Amb6322684 [0,1,0,0,1,0|1,0,0]=3 1627 B15R2.100 Clc1ccc(NCc2cccs2)cn1 Amb25790673 [0,1,0,0,1,0|2,0,0]=4 1628 B15R2.100 Clc1ccc(NCc2ccno2)cc1 Amb28320286 [0,1,0,0,1,0|1,0,0]=3 1629 B15R2.100 Clc1ccc(NCc2ccno2)nc1 Amb27236745 [0,1,0,0,1,0|2,0,0]=4 1630 B15R2.100 Clc1ccc(NCc2ccns2)cc1 Amb35580044 [0,1,0,0,1,0|1,0,0]=3 1631 B15R2.100 Clc1ccc(NCc2ccns2)cn1 Amb35580046 [0,1,0,0,1,0|2,0,0]=4 1632 B15R2.100 Clc1ccc(NCc2ccns2)nc1 Amb29868173 [0,1,0,0,1,0|2,0,0]=4 1633 B15R2.100 Clc1ccc(NCc2ccoc2)nc1 Amb27172562 [0,1,0,0,1,0|2,0,0]=4 1634 B15R2.100 Clc1ccc(NCc2ccsc2)cc1 Amb6354284 [0,1,0,0,1,0|1,0,0]=3 1635 B15R2.100 Clc1ccc(NCc2ccsc2)cn1 Amb25946209 [0,1,0,0,1,0|2,0,0]=4 1636 B15R2.100 Clc1ccc(NCc2cnco2)cc1 Amb28070014 [0,1,0,0,1,0|1,0,0]=3 1637 B15R2.100 Clc1ccc(NCc2cncs2)cc1 Amb18996510 [0,1,0,0,1,0|1,0,0]=3 1638 B15R2.100 Clc1ccc(NCc2cncs2)cn1 Amb24344868 [0,1,0,0,1,0|2,0,0]=4 1639 B15R2.100 Clc1ccc(NCc2cncs2)nc1 Amb27401630 [0,1,0,0,1,0|2,0,0]=4 1640 B15R2.100 Clc1ccc(NCc2cocn2)cc1 Amb27256144 [0,1,0,0,1,0|1,0,0]=3 1641 B15R2.100 Clc1ccc(NCc2cscn2)cc1 Amb18972452 [0,1,0,0,1,0|1,0,0]=3 1642 B15R2.100 Clc1ccc(NCc2csnn2)cc1 Amb9529094 [0,1,0,0,1,0|2,0,0]=4 1643 B15R2.100 Clc1ccc(NCc2nccs2)cc1 Amb17343196 [0,1,0,0,1,0|1,0,0]=3 1644 B15R2.100 Clc1ccc(NCn2cncn2)cc1 Amb27815152 [0,1,0,0,1,0|2,0,0]=4 1645 B15R2.100 Clc1ccc(OCc2ccco2)cc1 Amb27488144 [0,1,0,0,1,0|2,0,0]=4 1646 B15R2.100 Clc1ccc(OCc2ccns2)cc1 Amb35651550 [0,1,0,0,1,0|2,0,0]=4 1647 B15R2.100 Clc1ccc(OCc2ccsc2)cc1 Amb28283228 [0,1,0,0,1,0|2,0,0]=4 1648 B15R2.100 Clc1ccc(OCc2cncs2)cc1 Amb28282067 [0,1,0,0,1,0|2,0,0]=4 1649 B15R2.100 Clc1ccc(OCc2nccs2)cc1 Amb27490577 [0,1,0,0,1,0|2,0,0]=4 1650 B15R2.100 Fc1ccc(CNc2ccsc2)cc1 Amb27490529 [0,1,0,0,1,0|2,0,0]=4 1651 B15R2.100 Fc1ccc(NCc2ccco2)cc1 Amb2607069 [0,1,0,0,1,0|1,0,0]=3 1652 B15R2.100 Fc1ccc(NCc2ccco2)cc1 Amb7969755 [0,1,0,0,1,0|1,0,0]=3 1653 B15R2.100 Fc1ccc(NCc2cccs2)cc1 Amb10609384 [0,1,0,0,1,0|1,0,0]=3 1654 B15R2.100 Fc1ccc(NCc2cccs2)cc1 Amb837944 [0,1,0,0,1,0|1,0,0]=3 1655 B15R2.100 Fc1ccc(NCc2ccns2)cc1 Amb35733212 [0,1,0,0,1,0|1,0,0]=3 1656 B15R2.100 Fc1ccc(NCc2ccns2)cn1 Amb35720421 [0,1,0,0,1,0|2,0,0]=4 1657 B15R2.100 Fc1ccc(NCc2ccns2)nc1 Amb29868165 [0,1,0,0,1,0|2,0,0]=4 1658 B15R2.100 Fc1ccc(NCc2ccoc2)cc1 Amb28368978 [0,1,0,0,1,0|1,0,0]=3 1659 B15R2.100 Fc1ccc(NCc2ccsc2)cc1 Amb6696724 [0,1,0,0,1,0|1,0,0]=3 1660 B15R2.100 Fc1ccc(NCc2ccsc2)nc1 Amb28123077 [0,1,0,0,1,0|2,0,0]=4 1661 B15R2.100 Fc1ccc(NCc2cnco2)cn1 Amb27433277 [0,1,0,0,1,0|2,0,0]=4 1662 B15R2.100 Fc1ccc(NCc2cncs2)cc1 Amb18996513 [0,1,0,0,1,0|1,0,0]=3 1663 B15R2.100 Fc1ccc(NCc2cnsn2)cc1 Amb27779918 [0,1,0,0,1,0|2,0,0]=4 1664 B15R2.100 Fc1ccc(NCc2cscn2)cc1 Amb18972447 [0,1,0,0,1,0|1,0,0]=3 1665 B15R2.100 Fc1ccc(NCc2cscn2)nc1 Amb27164872 [0,1,0,0,1,0|2,0,0]=4 1666 B15R2.100 Fc1ccc(NCc2csnn2)cc1 Amb9529100 [0,1,0,0,1,0|2,0,0]=4 1667 B15R2.100 Fc1ccc(NCc2nccs2)cc1 Amb17339020 [0,1,0,0,1,0|1,0,0]=3 1668 B15R2.100 Fc1ccc(NCc2nccs2)nc1 Amb18975424 [0,1,0,0,1,0|2,0,0]=4 1669 B15R2.100 Fc1ccc(OCc2cccs2)cc1 Amb27181660 [0,1,0,0,1,0|2,0,0]=4 1670 B15R2.100 Fc1ccc(OCc2ccns2)cc1 Amb35651094 [0,1,0,0,1,0|2,0,0]=4 1671 B15R2.100 Fc1ccc(OCc2ccoc2)cc1 Amb28281945 [0,1,0,0,1,0|2,0,0]=4 1672 B15R2.100 Fc1ccc(OCc2ccsc2)cc1 Amb27783725 [0,1,0,0,1,0|2,0,0]=4 1673 B15R2.100 Ic1ccc(NCc2cccs2)cc1 Amb7759902 [0,1,0,0,1,0|1,0,0]=3 1674 B15R2.100 Ic1ccc(NCc2ccns2)cc1 Amb35730865 [0,1,0,0,1,0|1,0,0]=3 1675 B15R2.100 Ic1ccc(NCc2ccoc2)nc1 Amb27599310 [0,1,0,0,1,0|2,0,0]=4 1676 B15R2.100 Ic1ccc(NCc2cncs2)nc1 Amb28201609 [0,1,0,0,1,0|2,0,0]=4 1677 B15R2.100 Ic1ccc(NCc2cnsn2)cc1 Amb27221303 [0,1,0,0,1,0|2,0,0]=4 1678 B15R2.100 Ic1ccc(NCc2cscn2)nc1 Amb27256158 [0,1,0,0,1,0|2,0,0]=4 1679 B15R2.100 Ic1ccc(NCc2nccs2)cc1 Amb27250142 [0,1,0,0,1,0|1,0,0]=3 1680 B15R2.100 Ic1ccc(OCc2ccns2)cc1 Amb35649864 [0,1,0,0,1,0|2,0,0]=4 1681 B15R2.100 Ic1ccc(OCc2ccsc2)cc1 Amb27746738 [0,1,0,0,1,0|2,0,0]=4 1682 B15R2.100 Ic1ccc(OCc2cscn2)cc1 Amb27837290 [0,1,0,0,1,0|2,0,0]=4 1683 B15R2.100 Nc1ccc(CCc2ncco2)cc1 Amb18863323 [0,1,0,0,1,0|2,0,0]=4 1684 B15R2.100 Nc1ccc(CCc2nccs2)cc1 Amb18865071 [0,1,0,0,1,0|2,0,0]=4 1685 B15R2.100 Nc1ccc(CCn2cccn2)cc1 Amb9380772 [0,1,0,0,1,0|2,0,0]=4 1686 B15R2.100 Nc1ccc(CCn2ccnc2)cc1 Amb2445129 [0,1,0,0,1,0|2,0,0]=4 1687 B15R2.100 Nc1ccc(CNc2nccs2)cn1 Amb27607300 [0,1,0,0,1,0|2,0,0]=4 1688 B15R2.100 Nc1ccc(NCc2ccco2)cc1 Amb9205195 [0,1,0,0,1,0|1,0,0]=3 1689 B15R2.100 Nc1ccc(NCc2ccco2)cn1 Amb7767467 [0,1,0,0,1,0|2,0,0]=4 1690 B15R2.100 Nc1ccc(NCc2ccco2)nc1 Amb1118410 [0,1,0,0,1,0|2,0,0]=4 1691 B15R2.100 Nc1ccc(NCc2cccs2)nc1 Amb9023563 [0,1,0,0,1,0|2,0,0]=4 1692 B15R2.100 Nc1ccc(NCc2ccno2)cn1 Amb27824334 [0,1,0,0,1,0|2,0,0]=4 1693 B15R2.100 Nc1ccc(NCc2ccno2)nc1 Amb27627713 [0,1,0,0,1,0|2,0,0]=4 1694 B15R2.100 Nc1ccc(NCc2ccns2)cc1 Amb35717057 [0,1,0,0,1,0|1,0,0]=3 1695 B15R2.100 Nc1ccc(NCc2ccns2)cn1 Amb35717059 [0,1,0,0,1,0|2,0,0]=4 1696 B15R2.100 Nc1ccc(NCc2ccns2)nc1 Amb35717061 [0,1,0,0,1,0|2,0,0]=4 1697 B15R2.100 Nc1ccc(NCc2ccoc2)cc1 Amb27174059 [0,1,0,0,1,0|1,0,0]=3 1698 B15R2.100 Nc1ccc(NCc2ccoc2)nc1 Amb27984646 [0,1,0,0,1,0|2,0,0]=4 1699 B15R2.100 Nc1ccc(NCc2ccon2)cc1 Amb27213660 [0,1,0,0,1,0|1,0,0]=3 1700 B15R2.100 Nc1ccc(NCc2cnns2)cc1 Amb27247474 [0,1,0,0,1,0|2,0,0]=4 1701 B15R2.100 Nc1ccc(NCc2cscn2)cn1 Amb27417198 [0,1,0,0,1,0|2,0,0]=4 1702 B15R2.100 Nc1ccc(NCc2cscn2)nc1 Amb27417199 [0,1,0,0,1,0|2,0,0]=4 1703 B15R2.100 Nc1ccc(NCc2csnn2)cc1 Amb27959373 [0,1,0,0,1,0|2,0,0]=4 1704 B15R2.100 Nc1ccc(NCn2cncn2)cc1 Amb27423014 [0,1,0,0,1,0|2,0,0]=4 1705 B15R2.100 Nc1ccc(OCc2ccco2)cc1 Amb33533127 [0,1,0,0,1,0|2,0,0]=4 1706 B15R2.100 Nc1ccc(OCc2cccs2)cc1 Amb5760678 [0,1,0,0,1,0|2,0,0]=4 1707 B15R2.100 Nc1ccc(OCc2ccno2)cc1 Amb18971529 [0,1,0,0,1,0|2,0,0]=4 1708 B15R2.100 Nc1ccc(OCc2ccns2)cc1 Amb29870995 [0,1,0,0,1,0|2,0,0]=4 1709 B15R2.100 Nc1ccc(OCc2ncco2)cc1 Amb18863509 [0,1,0,0,1,0|2,0,0]=4 1710 B15R2.100 Nc1ccc(OCc2nccs2)cc1 Amb17101258 [0,1,0,0,1,0|2,0,0]=4 1711 B15R2.100 Nc1ccc(SCc2ccco2)cc1 Amb1099017 [0,1,0,0,1,0|2,0,0]=4 1712 B15R2.100 Nc1ccc(SCc2ccns2)cc1 Amb35658634 [0,1,0,0,1,0|2,0,0]=4 1713 B15R2.100 Nc1ccc(SCc2ccoc2)cc1 Amb27189298 [0,1,0,0,1,0|2,0,0]=4 1714 B15R2.100 Nc1ccc(SCc2cscn2)cc1 Amb8930270 [0,1,0,0,1,0|2,0,0]=4 1715 B15R2.100 Nc1ccc(SCc2nccs2)cc1 Amb19882147 [0,1,0,0,1,0|2,0,0]=4 1716 B15R2.100 Nc1ccc(SCn2cccn2)cc1 Amb27169087 [0,1,0,0,1,0|2,0,0]=4 1717 B15R2.100 O=C1C=CC(NCc2ccns2)=CN1 Amb35742413 [0,1,0,0,1,0|2,0,0]=4 1718 B15R2.100 O=C1C=CC(NCc2ccoc2)=CN1 Amb27425771 [0,1,0,0,1,0|2,0,0]=4 1719 B15R2.100 O=C1C=CC(NCc2cnco2)=CN1 Amb28071732 [0,1,0,0,1,0|2,0,0]=4 1720 B15R2.100 O=C1C=CC(NCc2cscn2)=CN1 Amb28204424 [0,1,0,0,1,0|2,0,0]=4 1721 B15R2.100 Oc1ccc(CCn2cccc2)cc1 Amb19046478 [0,1,0,0,1,0|2,0,0]=4 1722 B15R2.100 Oc1ccc(CCn2cccn2)cc1 Amb27255459 [0,1,0,0,1,0|2,0,0]=4 1723 B15R2.100 Oc1ccc(NCc2ccco2)cc1 Amb2721974 [0,1,0,0,1,0|1,0,0]=3 1724 B15R2.100 Oc1ccc(NCc2cccs2)cc1 Amb6336203 [0,1,0,0,1,0|1,0,0]=3 1725 B15R2.100 Oc1ccc(NCc2ccns2)cc1 Amb35742412 [0,1,0,0,1,0|1,0,0]=3 1726 B15R2.100 Oc1ccc(NCc2cnco2)cc1 Amb27981165 [0,1,0,0,1,0|1,0,0]=3 1727 B15R2.100 Oc1ccc(NCc2cncs2)cc1 Amb18996550 [0,1,0,0,1,0|1,0,0]=3 1728 B15R2.100 Oc1ccc(NCc2cocn2)cc1 Amb27832747 [0,1,0,0,1,0|1,0,0]=3 1729 B15R2.100 Oc1ccc(NCc2csnn2)cc1 Amb9608865 [0,1,0,0,1,0|2,0,0]=4 1730 B15R2.100 Oc1ccc(OCc2ccns2)cc1 Amb35673706 [0,1,0,0,1,0|2,0,0]=4 1731 B15R2.100 Oc1ccc(SCc2ccco2)cc1 Amb28251737 [0,1,0,0,1,0|2,0,0]=4 1732 B15R2.100 Oc1ccc(SCc2cccs2)cc1 Amb13893514 [0,1,0,0,1,0|2,0,0]=4 1733 B15R2.100 Oc1ccc(SCc2ccno2)cc1 Amb28045218 [0,1,0,0,1,0|2,0,0]=4 1734 B15R2.100 Oc1ccc(SCc2ccns2)cc1 Amb35673709 [0,1,0,0,1,0|2,0,0]=4 1735 B15R2.100 Oc1ccc(SCc2nccs2)cc1 Amb27867284 [0,1,0,0,1,0|2,0,0]=4 1736 B15R2.100 Oc1ccc(SCn2cccn2)cc1 Amb27612580 [0,1,0,0,1,0|2,0,0]=4 1737 B15R2.283 Brc1cc(CNc2ccccc2)on1 Amb28047981 [0,1,0,0,1,0|1,0,0]=3 1738 B15R2.283 Brc1cc(CNc2cccnc2)cs1 Amb9511674 [0,1,0,0,1,0|2,0,0]=4 1739 B15R2.283 Brc1cc(CNc2ccncc2)cs1 Amb27826037 [0,1,0,0,1,0|2,0,0]=4 1740 B15R2.283 Brc1cc(CSc2ccccc2)co1 Amb27768461 [0,1,0,0,1,0|2,0,0]=4 1741 B15R2.283 Brc1ccc(CNc2ccccc2)s1 Amb6685182 [0,1,0,0,1,0|1,0,0]=3 1742 B15R2.283 Brc1ccc(CNc2ccccn2)o1 Amb7097569 [0,1,0,0,1,0|2,0,0]=4 1743 B15R2.283 Brc1ccc(CNc2cccnc2)s1 Amb6686640 [0,1,0,0,1,0|2,0,0]=4 1744 B15R2.283 Brc1ccc(CNc2ccncc2)s1 Amb27432776 [0,1,0,0,1,0|2,0,0]=4 1745 B15R2.283 Brc1ccc(COc2ccccc2)o1 Amb27181464 [0,1,0,0,1,0|2,0,0]=4 1746 B15R2.283 Brc1cnc(CNc2ccccc2)s1 Amb28342967 [0,1,0,0,1,0|1,0,0]=3 1747 B15R2.283 Brc1cnc(NCc2cccnc2)s1 Amb26464875 [0,1,0,0,1,0|2,0,0]=4 1748 B15R2.283 Brc1cnn(CCc2ccccc2)c1 Amb19375314 [0,1,0,0,1,0|2,0,0]=4 1749 B15R2.283 Brc1cnn(COc2ccccc2)c1 Amb23441306 [0,1,0,0,1,0|2,0,0]=4 1750 B15R2.283 Brc1coc(CNc2ccccc2)c1 Amb27809278 [0,1,0,0,1,0|1,0,0]=3 1751 B15R2.283 Brc1csc(CNc2ccccc2)c1 Amb7783550 [0,1,0,0,1,0|1,0,0]=3 1752 B15R2.283 Brc1csc(CNc2ccccn2)c1 Amb27268205 [0,1,0,0,1,0|2,0,0]=4 1753 B15R2.283 Brc1csc(CNc2cccnc2)c1 Amb7783552 [0,1,0,0,1,0|2,0,0]=4 1754 B15R2.283 Cc1cc(CNc2ccccc2)sn1 Amb29868120 [0,1,0,0,1,0|1,0,0]=3 1755 B15R2.283 Cc1cc(CNc2ccccn2)on1 Amb18983748 [0,1,0,0,1,0|2,0,0]=4 1756 B15R2.283 Cc1cc(CNc2ccncc2)sn1 Amb29856358 [0,1,0,0,1,0|2,0,0]=4 1757 B15R2.283 Cc1ccc(CNc2ccccn2)o1 Amb1762669 [0,1,0,0,1,0|2,0,0]=4 1758 B15R2.283 Cc1ccc(CNc2cccnc2)o1 Amb6686506 [0,1,0,0,1,0|2,0,0]=4 1759 B15R2.283 Cc1ccc(CNc2cccnc2)s1 Amb6719771 [0,1,0,0,1,0|2,0,0]=4 1760 B15R2.283 Cc1ccc(CNc2ccncc2)o1 Amb18299213 [0,1,0,0,1,0|2,0,0]=4 1761 B15R2.283 Cc1ccn(CCc2ccccc2)n1 Amb24348125 [0,1,0,0,1,0|2,0,0]=4 1762 B15R2.283 Cc1cnc(CNc2cccnc2)s1 Amb27781763 [0,1,0,0,1,0|2,0,0]=4 1763 B15R2.283 Cc1cnc(CSc2ccccc2)s1 Amb28068548 [0,1,0,0,1,0|2,0,0]=4 1764 B15R2.283 Cc1cnc(NCc2cccnc2)o1 Amb27973963 [0,1,0,0,1,0|2,0,0]=4 1765 B15R2.283 Cc1csc(CNc2ccccc2)n1 Amb17338176 [0,1,0,0,1,0|1,0,0]=3 1766 B15R2.283 Cc1csc(CNc2ccccn2)c1 Amb27648085 [0,1,0,0,1,0|2,0,0]=4 1767 B15R2.283 Cc1csc(CNc2ccccn2)n1 Amb18971023 [0,1,0,0,1,0|2,0,0]=4 1768 B15R2.283 Cc1csc(CNc2cccnc2)n1 Amb18933046 [0,1,0,0,1,0|2,0,0]=4 1769 B15R2.283 Cc1csc(COc2ccccc2)n1 Amb27390334 [0,1,0,0,1,0|2,0,0]=4 1770 B15R2.283 Cc1csc(CSc2ccccc2)n1 Amb4382820 [0,1,0,0,1,0|2,0,0]=4 1771 B15R2.283 Cc1nc(CNc2cccnc2)cs1 Amb6745011 [0,1,0,0,1,0|2,0,0]=4 1772 B15R2.283 Cc1ncc(CNc2cccnc2)s1 Amb19372994 [0,1,0,0,1,0|2,0,0]=4 1773 B15R2.283 Cc1ncc(CNc2ccncc2)o1 Amb27976033 [0,1,0,0,1,0|2,0,0]=4 1774 B15R2.283 Cc1ncc(NCc2cccnc2)s1 Amb27773486 [0,1,0,0,1,0|2,0,0]=4 1775 B15R2.283 Cc1nnc(CNc2ccccc2)o1 Amb17029950 [0,1,0,0,1,0|2,0,0]=4 1776 B15R2.283 Cc1nnc(CNc2ccccc2)s1 Amb28201777 [0,1,0,0,1,0|2,0,0]=4 1777 B15R2.283 Cc1noc(CNc2ccccc2)n1 Amb18968007 [0,1,0,0,1,0|2,0,0]=4 1778 B15R2.283 Clc1cc(CNc2ccccc2)cs1 Amb27768782 [0,1,0,0,1,0|1,0,0]=3 1779 B15R2.283 Clc1ccc(CNc2ccccc2)s1 Amb6707036 [0,1,0,0,1,0|1,0,0]=3 1780 B15R2.283 Clc1ccc(CNc2ccccn2)o1 Amb25752812 [0,1,0,0,1,0|2,0,0]=4 1781 B15R2.283 Clc1cnc(NCc2cccnc2)s1 Amb27599271 [0,1,0,0,1,0|2,0,0]=4 1782 B15R2.283 Clc1csc(NCc2cccnc2)n1 Amb27629477 [0,1,0,0,1,0|2,0,0]=4 1783 B15R2.283 Clc1ncc(COc2ccccc2)s1 Amb2435155 [0,1,0,0,1,0|2,0,0]=4 1784 B15R2.283 Clc1ncc(CSc2ccccc2)s1 Amb2429943 [0,1,0,0,1,0|2,0,0]=4 1785 B15R2.283 Cn1cc(CNc2ccccc2)cn1 Amb6715965 [0,1,0,0,1,0|1,0,0]=3 1786 B15R2.283 Cn1cc(CNc2cccnc2)cn1 Amb6715973 [0,1,0,0,1,0|2,0,0]=4 1787 B15R2.283 Cn1cc(NCc2cccnc2)cn1 Amb9396715 [0,1,0,0,1,0|2,0,0]=4 1788 B15R2.283 Cn1ccc(CNc2ccccc2)n1 Amb6888636 [0,1,0,0,1,0|1,0,0]=3 1789 B15R2.283 Cn1ccc(CNc2ccccn2)n1 Amb27390415 [0,1,0,0,1,0|2,0,0]=4 1790 B15R2.283 Cn1ccc(CNc2ccncc2)n1 Amb28423203 [0,1,0,0,1,0|2,0,0]=4 1791 B15R2.283 Cn1ccc(COc2ccccc2)n1 Amb27981040 [0,1,0,0,1,0|2,0,0]=4 1792 B15R2.283 Cn1ccc(NCc2cccnc2)n1 Amb9778149 [0,1,0,0,1,0|2,0,0]=4 1793 B15R2.283 Cn1cnc(CNc2ccccn2)c1 Amb28351085 [0,1,0,0,1,0|2,0,0]=4 1794 B15R2.283 Ic1ccc(CNc2ccccc2)o1 Amb9622177 [0,1,0,0,1,0|1,0,0]=3 1795 B15R2.283 Ic1cnc(CNc2cccnc2)s1 Amb27434370 [0,1,0,0,1,0|2,0,0]=4 1796 B15R2.283 Nc1cc(CCc2ccccc2)no1 Amb33529147 [0,1,0,0,1,0|2,0,0]=4 1797 B15R2.283 Nc1cc(CCc2ccccc2)on1 Amb26420299 [0,1,0,0,1,0|2,0,0]=4 1798 B15R2.283 Nc1cc(COc2ccccc2)no1 Amb17234868 [0,1,0,0,1,0|2,0,0]=4 1799 B15R2.283 Nc1ccn(CCc2ccccc2)n1 Amb7173304 [0,1,0,0,1,0|2,0,0]=4 1800 B15R2.283 Nc1ccn(NCc2ccccc2)c1 Amb27808328 [0,1,0,0,1,0|2,0,0]=4 1801 B15R2.283 Nc1cn(CCc2ccccc2)cn1 Amb18821444 [0,1,0,0,1,0|2,0,0]=4 1802 B15R2.283 Nc1cnc(CCc2ccccc2)o1 Amb18564480 [0,1,0,0,1,0|2,0,0]=4 1803 B15R2.283 Nc1cnc(COc2ccccc2)o1 Amb18564685 [0,1,0,0,1,0|2,0,0]=4 1804 B15R2.283 Nc1cnc(COc2ccccc2)s1 Amb27406763 [0,1,0,0,1,0|2,0,0]=4 1805 B15R2.283 Nc1cnn(CCc2ccccc2)c1 Amb6667049 [0,1,0,0,1,0|2,0,0]=4 1806 B15R2.283 Nc1csc(CCc2ccccc2)n1 Amb28341882 [0,1,0,0,1,0|2,0,0]=4 1807 B15R2.283 Nc1nc(CCc2ccccc2)cs1 Amb17238165 [0,1,0,0,1,0|2,0,0]=4 1808 B15R2.283 Nc1nc(CNc2ccccc2)cs1 Amb18865210 [0,1,0,0,1,0|1,0,0]=3 1809 B15R2.283 Nc1nc(COc2ccccc2)cs1 Amb32671106 [0,1,0,0,1,0|2,0,0]=4 1810 B15R2.283 Nc1nc(COc2ccccc2)cs1 Amb33526374 [0,1,0,0,1,0|2,0,0]=4 1811 B15R2.283 Nc1nc(CSc2ccccc2)cs1 Amb8830551 [0,1,0,0,1,0|2,0,0]=4 1812 B15R2.283 Nc1ncc(CCc2ccccc2)o1 Amb27645227 [0,1,0,0,1,0|2,0,0]=4 1813 B15R2.283 Nc1ncc(CNc2ccccn2)o1 Amb28045542 [0,1,0,0,1,0|2,0,0]=4 1814 B15R2.283 Nc1ncc(COc2ccccc2)s1 Amb4291193 [0,1,0,0,1,0|2,0,0]=4 1815 B15R2.283 O=C1C=C\C(=N\Nc2ccccc2)O1 Amb534137 [0,1,0,0,1,0|2,0,0]=4 1816 B15R2.283 O=C1N=C(CNc2ccccc2)NN1 Amb19804621 [0,1,0,0,1,0|2,0,0]=4 1817 B15R2.283 Oc1cnn(CCc2ccccc2)c1 Amb26846771 [0,1,0,0,1,0|2,0,0]=4 1818 B15R2.283 Oc1cnn(CCc2ccccc2)c1 Amb33295317 [0,1,0,0,1,0|2,0,0]=4 1819 B15R2.283 Oc1csc(CCc2ccccc2)n1 Amb27418813 [0,1,0,0,1,0|2,0,0]=4 1820 B15R2.562 Brc1ccccc1CCc2ncco2 Amb18228108 [0,1,0,0,1,0|2,0,0]=4 1821 B15R2.562 Brc1ccccc1CCc2nccs2 Amb18885134 [0,1,0,0,1,0|2,0,0]=4 1822 B15R2.562 Brc1ccccc1CNn2cccc2 Amb27863218 [0,1,0,0,1,0|2,0,0]=4 1823 B15R2.562 Brc1ccccc1NCc2ccco2 Amb6696376 [0,1,0,0,1,0|1,0,0]=3 1824 B15R2.562 Brc1ccccc1NCc2cccs2 Amb4418598 [0,1,0,0,1,0|1,0,0]=3 1825 B15R2.562 Brc1ccccc1NCc2ccno2 Amb27592304 [0,1,0,0,1,0|1,0,0]=3 1826 B15R2.562 Brc1ccccc1NCc2ccns2 Amb35742396 [0,1,0,0,1,0|1,0,0]=3 1827 B15R2.562 Brc1ccccc1NCc2ccsc2 Amb6696381 [0,1,0,0,1,0|1,0,0]=3 1828 B15R2.562 Brc1ccccc1NCc2cncs2 Amb25164853 [0,1,0,0,1,0|1,0,0]=3 1829 B15R2.562 Brc1ccccc1NCc2cnsn2 Amb27215080 [0,1,0,0,1,0|2,0,0]=4 1830 B15R2.562 Brc1ccccc1NCc2cscn2 Amb27771339 [0,1,0,0,1,0|1,0,0]=3 1831 B15R2.562 Brc1ccccc1NCc2csnn2 Amb9529097 [0,1,0,0,1,0|2,0,0]=4 1832 B15R2.562 Brc1ccccc1NCc2nccs2 Amb17362863 [0,1,0,0,1,0|1,0,0]=3 1833 B15R2.562 Brc1ccccc1OCc2ccns2 Amb35650191 [0,1,0,0,1,0|2,0,0]=4 1834 B15R2.562 Brc1cccnc1NCc2ccco2 Amb28183213 [0,1,0,0,1,0|2,0,0]=4 1835 B15R2.562 Brc1cccnc1NCc2ccno2 Amb27832851 [0,1,0,0,1,0|2,0,0]=4 1836 B15R2.562 Brc1cccnc1NCc2ccns2 Amb35682579 [0,1,0,0,1,0|2,0,0]=4 1837 B15R2.562 Brc1cccnc1NCc2cscn2 Amb27408132 [0,1,0,0,1,0|2,0,0]=4 1838 B15R2.562 Brc1cnccc1NCc2ccns2 Amb35682580 [0,1,0,0,1,0|2,0,0]=4 1839 B15R2.562 Brc1cnccc1NCc2ccsc2 Amb27865771 [0,1,0,0,1,0|2,0,0]=4 1840 B15R2.562 Brc1cnccc1NCc2cncs2 Amb28289717 [0,1,0,0,1,0|2,0,0]=4 1841 B15R2.562 Brc1cnccc1NCc2cscn2 Amb28424287 [0,1,0,0,1,0|2,0,0]=4 1842 B15R2.562 Brc1ncccc1NCc2ccns2 Amb35742401 [0,1,0,0,1,0|2,0,0]=4 1843 B15R2.562 Brc1ncccc1NCc2ccsc2 Amb27775626 [0,1,0,0,1,0|2,0,0]=4 1844 B15R2.562 Brc1ncccc1NCc2nccs2 Amb27475870 [0,1,0,0,1,0|2,0,0]=4 1845 B15R2.562 Cc1ccccc1CCc2cnco2 Amb35647974 [0,1,0,0,1,0|2,0,0]=4 1846 B15R2.562 Cc1ccccc1CNn2cccc2 Amb27807775 [0,1,0,0,1,0|2,0,0]=4 1847 B15R2.562 Cc1ccccc1NCc2ccco2 Amb6701130 [0,1,0,0,1,0|1,0,0]=3 1848 B15R2.562 Cc1ccccc1NCc2cccs2 Amb6701127 [0,1,0,0,1,0|1,0,0]=3 1849 B15R2.562 Cc1ccccc1NCc2ccno2 Amb27419085 [0,1,0,0,1,0|1,0,0]=3 1850 B15R2.562 Cc1ccccc1NCc2ccns2 Amb35742405 [0,1,0,0,1,0|1,0,0]=3 1851 B15R2.562 Cc1ccccc1NCc2ccsc2 Amb6701135 [0,1,0,0,1,0|1,0,0]=3 1852 B15R2.562 Cc1ccccc1NCc2cnco2 Amb27756776 [0,1,0,0,1,0|1,0,0]=3 1853 B15R2.562 Cc1ccccc1NCc2cncs2 Amb18996527 [0,1,0,0,1,0|1,0,0]=3 1854 B15R2.562 Cc1ccccc1NCc2csnn2 Amb9529132 [0,1,0,0,1,0|2,0,0]=4 1855 B15R2.562 Cc1ccccc1NCc2nccs2 Amb6286378 [0,1,0,0,1,0|1,0,0]=3 1856 B15R2.562 Cc1ccccc1OCc2ccno2 Amb27657027 [0,1,0,0,1,0|2,0,0]=4 1857 B15R2.562 Cc1ccccc1OCc2ccns2 Amb35650886 [0,1,0,0,1,0|2,0,0]=4 1858 B15R2.562 Cc1cccnc1NCc2cccs2 Amb5456337 [0,1,0,0,1,0|2,0,0]=4 1859 B15R2.562 Cc1cccnc1NCc2ccns2 Amb35719696 [0,1,0,0,1,0|2,0,0]=4 1860 B15R2.562 Cc1cccnc1NCc2ccoc2 Amb28183282 [0,1,0,0,1,0|2,0,0]=4 1861 B15R2.562 Cc1cccnc1NCc2ccon2 Amb27612549 [0,1,0,0,1,0|2,0,0]=4 1862 B15R2.562 Cc1cccnc1NCc2ccsc2 Amb28071952 [0,1,0,0,1,0|2,0,0]=4 1863 B15R2.562 Cc1ccncc1CNc2ccsc2 Amb27971536 [0,1,0,0,1,0|1,0,0]=3 1864 B15R2.562 Cc1ccncc1CNc2cnsc2 Amb35699653 [0,1,0,0,1,0|2,0,0]=4 1865 B15R2.562 Cc1ccncc1NCc2ccco2 Amb26590392 [0,1,0,0,1,0|2,0,0]=4 1866 B15R2.562 Cc1ccncc1NCc2cccs2 Amb27250113 [0,1,0,0,1,0|2,0,0]=4 1867 B15R2.562 Cc1ccncc1NCc2ccns2 Amb35742410 [0,1,0,0,1,0|2,0,0]=4 1868 B15R2.562 Cc1ccncc1NCc2ccoc2 Amb27983469 [0,1,0,0,1,0|2,0,0]=4 1869 B15R2.562 Cc1ccncc1NCc2ccsc2 Amb24545818 [0,1,0,0,1,0|2,0,0]=4 1870 B15R2.562 Cc1ccncc1NCc2cncs2 Amb25830787 [0,1,0,0,1,0|2,0,0]=4 1871 B15R2.562 Cc1ccncc1NCc2cscn2 Amb27392713 [0,1,0,0,1,0|2,0,0]=4 1872 B15R2.562 Cc1ccncc1NCc2nccs2 Amb28322568 [0,1,0,0,1,0|2,0,0]=4 1873 B15R2.562 Cc1cnccc1NCc2cccs2 Amb27240547 [0,1,0,0,1,0|2,0,0]=4 1874 B15R2.562 Cc1cnccc1NCc2ccns2 Amb29868152 [0,1,0,0,1,0|2,0,0]=4 1875 B15R2.562 Cc1cnccc1NCc2ccoc2 Amb27242926 [0,1,0,0,1,0|2,0,0]=4 1876 B15R2.562 Cc1cnccc1NCc2cncs2 Amb27273519 [0,1,0,0,1,0|2,0,0]=4 1877 B15R2.562 Cc1ncccc1NCc2ccco2 Amb25363561 [0,1,0,0,1,0|2,0,0]=4 1878 B15R2.562 Cc1ncccc1NCc2cccs2 Amb24526062 [0,1,0,0,1,0|2,0,0]=4 1879 B15R2.562 Cc1ncccc1NCc2ccns2 Amb35742408 [0,1,0,0,1,0|2,0,0]=4 1880 B15R2.562 Cc1ncccc1NCc2ccoc2 Amb28369524 [0,1,0,0,1,0|2,0,0]=4 1881 B15R2.562 Cc1ncccc1NCc2ccsc2 Amb26521927 [0,1,0,0,1,0|2,0,0]=4 1882 B15R2.562 Cc1ncccc1NCc2cncs2 Amb27975060 [0,1,0,0,1,0|2,0,0]=4 1883 B15R2.562 Cc1ncccc1NCc2nccs2 Amb27387361 [0,1,0,0,1,0|2,0,0]=4 1884 B15R2.562 Cc1nccnc1CNc2ccsc2 Amb35600708 [0,1,0,0,1,0|2,0,0]=4 1885 B15R2.562 Cc1nccnc1CNn2cccc2 Amb35600722 [0,1,0,0,1,0|2,0,0]=4 1886 B15R2.562 Clc1ccccc1CNn2cccc2 Amb27602928 [0,1,0,0,1,0|2,0,0]=4 1887 B15R2.562 Clc1ccccc1NCc2ccco2 Amb27790092 [0,1,0,0,1,0|1,0,0]=3 1888 B15R2.562 Clc1ccccc1NCc2ccco2 Amb534494 [0,1,0,0,1,0|1,0,0]=3 1889 B15R2.562 Clc1ccccc1NCc2cccs2 Amb4304335 [0,1,0,0,1,0|1,0,0]=3 1890 B15R2.562 Clc1ccccc1NCc2ccno2 Amb27418972 [0,1,0,0,1,0|1,0,0]=3 1891 B15R2.562 Clc1ccccc1NCc2ccns2 Amb35580043 [0,1,0,0,1,0|1,0,0]=3 1892 B15R2.562 Clc1ccccc1NCc2ccsc2 Amb6696858 [0,1,0,0,1,0|1,0,0]=3 1893 B15R2.562 Clc1ccccc1NCc2cncs2 Amb18996514 [0,1,0,0,1,0|1,0,0]=3 1894 B15R2.562 Clc1ccccc1NCc2cnns2 Amb28321205 [0,1,0,0,1,0|2,0,0]=4 1895 B15R2.562 Clc1ccccc1NCc2cnsn2 Amb27852200 [0,1,0,0,1,0|2,0,0]=4 1896 B15R2.562 Clc1ccccc1NCc2cocn2 Amb27418973 [0,1,0,0,1,0|1,0,0]=3 1897 B15R2.562 Clc1ccccc1NCc2csnn2 Amb9529101 [0,1,0,0,1,0|2,0,0]=4 1898 B15R2.562 Clc1ccccc1NCc2nccs2 Amb17343194 [0,1,0,0,1,0|1,0,0]=3 1899 B15R2.562 Clc1ccccc1OCc2ccns2 Amb35651549 [0,1,0,0,1,0|2,0,0]=4 1900 B15R2.562 Clc1ccccc1OCc2cncs2 Amb27650958 [0,1,0,0,1,0|2,0,0]=4 1901 B15R2.562 Clc1ccccc1OCc2cscn2 Amb28070599 [0,1,0,0,1,0|2,0,0]=4 1902 B15R2.562 Clc1ccccc1SCc2nccs2 Amb27866954 [0,1,0,0,1,0|2,0,0]=4 1903 B15R2.562 Clc1cccnc1NCc2ccno2 Amb27860827 [0,1,0,0,1,0|2,0,0]=4 1904 B15R2.562 Clc1cccnc1NCc2ccns2 Amb29868172 [0,1,0,0,1,0|2,0,0]=4 1905 B15R2.562 Clc1cccnc1NCc2ccoc2 Amb28062602 [0,1,0,0,1,0|2,0,0]=4 1906 B15R2.562 Clc1cccnc1NCc2ccsc2 Amb27393257 [0,1,0,0,1,0|2,0,0]=4 1907 B15R2.562 Clc1ccncc1NCc2ccns2 Amb35742379 [0,1,0,0,1,0|2,0,0]=4 1908 B15R2.562 Clc1ccncc1NCc2cnco2 Amb28325336 [0,1,0,0,1,0|2,0,0]=4 1909 B15R2.562 Clc1ccncc1NCc2cocn2 Amb27785708 [0,1,0,0,1,0|2,0,0]=4 1910 B15R2.562 Clc1cnccc1NCc2ccco2 Amb28434513 [0,1,0,0,1,0|2,0,0]=4 1911 B15R2.562 Clc1cnccc1NCc2ccno2 Amb27475945 [0,1,0,0,1,0|2,0,0]=4 1912 B15R2.562 Clc1cnccc1NCc2ccns2 Amb29868171 [0,1,0,0,1,0|2,0,0]=4 1913 B15R2.562 Clc1ncccc1CNc2ccon2 Amb27434927 [0,1,0,0,1,0|2,0,0]=4 1914 B15R2.562 Clc1ncccc1NCc2ccco2 Amb9555426 [0,1,0,0,1,0|2,0,0]=4 1915 B15R2.562 Clc1ncccc1NCc2ccns2 Amb35742391 [0,1,0,0,1,0|2,0,0]=4 1916 B15R2.562 Clc1ncccc1NCc2ccsc2 Amb9555433 [0,1,0,0,1,0|2,0,0]=4 1917 B15R2.562 Clc1ncccc1NCc2cocn2 Amb27454040 [0,1,0,0,1,0|2,0,0]=4 1918 B15R2.562 Fc1ccccc1CNc2ccsc2 Amb27668769 [0,1,0,0,1,0|2,0,0]=4 1919 B15R2.562 Fc1ccccc1NCc2ccco2 Amb6697272 [0,1,0,0,1,0|1,0,0]=3 1920 B15R2.562 Fc1ccccc1NCc2cccs2 Amb6697269 [0,1,0,0,1,0|1,0,0]=3 1921 B15R2.562 Fc1ccccc1NCc2ccns2 Amb35733213 [0,1,0,0,1,0|1,0,0]=3 1922 B15R2.562 Fc1ccccc1NCc2ccsc2 Amb6697278 [0,1,0,0,1,0|1,0,0]=3 1923 B15R2.562 Fc1ccccc1NCc2cncs2 Amb18996515 [0,1,0,0,1,0|1,0,0]=3 1924 B15R2.562 Fc1ccccc1NCc2cnns2 Amb28348828 [0,1,0,0,1,0|2,0,0]=4 1925 B15R2.562 Fc1ccccc1NCc2cscn2 Amb18972453 [0,1,0,0,1,0|1,0,0]=3 1926 B15R2.562 Fc1ccccc1NCc2nccs2 Amb17339019 [0,1,0,0,1,0|1,0,0]=3 1927 B15R2.562 Fc1ccccc1OCc2ccns2 Amb35651548 [0,1,0,0,1,0|2,0,0]=4 1928 B15R2.562 Fc1ccccc1OCc2ccsc2 Amb28456903 [0,1,0,0,1,0|2,0,0]=4 1929 B15R2.562 Fc1ccccc1SCc2nccs2 Amb28409229 [0,1,0,0,1,0|2,0,0]=4 1930 B15R2.562 Fc1cccnc1NCc2ccns2 Amb29868164 [0,1,0,0,1,0|2,0,0]=4 1931 B15R2.562 Fc1cccnc1NCc2ccon2 Amb27766875 [0,1,0,0,1,0|2,0,0]=4 1932 B15R2.562 Fc1cccnc1NCc2cscn2 Amb28140908 [0,1,0,0,1,0|2,0,0]=4 1933 B15R2.562 Fc1cnccc1NCc2ccno2 Amb35655214 [0,1,0,0,1,0|2,0,0]=4 1934 B15R2.562 Fc1cnccc1NCc2ccns2 Amb35655191 [0,1,0,0,1,0|2,0,0]=4 1935 B15R2.562 Fc1cnccc1NCc2ccon2 Amb35655213 [0,1,0,0,1,0|2,0,0]=4 1936 B15R2.562 Fc1ncccc1NCc2ccco2 Amb35725116 [0,1,0,0,1,0|2,0,0]=4 1937 B15R2.562 Fc1ncccc1NCc2cccs2 Amb35714063 [0,1,0,0,1,0|2,0,0]=4 1938 B15R2.562 Fc1ncccc1NCc2ccns2 Amb29868113 [0,1,0,0,1,0|2,0,0]=4 1939 B15R2.562 Fc1ncccc1NCc2ccoc2 Amb35725117 [0,1,0,0,1,0|2,0,0]=4 1940 B15R2.562 Fc1ncccc1NCc2ccsc2 Amb35714064 [0,1,0,0,1,0|2,0,0]=4 1941 B15R2.562 Fc1ncccc1NCc2cnco2 Amb35714032 [0,1,0,0,1,0|2,0,0]=4 1942 B15R2.562 Fc1ncccc1NCc2cncs2 Amb35714065 [0,1,0,0,1,0|2,0,0]=4 1943 B15R2.562 Fc1ncccc1NCc2cocn2 Amb35713919 [0,1,0,0,1,0|2,0,0]=4 1944 B15R2.562 Fc1ncccc1NCc2cscn2 Amb35714067 [0,1,0,0,1,0|2,0,0]=4 1945 B15R2.562 Fc1ncccc1NCc2nccs2 Amb35714066 [0,1,0,0,1,0|2,0,0]=4 1946 B15R2.562 Ic1ccccc1NCc2ccco2 Amb9208197 [0,1,0,0,1,0|1,0,0]=3 1947 B15R2.562 Ic1ccccc1NCc2cccs2 Amb7759831 [0,1,0,0,1,0|1,0,0]=3 1948 B15R2.562 Ic1ccccc1NCc2ccns2 Amb35730866 [0,1,0,0,1,0|1,0,0]=3 1949 B15R2.562 Ic1ccccc1NCc2ccsc2 Amb7785757 [0,1,0,0,1,0|1,0,0]=3 1950 B15R2.562 Ic1ccccc1NCc2cncs2 Amb26940273 [0,1,0,0,1,0|1,0,0]=3 1951 B15R2.562 Ic1ccccc1NCc2cnsn2 Amb27850716 [0,1,0,0,1,0|2,0,0]=4 1952 B15R2.562 Ic1ccccc1NCc2csnn2 Amb9529292 [0,1,0,0,1,0|2,0,0]=4 1953 B15R2.562 Ic1ccccc1OCc2ccns2 Amb35650194 [0,1,0,0,1,0|2,0,0]=4 1954 B15R2.562 Ic1ccccc1OCc2ccoc2 Amb27809011 [0,1,0,0,1,0|2,0,0]=4 1955 B15R2.562 Ic1ccccc1OCc2cscn2 Amb27746732 [0,1,0,0,1,0|2,0,0]=4 1956 B15R2.562 Nc1ccccc1CCc2cccs2 Amb23454504 [0,1,0,0,1,0|2,0,0]=4 1957 B15R2.562 Nc1ccccc1CCc2ncco2 Amb18863321 [0,1,0,0,1,0|2,0,0]=4 1958 B15R2.562 Nc1ccccc1CCc2nccs2 Amb18865069 [0,1,0,0,1,0|2,0,0]=4 1959 B15R2.562 Nc1ccccc1CCn2ccnc2 Amb18992146 [0,1,0,0,1,0|2,0,0]=4 1960 B15R2.562 Nc1ccccc1NCc2ccco2 Amb9205197 [0,1,0,0,1,0|1,0,0]=3 1961 B15R2.562 Nc1ccccc1NCc2ccns2 Amb35720614 [0,1,0,0,1,0|1,0,0]=3 1962 B15R2.562 Nc1ccccc1NCc2ccoc2 Amb28313820 [0,1,0,0,1,0|1,0,0]=3 1963 B15R2.562 Nc1ccccc1NCc2ccsc2 Amb28283188 [0,1,0,0,1,0|1,0,0]=3 1964 B15R2.562 Nc1ccccc1NCc2cnns2 Amb27969502 [0,1,0,0,1,0|2,0,0]=4 1965 B15R2.562 Nc1ccccc1NCc2cocn2 Amb28347133 [0,1,0,0,1,0|1,0,0]=3 1966 B15R2.562 Nc1ccccc1NCc2csnn2 Amb27787018 [0,1,0,0,1,0|2,0,0]=4 1967 B15R2.562 Nc1ccccc1NCc2nccs2 Amb18975307 [0,1,0,0,1,0|1,0,0]=3 1968 B15R2.562 Nc1ccccc1NCc2ncon2 Amb27824096 [0,1,0,0,1,0|2,0,0]=4 1969 B15R2.562 Nc1ccccc1OCc2ccco2 Amb2721772 [0,1,0,0,1,0|2,0,0]=4 1970 B15R2.562 Nc1ccccc1OCc2ccco2 Amb8503310 [0,1,0,0,1,0|2,0,0]=4 1971 B15R2.562 Nc1ccccc1OCc2cccs2 Amb5760680 [0,1,0,0,1,0|2,0,0]=4 1972 B15R2.562 Nc1ccccc1OCc2ccns2 Amb29870994 [0,1,0,0,1,0|2,0,0]=4 1973 B15R2.562 Nc1ccccc1OCc2cscn2 Amb13952144 [0,1,0,0,1,0|2,0,0]=4 1974 B15R2.562 Nc1ccccc1OCc2ncco2 Amb18863511 [0,1,0,0,1,0|2,0,0]=4 1975 B15R2.562 Nc1ccccc1OCc2nccs2 Amb18865448 [0,1,0,0,1,0|2,0,0]=4 1976 B15R2.562 Nc1ccccc1SCc2ccco2 Amb7786185 [0,1,0,0,1,0|2,0,0]=4 1977 B15R2.562 Nc1ccccc1SCc2ccns2 Amb35658632 [0,1,0,0,1,0|2,0,0]=4 1978 B15R2.562 Nc1ccccc1SCc2ccoc2 Amb27172621 [0,1,0,0,1,0|2,0,0]=4 1979 B15R2.562 Nc1ccccc1SCc2ccsc2 Amb2362038 [0,1,0,0,1,0|2,0,0]=4 1980 B15R2.562 Nc1ccccc1SCc2cscn2 Amb6746138 [0,1,0,0,1,0|2,0,0]=4 1981 B15R2.562 Nc1ccccc1SCn2cccn2 Amb27483848 [0,1,0,0,1,0|2,0,0]=4 1982 B15R2.562 Nc1cccnc1NCc2ccco2 Amb9205192 [0,1,0,0,1,0|2,0,0]=4 1983 B15R2.562 Nc1cccnc1NCc2cccs2 Amb9023560 [0,1,0,0,1,0|2,0,0]=4 1984 B15R2.562 Nc1cccnc1NCc2ccno2 Amb27390317 [0,1,0,0,1,0|2,0,0]=4 1985 B15R2.562 Nc1cccnc1NCc2ccns2 Amb35717062 [0,1,0,0,1,0|2,0,0]=4 1986 B15R2.562 Nc1cccnc1NCc2ccoc2 Amb28191130 [0,1,0,0,1,0|2,0,0]=4 1987 B15R2.562 Nc1cccnc1NCc2nccs2 Amb18974893 [0,1,0,0,1,0|2,0,0]=4 1988 B15R2.562 Nc1ccncc1CCc2cccs2 Amb28370424 [0,1,0,0,1,0|2,0,0]=4 1989 B15R2.562 Nc1ccncc1NCc2ccno2 Amb28347843 [0,1,0,0,1,0|2,0,0]=4 1990 B15R2.562 Nc1ccncc1NCc2ccns2 Amb35717063 [0,1,0,0,1,0|2,0,0]=4 1991 B15R2.562 Nc1cnccc1NCc2ccco2 Amb7767466 [0,1,0,0,1,0|2,0,0]=4 1992 B15R2.562 Nc1cnccc1NCc2cccs2 Amb9023557 [0,1,0,0,1,0|2,0,0]=4 1993 B15R2.562 Nc1cnccc1NCc2ccno2 Amb27824202 [0,1,0,0,1,0|2,0,0]=4 1994 B15R2.562 Nc1cnccc1NCc2ccns2 Amb35717060 [0,1,0,0,1,0|2,0,0]=4 1995 B15R2.562 Nc1cnccc1NCc2ccoc2 Amb27784456 [0,1,0,0,1,0|2,0,0]=4 1996 B15R2.562 Nc1ncccc1CNc2nccs2 Amb27756239 [0,1,0,0,1,0|2,0,0]=4 1997 B15R2.562 Nc1ncccc1NCc2ccno2 Amb28204521 [0,1,0,0,1,0|2,0,0]=4 1998 B15R2.562 Nc1ncccc1NCc2ccns2 Amb35717055 [0,1,0,0,1,0|2,0,0]=4 1999 B15R2.562 Nc1ncccc1NCc2nccs2 Amb27243248 [0,1,0,0,1,0|2,0,0]=4 2000 B15R2.562 Oc1ccccc1OCc2ccco2 Amb9210980 [0,1,0,0,1,0|2,0,0]=4 2001 B15R2.562 Oc1ccccc1OCc2ccno2 Amb8837320 [0,1,0,0,1,0|2,0,0]=4 2002 B15R2.562 Oc1ccccc1OCc2ccns2 Amb35673707 [0,1,0,0,1,0|2,0,0]=4 2003 B15R2.562 Oc1ccccc1OCc2ccoc2 Amb27393385 [0,1,0,0,1,0|2,0,0]=4 2004 B15R2.562 Oc1ccccc1OCc2cscn2 Amb8837313 [0,1,0,0,1,0|2,0,0]=4 2005 B15R2.562 Oc1ccccc1SCc2ccco2 Amb27663910 [0,1,0,0,1,0|2,0,0]=4 2006 B15R2.562 Oc1ccccc1SCc2cccs2 Amb27971517 [0,1,0,0,1,0|2,0,0]=4 2007 B15R2.562 Oc1ccccc1SCc2ccns2 Amb35673699 [0,1,0,0,1,0|2,0,0]=4 2008 B15R2.562 Oc1ccccc1SCc2ccsc2 Amb28131530 [0,1,0,0,1,0|2,0,0]=4 2009 B15R2.562 Oc1ccccc1SCc2cncs2 Amb27594131 [0,1,0,0,1,0|2,0,0]=4 2010 B15R2.562 Oc1ccccc1SCc2cscn2 Amb27971516 [0,1,0,0,1,0|2,0,0]=4 2011 B15R2.562 Oc1ncccc1NCc2ccco2 Amb28383060 [0,1,0,0,1,0|2,0,0]=4 2012 B15R2.562 Pc1ncccc1NCc2ccco2 Amb27387801 [0,1,0,0,1,0|2,0,0]=4 2013 B15R2.1117 Brc1cccc(CCc2ncco2)c1 Amb18228111 [0,1,0,0,1,0|2,0,0]=4 2014 B15R2.1117 Brc1cccc(CCc2nccs2)c1 Amb18885135 [0,1,0,0,1,0|2,0,0]=4 2015 B15R2.1117 Brc1cccc(CCn2cccc2)c1 Amb28382271 [0,1,0,0,1,0|2,0,0]=4 2016 B15R2.1117 Brc1cccc(CNn2cccc2)c1 Amb27387237 [0,1,0,0,1,0|2,0,0]=4 2017 B15R2.1117 Brc1cccc(NCc2ccco2)c1 Amb6696596 [0,1,0,0,1,0|1,0,0]=3 2018 B15R2.1117 Brc1cccc(NCc2ccco2)n1 Amb27236382 [0,1,0,0,1,0|2,0,0]=4 2019 B15R2.1117 Brc1cccc(NCc2cccs2)c1 Amb4418524 [0,1,0,0,1,0|1,0,0]=3 2020 B15R2.1117 Brc1cccc(NCc2ccno2)n1 Amb28187680 [0,1,0,0,1,0|2,0,0]=4 2021 B15R2.1117 Brc1cccc(NCc2ccns2)c1 Amb35742398 [0,1,0,0,1,0|1,0,0]=3 2022 B15R2.1117 Brc1cccc(NCc2ccns2)n1 Amb29868340 [0,1,0,0,1,0|2,0,0]=4 2023 B15R2.1117 Brc1cccc(NCc2ccsc2)c1 Amb6696602 [0,1,0,0,1,0|1,0,0]=3 2024 B15R2.1117 Brc1cccc(NCc2cnco2)c1 Amb27760976 [0,1,0,0,1,0|1,0,0]=3 2025 B15R2.1117 Brc1cccc(NCc2cncs2)c1 Amb26334480 [0,1,0,0,1,0|1,0,0]=3 2026 B15R2.1117 Brc1cccc(NCc2cncs2)n1 Amb28183434 [0,1,0,0,1,0|2,0,0]=4 2027 B15R2.1117 Brc1cccc(NCc2cocn2)c1 Amb27765303 [0,1,0,0,1,0|1,0,0]=3 2028 B15R2.1117 Brc1cccc(NCc2cscn2)c1 Amb27233292 [0,1,0,0,1,0|1,0,0]=3 2029 B15R2.1117 Brc1cccc(NCc2csnn2)c1 Amb9529099 [0,1,0,0,1,0|2,0,0]=4 2030 B15R2.1117 Brc1cccc(NCc2nccs2)c1 Amb17362864 [0,1,0,0,1,0|1,0,0]=3 2031 B15R2.1117 Brc1cccc(NCc2nccs2)n1 Amb28244502 [0,1,0,0,1,0|2,0,0]=4 2032 B15R2.1117 Brc1cccc(OCc2ccns2)c1 Amb35650190 [0,1,0,0,1,0|2,0,0]=4 2033 B15R2.1117 Brc1cccc(OCc2cncs2)c1 Amb28401231 [0,1,0,0,1,0|2,0,0]=4 2034 B15R2.1117 Brc1cccc(OCc2cscn2)c1 Amb6745974 [0,1,0,0,1,0|2,0,0]=4 2035 B15R2.1117 Brc1cccc(OCc2nccs2)c1 Amb27588154 [0,1,0,0,1,0|2,0,0]=4 2036 B15R2.1117 Brc1ccnc(NCc2ccco2)c1 Amb27754803 [0,1,0,0,1,0|2,0,0]=4 2037 B15R2.1117 Brc1ccnc(NCc2ccoc2)c1 Amb27425810 [0,1,0,0,1,0|2,0,0]=4 2038 B15R2.1117 Brc1cncc(CNc2cnsc2)c1 Amb35707173 [0,1,0,0,1,0|2,0,0]=4 2039 B15R2.1117 Brc1cncc(NCc2cccs2)c1 Amb27223677 [0,1,0,0,1,0|2,0,0]=4 2040 B15R2.1117 Brc1cncc(NCc2ccno2)c1 Amb28421993 [0,1,0,0,1,0|2,0,0]=4 2041 B15R2.1117 Brc1cncc(NCc2ccns2)c1 Amb35730857 [0,1,0,0,1,0|2,0,0]=4 2042 B15R2.1117 Brc1cncc(NCc2ccon2)c1 Amb27189030 [0,1,0,0,1,0|2,0,0]=4 2043 B15R2.1117 Brc1cncc(NCc2cncs2)c1 Amb27591480 [0,1,0,0,1,0|2,0,0]=4 2044 B15R2.1117 Brc1cncc(NCc2cscn2)c1 Amb27638591 [0,1,0,0,1,0|2,0,0]=4 2045 B15R2.1117 Brc1cncc(NCc2nccs2)c1 Amb27390309 [0,1,0,0,1,0|2,0,0]=4 2046 B15R2.1117 Cc1cc(NCc2ccco2)ccn1 Amb28322566 [0,1,0,0,1,0|2,0,0]=4 2047 B15R2.1117 Cc1cc(NCc2cccs2)ccn1 Amb27585583 [0,1,0,0,1,0|2,0,0]=4 2048 B15R2.1117 Cc1cc(NCc2ccno2)ccn1 Amb27824210 [0,1,0,0,1,0|2,0,0]=4 2049 B15R2.1117 Cc1cc(NCc2ccns2)ccn1 Amb29868153 [0,1,0,0,1,0|2,0,0]=4 2050 B15R2.1117 Cc1cc(NCc2cscn2)ccn1 Amb28343004 [0,1,0,0,1,0|2,0,0]=4 2051 B15R2.1117 Cc1cccc(CCc2cnco2)c1 Amb35647914 [0,1,0,0,1,0|2,0,0]=4 2052 B15R2.1117 Cc1cccc(CNc2ccsc2)c1 Amb27483765 [0,1,0,0,1,0|2,0,0]=4 2053 B15R2.1117 Cc1cccc(NCc2ccco2)c1 Amb6684426 [0,1,0,0,1,0|1,0,0]=3 2054 B15R2.1117 Cc1cccc(NCc2cccs2)c1 Amb6684423 [0,1,0,0,1,0|1,0,0]=3 2055 B15R2.1117 Cc1cccc(NCc2ccns2)c1 Amb35742404 [0,1,0,0,1,0|1,0,0]=3 2056 B15R2.1117 Cc1cccc(NCc2ccns2)n1 Amb35719697 [0,1,0,0,1,0|2,0,0]=4 2057 B15R2.1117 Cc1cccc(NCc2ccoc2)n1 Amb27981551 [0,1,0,0,1,0|2,0,0]=4 2058 B15R2.1117 Cc1cccc(NCc2ccon2)n1 Amb27600332 [0,1,0,0,1,0|2,0,0]=4 2059 B15R2.1117 Cc1cccc(NCc2ccsc2)c1 Amb6684431 [0,1,0,0,1,0|1,0,0]=3 2060 B15R2.1117 Cc1cccc(NCc2cncs2)c1 Amb18996495 [0,1,0,0,1,0|1,0,0]=3 2061 B15R2.1117 Cc1cccc(NCc2cnsn2)c1 Amb27469074 [0,1,0,0,1,0|2,0,0]=4 2062 B15R2.1117 Cc1cccc(NCc2cscn2)c1 Amb18972442 [0,1,0,0,1,0|1,0,0]=3 2063 B15R2.1117 Cc1cccc(NCc2csnn2)c1 Amb9528974 [0,1,0,0,1,0|2,0,0]=4 2064 B15R2.1117 Cc1cccc(NCc2nccs2)c1 Amb17338178 [0,1,0,0,1,0|1,0,0]=3 2065 B15R2.1117 Cc1cccc(OCc2ccns2)c1 Amb35651514 [0,1,0,0,1,0|2,0,0]=4 2066 B15R2.1117 Cc1ccnc(NCc2ccco2)c1 Amb18979506 [0,1,0,0,1,0|2,0,0]=4 2067 B15R2.1117 Cc1ccnc(NCc2cccs2)c1 Amb18979505 [0,1,0,0,1,0|2,0,0]=4 2068 B15R2.1117 Cc1ccnc(NCc2ccns2)c1 Amb35719695 [0,1,0,0,1,0|2,0,0]=4 2069 B15R2.1117 Cc1ccnc(NCc2ccoc2)c1 Amb27754317 [0,1,0,0,1,0|2,0,0]=4 2070 B15R2.1117 Cc1ccnc(NCc2cocn2)c1 Amb27419142 [0,1,0,0,1,0|2,0,0]=4 2071 B15R2.1117 Cc1cncc(NCc2ccco2)c1 Amb27595412 [0,1,0,0,1,0|2,0,0]=4 2072 B15R2.1117 Cc1cncc(NCc2ccns2)c1 Amb35742407 [0,1,0,0,1,0|2,0,0]=4 2073 B15R2.1117 Cc1cncc(NCc2ccsc2)c1 Amb28291716 [0,1,0,0,1,0|2,0,0]=4 2074 B15R2.1117 Cc1cncc(NCc2cocn2)c1 Amb27211877 [0,1,0,0,1,0|2,0,0]=4 2075 B15R2.1117 Clc1cc(NCc2ccco2)ccn1 Amb27834421 [0,1,0,0,1,0|2,0,0]=4 2076 B15R2.1117 Clc1cc(NCc2cccs2)ccn1 Amb28126035 [0,1,0,0,1,0|2,0,0]=4 2077 B15R2.1117 Clc1cc(NCc2ccno2)ccn1 Amb27824332 [0,1,0,0,1,0|2,0,0]=4 2078 B15R2.1117 Clc1cc(NCc2ccns2)ccn1 Amb35742380 [0,1,0,0,1,0|2,0,0]=4 2079 B15R2.1117 Clc1cc(NCc2ccoc2)ccn1 Amb27612602 [0,1,0,0,1,0|2,0,0]=4 2080 B15R2.1117 Clc1cccc(NCc2ccco2)c1 Amb3489160 [0,1,0,0,1,0|1,0,0]=3 2081 B15R2.1117 Clc1cccc(NCc2ccco2)n1 Amb21958907 [0,1,0,0,1,0|2,0,0]=4 2082 B15R2.1117 Clc1cccc(NCc2cccs2)c1 Amb4304339 [0,1,0,0,1,0|1,0,0]=3 2083 B15R2.1117 Clc1cccc(NCc2ccno2)c1 Amb27419106 [0,1,0,0,1,0|1,0,0]=3 2084 B15R2.1117 Clc1cccc(NCc2ccns2)c1 Amb35580045 [0,1,0,0,1,0|1,0,0]=3 2085 B15R2.1117 Clc1cccc(NCc2ccns2)n1 Amb35742390 [0,1,0,0,1,0|2,0,0]=4 2086 B15R2.1117 Clc1cccc(NCc2ccsc2)c1 Amb6695675 [0,1,0,0,1,0|1,0,0]=3 2087 B15R2.1117 Clc1cccc(NCc2cnco2)n1 Amb27172420 [0,1,0,0,1,0|2,0,0]=4 2088 B15R2.1117 Clc1cccc(NCc2cncs2)c1 Amb18996508 [0,1,0,0,1,0|1,0,0]=3 2089 B15R2.1117 Clc1cccc(NCc2cnsn2)c1 Amb27449444 [0,1,0,0,1,0|2,0,0]=4 2090 B15R2.1117 Clc1cccc(NCc2cscn2)n1 Amb27410870 [0,1,0,0,1,0|2,0,0]=4 2091 B15R2.1117 Clc1cccc(NCc2csnn2)c1 Amb9529092 [0,1,0,0,1,0|2,0,0]=4 2092 B15R2.1117 Clc1cccc(NCc2nccs2)c1 Amb17343195 [0,1,0,0,1,0|1,0,0]=3 2093 B15R2.1117 Clc1cccc(NCc2ncno2)c1 Amb18290401 [0,1,0,0,1,0|2,0,0]=4 2094 B15R2.1117 Clc1cccc(OCc2cccs2)c1 Amb27210087 [0,1,0,0,1,0|2,0,0]=4 2095 B15R2.1117 Clc1cccc(OCc2ccns2)c1 Amb35651551 [0,1,0,0,1,0|2,0,0]=4 2096 B15R2.1117 Clc1cccc(OCc2cscn2)c1 Amb27772264 [0,1,0,0,1,0|2,0,0]=4 2097 B15R2.1117 Clc1cccc(OCc2nccs2)c1 Amb27244656 [0,1,0,0,1,0|2,0,0]=4 2098 B15R2.1117 Clc1cncc(NCc2ccco2)c1 Amb29857828 [0,1,0,0,1,0|2,0,0]=4 2099 B15R2.1117 Clc1cncc(NCc2cccs2)c1 Amb29864899 [0,1,0,0,1,0|2,0,0]=4 2100 B15R2.1117 Clc1cncc(NCc2ccns2)c1 Amb35722301 [0,1,0,0,1,0|2,0,0]=4 2101 B15R2.1117 Clc1cncc(NCc2ccoc2)c1 Amb29857829 [0,1,0,0,1,0|2,0,0]=4 2102 B15R2.1117 Clc1cncc(NCc2ccsc2)c1 Amb29864900 [0,1,0,0,1,0|2,0,0]=4 2103 B15R2.1117 Clc1cncc(NCc2cnco2)c1 Amb29857834 [0,1,0,0,1,0|2,0,0]=4 2104 B15R2.1117 Clc1cncc(NCc2cncs2)c1 Amb29864980 [0,1,0,0,1,0|2,0,0]=4 2105 B15R2.1117 Clc1cncc(NCc2cocn2)c1 Amb35732513 [0,1,0,0,1,0|2,0,0]=4 2106 B15R2.1117 Clc1cncc(NCc2cscn2)c1 Amb29864901 [0,1,0,0,1,0|2,0,0]=4 2107 B15R2.1117 Clc1cncc(NCc2nccs2)c1 Amb29864902 [0,1,0,0,1,0|2,0,0]=4 2108 B15R2.1117 Fc1cc(NCc2ccns2)ccn1 Amb29868333 [0,1,0,0,1,0|2,0,0]=4 2109 B15R2.1117 Fc1cc(NCc2ccoc2)ccn1 Amb28383233 [0,1,0,0,1,0|2,0,0]=4 2110 B15R2.1117 Fc1cc(NCc2nccs2)ccn1 Amb28075279 [0,1,0,0,1,0|2,0,0]=4 2111 B15R2.1117 Fc1cccc(CNc2ccsc2)c1 Amb27246012 [0,1,0,0,1,0|2,0,0]=4 2112 B15R2.1117 Fc1cccc(NCc2ccco2)c1 Amb6695787 [0,1,0,0,1,0|1,0,0]=3 2113 B15R2.1117 Fc1cccc(NCc2ccco2)n1 Amb18973533 [0,1,0,0,1,0|2,0,0]=4 2114 B15R2.1117 Fc1cccc(NCc2cccs2)c1 Amb6695784 [0,1,0,0,1,0|1,0,0]=3 2115 B15R2.1117 Fc1cccc(NCc2cccs2)n1 Amb23606171 [0,1,0,0,1,0|2,0,0]=4 2116 B15R2.1117 Fc1cccc(NCc2ccno2)c1 Amb27659800 [0,1,0,0,1,0|1,0,0]=3 2117 B15R2.1117 Fc1cccc(NCc2ccno2)n1 Amb27824305 [0,1,0,0,1,0|2,0,0]=4 2118 B15R2.1117 Fc1cccc(NCc2ccns2)c1 Amb35733214 [0,1,0,0,1,0|1,0,0]=3 2119 B15R2.1117 Fc1cccc(NCc2ccns2)n1 Amb35720405 [0,1,0,0,1,0|2,0,0]=4 2120 B15R2.1117 Fc1cccc(NCc2ccsc2)c1 Amb6695793 [0,1,0,0,1,0|1,0,0]=3 2121 B15R2.1117 Fc1cccc(NCc2cncs2)c1 Amb18996509 [0,1,0,0,1,0|1,0,0]=3 2122 B15R2.1117 Fc1cccc(NCc2cnsn2)c1 Amb27883092 [0,1,0,0,1,0|2,0,0]=4 2123 B15R2.1117 Fc1cccc(NCc2cocn2)n1 Amb27648018 [0,1,0,0,1,0|2,0,0]=4 2124 B15R2.1117 Fc1cccc(NCc2csnn2)c1 Amb9529093 [0,1,0,0,1,0|2,0,0]=4 2125 B15R2.1117 Fc1cccc(NCc2nccs2)c1 Amb17339021 [0,1,0,0,1,0|1,0,0]=3 2126 B15R2.1117 Fc1cccc(OCc2ccns2)c1 Amb35651405 [0,1,0,0,1,0|2,0,0]=4 2127 B15R2.1117 Fc1cccc(SCc2nccs2)c1 Amb28409231 [0,1,0,0,1,0|2,0,0]=4 2128 B15R2.1117 Fc1ccnc(NCc2cccs2)c1 Amb27762341 [0,1,0,0,1,0|2,0,0]=4 2129 B15R2.1117 Fc1cncc(NCc2ccns2)c1 Amb35720422 [0,1,0,0,1,0|2,0,0]=4 2130 B15R2.1117 Fc1cncc(NCc2ccoc2)c1 Amb27658637 [0,1,0,0,1,0|2,0,0]=4 2131 B15R2.1117 Fc1cncc(NCc2cncs2)c1 Amb25712472 [0,1,0,0,1,0|2,0,0]=4 2132 B15R2.1117 Fc1cncc(NCc2cscn2)c1 Amb26654773 [0,1,0,0,1,0|2,0,0]=4 2133 B15R2.1117 Ic1cccc(NCc2ccco2)c1 Amb9208173 [0,1,0,0,1,0|1,0,0]=3 2134 B15R2.1117 Ic1cccc(NCc2cccs2)c1 Amb7760199 [0,1,0,0,1,0|1,0,0]=3 2135 B15R2.1117 Ic1cccc(NCc2ccns2)c1 Amb35730864 [0,1,0,0,1,0|1,0,0]=3 2136 B15R2.1117 Ic1cccc(NCc2ccon2)c1 Amb27750677 [0,1,0,0,1,0|1,0,0]=3 2137 B15R2.1117 Ic1cccc(NCc2ccsc2)c1 Amb7785400 [0,1,0,0,1,0|1,0,0]=3 2138 B15R2.1117 Ic1cccc(NCc2cncs2)c1 Amb26852373 [0,1,0,0,1,0|1,0,0]=3 2139 B15R2.1117 Ic1cccc(NCc2cnns2)c1 Amb27792520 [0,1,0,0,1,0|2,0,0]=4 2140 B15R2.1117 Ic1cccc(NCc2csnn2)c1 Amb9529291 [0,1,0,0,1,0|2,0,0]=4 2141 B15R2.1117 Ic1cccc(OCc2cccs2)c1 Amb27805774 [0,1,0,0,1,0|2,0,0]=4 2142 B15R2.1117 Ic1cccc(OCc2ccns2)c1 Amb35649863 [0,1,0,0,1,0|2,0,0]=4 2143 B15R2.1117 Ic1cccc(OCc2ccoc2)c1 Amb28370186 [0,1,0,0,1,0|2,0,0]=4 2144 B15R2.1117 Ic1cccc(OCc2nccs2)c1 Amb27182358 [0,1,0,0,1,0|2,0,0]=4 2145 B15R2.1117 Nc1cc(NCc2ccns2)ccn1 Amb29856255 [0,1,0,0,1,0|2,0,0]=4 2146 B15R2.1117 Nc1cc(NCc2ccoc2)ccn1 Amb28251907 [0,1,0,0,1,0|2,0,0]=4 2147 B15R2.1117 Nc1cc(NCc2ccon2)ccn1 Amb27446494 [0,1,0,0,1,0|2,0,0]=4 2148 B15R2.1117 Nc1cc(NCc2nccs2)ccn1 Amb27800537 [0,1,0,0,1,0|2,0,0]=4 2149 B15R2.1117 Nc1cccc(CCc2ncco2)c1 Amb18863322 [0,1,0,0,1,0|2,0,0]=4 2150 B15R2.1117 Nc1cccc(CCc2nccs2)c1 Amb18865070 [0,1,0,0,1,0|2,0,0]=4 2151 B15R2.1117 Nc1cccc(NCc2ccco2)c1 Amb2499904 [0,1,0,0,1,0|1,0,0]=3 2152 B15R2.1117 Nc1cccc(NCc2ccns2)c1 Amb35717058 [0,1,0,0,1,0|1,0,0]=3 2153 B15R2.1117 Nc1cccc(NCc2ccns2)n1 Amb29856256 [0,1,0,0,1,0|2,0,0]=4 2154 B15R2.1117 Nc1cccc(NCc2ccoc2)c1 Amb27788702 [0,1,0,0,1,0|1,0,0]=3 2155 B15R2.1117 Nc1cccc(NCc2cncs2)c1 Amb28134531 [0,1,0,0,1,0|1,0,0]=3 2156 B15R2.1117 Nc1cccc(NCc2cocn2)c1 Amb27216919 [0,1,0,0,1,0|1,0,0]=3 2157 B15R2.1117 Nc1cccc(NCc2cscn2)c1 Amb27395592 [0,1,0,0,1,0|1,0,0]=3 2158 B15R2.1117 Nc1cccc(NCc2csnn2)c1 Amb27618786 [0,1,0,0,1,0|2,0,0]=4 2159 B15R2.1117 Nc1cccc(OCc2ccco2)c1 Amb17131746 [0,1,0,0,1,0|2,0,0]=4 2160 B15R2.1117 Nc1cccc(OCc2ccns2)c1 Amb29870996 [0,1,0,0,1,0|2,0,0]=4 2161 B15R2.1117 Nc1cccc(OCc2cscn2)c1 Amb13952294 [0,1,0,0,1,0|2,0,0]=4 2162 B15R2.1117 Nc1cccc(OCc2ncco2)c1 Amb18863510 [0,1,0,0,1,0|2,0,0]=4 2163 B15R2.1117 Nc1cccc(OCc2nccs2)c1 Amb17101264 [0,1,0,0,1,0|2,0,0]=4 2164 B15R2.1117 Nc1cccc(SCc2ccns2)c1 Amb35658631 [0,1,0,0,1,0|2,0,0]=4 2165 B15R2.1117 Nc1cccc(SCc2cncs2)c1 Amb27947617 [0,1,0,0,1,0|2,0,0]=4 2166 B15R2.1117 Nc1cccc(SCc2nccs2)c1 Amb19882176 [0,1,0,0,1,0|2,0,0]=4 2167 B15R2.1117 Nc1ccnc(NCc2ccco2)c1 Amb17336092 [0,1,0,0,1,0|2,0,0]=4 2168 B15R2.1117 Nc1ccnc(NCc2cccs2)c1 Amb18981477 [0,1,0,0,1,0|2,0,0]=4 2169 B15R2.1117 Nc1ccnc(NCc2ccno2)c1 Amb27227588 [0,1,0,0,1,0|2,0,0]=4 2170 B15R2.1117 Nc1ccnc(NCc2ccns2)c1 Amb35717038 [0,1,0,0,1,0|2,0,0]=4 2171 B15R2.1117 Nc1ccnc(NCc2ccon2)c1 Amb28244652 [0,1,0,0,1,0|2,0,0]=4 2172 B15R2.1117 Nc1ccnc(NCc2nccs2)c1 Amb18981511 [0,1,0,0,1,0|2,0,0]=4 2173 B15R2.1117 Nc1cncc(NCc2ccns2)c1 Amb29856344 [0,1,0,0,1,0|2,0,0]=4 2174 B15R2.1117 Nc1cncc(NCc2ccon2)c1 Amb28398196 [0,1,0,0,1,0|2,0,0]=4 2175 B15R2.1117 Nc1cncc(NCc2cscn2)c1 Amb27856005 [0,1,0,0,1,0|2,0,0]=4 2176 B15R2.1117 Nc1cncc(NCc2nccs2)c1 Amb28409244 [0,1,0,0,1,0|2,0,0]=4 2177 B15R2.1117 Oc1cccc(NCc2ccns2)c1 Amb35742411 [0,1,0,0,1,0|1,0,0]=3 2178 B15R2.1117 Oc1cccc(OCc2ccns2)c1 Amb35673705 [0,1,0,0,1,0|2,0,0]=4 2179 B15R2.1117 Oc1cccc(SCc2ccns2)c1 Amb35673708 [0,1,0,0,1,0|2,0,0]=4 2180 B15R2.1117 Oc1cccc(SCc2nccs2)c1 Amb28409194 [0,1,0,0,1,0|2,0,0]=4 2181 B15R2.1259 BrC(Cc1cccs1)c2ccccc2 Amb27234315 [0,1,0,0,1,0|2,0,0]=4 2182 B15R2.1259 BrC(Cc1cccs1)c2cccnc2 Amb27657270 [0,1,0,0,1,0|2,0,0]=4 2183 B15R2.1259 BrC(Cc1ccsc1)c2ccccc2 Amb27980873 [0,1,0,0,1,0|2,0,0]=4 2184 B15R2.1259 CC(Cn1cccn1)c2ccccc2 Amb27455219 [0,1,0,0,1,0|2,0,0]=4 2185 B15R2.1259 CC(Nc1ccsc1)c2cccnc2 Amb27387418 [0,1,0,0,1,0|1,0,0]=3 2186 B15R2.1259 CC(Nc1ccsc1)c2cnccn2 Amb27387475 [0,1,0,0,1,0|2,0,0]=4 2187 B15R2.1259 CC(Nc1cnsc1)c2cccnc2 Amb35699658 [0,1,0,0,1,0|2,0,0]=4 2188 B15R2.1259 CC(Nn1cccc1)c2cnccn2 Amb27387236 [0,1,0,0,1,0|2,0,0]=4 2189 B15R2.1259 NC(Cc1ccco1)c2ccccc2 Amb5736315 [0,1,0,0,1,0|2,0,0]=4 2190 B15R2.1259 NC(Cc1cccs1)c2ccccc2 Amb5736343 [0,1,0,0,1,0|2,0,0]=4 2191 B15R2.1259 NC(Cc1cccs1)c2cccnc2 Amb18972001 [0,1,0,0,1,0|2,0,0]=4 2192 B15R2.1259 NC(Cc1cnsc1)c2ccccc2 Amb29868747 [0,1,0,0,1,0|2,0,0]=4 2193 B15R2.1259 NC(Cc1cscn1)c2ccccc2 Amb18990211 [0,1,0,0,1,0|2,0,0]=4 2194 B15R2.1259 NC(Cn1cccc1)c2ccccc2 Amb5744327 [0,1,0,0,1,0|2,0,0]=4 2195 B15R2.1259 NC(Cn1cccn1)c2ccccc2 Amb1058897 [0,1,0,0,1,0|2,0,0]=4 2196 B15R2.1259 NC(Cn1cccn1)c2ccccc2 Amb8503334 [0,1,0,0,1,0|2,0,0]=4 2197 B15R2.1259 NC(Cn1ccnc1)c2ccccc2 Amb10068905 [0,1,0,0,1,0|2,0,0]=4 2198 B15R2.1259 NC(Cn1ccnc1)c2ccccc2 Amb13948954 [0,1,0,0,1,0|2,0,0]=4 2199 B15R2.1259 NC(Cn1ccnc1)c2ccccc2 Amb9758155 [0,1,0,0,1,0|2,0,0]=4 2200 B15R2.1259 O=C(Cc1ccns1)c2ccccc2 Amb35650094 [0,1,0,0,1,0|2,0,0]=4 2201 B15R2.1259 O=C(Cc1nccs1)c2ccccc2 Amb27603054 [0,1,0,0,1,0|2,0,0]=4 2202 B15R2.1259 O=C(Cn1cccn1)c2ccccc2 Amb2408353 [0,1,0,0,1,0|2,0,0]=4 2203 B15R2.1259 O=C(Cn1ccnc1)c2ccccc2 Amb6468530 [0,1,0,0,1,0|2,0,0]=4 2204 B15R2.1259 OC(CC1=CC=CC1)c2ccccc2 Amb27389021 [0,1,0,0,1,0|1,0,1]=4 2205 B15R2.1259 OC(CC1=CCC=C1)c2ccccc2 Amb27772854 [0,1,0,0,1,0|1,0,1]=4 2206 B15R2.1259 OC(Cc1ccco1)c2cccnc2 Amb28348915 [0,1,0,0,1,0|2,0,0]=4 2207 B15R2.1259 OC(Cc1cccs1)c2ccccc2 Amb28322972 [0,1,0,0,1,0|2,0,0]=4 2208 B15R2.1259 OC(Cc1ccns1)c2ccccc2 Amb29887376 [0,1,0,0,1,0|2,0,0]=4 2209 B15R2.1259 OC(Cn1cccc1)c2ccccc2 Amb1068361 [0,1,0,0,1,0|2,0,0]=4 2210 B15R2.1259 OC(Cn1cccn1)c2ccccc2 Amb1056096 [0,1,0,0,1,0|2,0,0]=4 2211 B15R2.1259 OC(Cn1ccnc1)c2ccccc2 Amb1052934 [0,1,0,0,1,0|2,0,0]=4 2212 B15R2.1259 O[C@H](Cc1ccco1)c2ccccc2 Amb27835176 [0,1,0,0,1,0|2,0,0]=4 2213 B15R2.1259 O[C@H](Cn1ccnc1)c2ccccc2 Amb27205700 [0,1,0,0,1,0|2,0,0]=4 2214 B17R2.143 BrC(Cc1ccccc1)Cc2ccccc2 Amb17755302 [0,1,0,0,0,1|2,0,0]=4 2215 B17R2.143 CN(Cc1ccccc1)Cc2ccccc2 Amb1925683 [0,1,0,0,0,1|1,0,0]=3 2216 B17R2.143 C\C(=N/c1ccccc1)Nc2ccccc2 Amb8505021 [0,1,0,0,0,1|1,0,1]=4 2217 B17R2.143 N=C(Nc1ccccc1)Nc2ccccc2 Amb1299410 [0,1,0,0,0,1|1,0,1]=4 2218 B17R2.143 N=C(Nc1ccccc1)Nc2ccccc2 Amb22002351 [0,1,0,0,0,1|1,0,1]=4 2219 B17R2.143 NC(Cc1ccccc1)Cc2ccccc2 Amb1114019 [0,1,0,0,0,1|2,0,0]=4 2220 B17R2.143 NC(Cc1ccccc1)Cc2ccccc2 Amb2816835 [0,1,0,0,0,1|2,0,0]=4 2221 B17R2.143 NC(Cc1ccccc1)Cc2cccnc2 Amb19024201 [0,1,0,0,0,1|1,0,0]=3 2222 B17R2.143 NN(Cc1ccccc1)Cc2ccccc2 Amb6608929 [0,1,0,0,0,1|1,0,0]=3 2223 B17R2.143 N\C(=N\c1ccccc1)Nc2ccccc2 Amb22330448 [0,1,0,0,0,1|1,0,1]=4 2224 B17R2.143 O=C(Cc1ccccc1)Cc2ccccc2 Amb6354516 [0,1,0,0,0,1|2,0,0]=4 2225 B17R2.143 O=C(Cc1ccccc1)Cc2cccnc2 Amb32684178 [0,1,0,0,0,1|1,0,0]=3 2226 B17R2.143 O=C(Cc1ccccc1)Nc2ccccc2 Amb3099547 [0,1,0,0,0,1|1,0,0]=3 2227 B17R2.143 O=C(Cc1ccccc1)Nc2ccccn2 Amb6560630 [0,1,0,0,0,1|2,0,0]=4 2228 B17R2.143 O=C(Nc1ccccc1)Nc2ccccc2 Amb1245995 [0,1,0,0,0,1|1,0,1]=4 2229 B17R2.143 O=C(Nc1ccccc1)Nc2cncnc2 Amb24100163 [0,1,0,0,0,1|1,0,1]=4 2230 B17R2.143 O=C(Nc1cccnc1)Nc2cccnc2 Amb2611984 [0,1,0,0,0,1|1,0,1]=4 2231 B17R2.143 O=C(Nc1cccnc1)Oc2ccccc2 Amb1557114 [0,1,0,0,0,1|1,0,1]=4 2232 B17R2.143 O=S(Cc1ccccc1)Cc2ccccc2 Amb8387527 [0,1,0,0,0,1|2,0,0]=4 2233 B17R2.143 OC(Cc1ccccc1)Cc2ccccc2 Amb1110031 [0,1,0,0,0,1|2,0,0]=4 2234 B17R2.143 ON(Cc1ccccc1)Cc2ccccc2 Amb2226907 [0,1,0,0,0,1|1,0,0]=3 2235 B17R2.143 S=C(Nc1ccccc1)Nc2ccccc2 Amb534979 [0,1,0,0,0,1|1,0,1]=4 2236 B17R2.143 S=C(Nc1ccccc1)Nc2cccnc2 Amb1080520 [0,1,0,0,0,1|0,0,1]=3 2237 B17R2.143 SC(Cc1ccccc1)Cc2ccccc2 Amb7784708 [0,1,0,0,0,1|2,0,0]=4 2238 B17R2.143 S\C(=N\c1ccccc1)Nc2ccccc2 Amb3467091 [0,1,0,0,0,1|1,0,1]=4 2239 B17R2.143 [O-]\C(=N/c1ccccc1)Nc2ccccc2 Amb8488212 [0,1,0,0,0,1|1,0,1]=4 2240 B17R2.143 [Se]=C(Nc1ccccc1)Nc2ccccc2 Amb2704342 [0,1,0,0,0,1|1,0,1]=4 2241 B17R2.216 Brc1ccc(CNCc2ccccc2)cc1 Amb22587996 [0,1,0,0,0,1|1,0,0]=3 2242 B17R2.216 Brc1ccc(CNCc2ccccc2)cc1 Amb838866 [0,1,0,0,0,1|1,0,0]=3 2243 B17R2.216 Brc1ccc(CNCc2ccccc2)nc1 Amb27223602 [0,1,0,0,0,1|2,0,0]=4 2244 B17R2.216 Brc1ccc(CNCc2ccccn2)cc1 Amb10610049 [0,1,0,0,0,1|2,0,0]=4 2245 B17R2.216 Brc1ccc(CNCc2ccccn2)cc1 Amb6699016 [0,1,0,0,0,1|2,0,0]=4 2246 B17R2.216 Brc1ccc(CNCc2cccnc2)cc1 Amb6352451 [0,1,0,0,0,1|0,0,0]=2 2247 B17R2.216 Brc1ccc(CNCc2ccncc2)cc1 Amb6729560 [0,1,0,0,0,1|2,0,0]=4 2248 B17R2.216 Brc1ccc(COCc2ccccc2)cc1 Amb19301961 [0,1,0,0,0,1|2,0,0]=4 2249 B17R2.216 Brc1ccc(NCCc2ccccc2)cc1 Amb6696485 [0,1,0,0,0,1|1,0,0]=3 2250 B17R2.216 Brc1ccc(NCCc2ccccc2)nc1 Amb6623061 [0,1,0,0,0,1|2,0,0]=4 2251 B17R2.216 Brc1ccc(OCCc2ccccc2)cc1 Amb6649169 [0,1,0,0,0,1|2,0,0]=4 2252 B17R2.216 Cc1ccc(CCNc2ccccc2)cn1 Amb6344803 [0,1,0,0,0,1|0,0,0]=2 2253 B17R2.216 Cc1ccc(CNCc2ccccc2)cc1 Amb6687346 [0,1,0,0,0,1|1,0,0]=3 2254 B17R2.216 Cc1ccc(CNCc2ccccn2)cc1 Amb6355683 [0,1,0,0,0,1|2,0,0]=4 2255 B17R2.216 Cc1ccc(CNCc2cccnc2)cc1 Amb6355739 [0,1,0,0,0,1|0,0,0]=2 2256 B17R2.216 Cc1ccc(CNCc2ccncc2)cc1 Amb6352450 [0,1,0,0,0,1|2,0,0]=4 2257 B17R2.216 Cc1ccc(NCCc2ccccc2)cc1 Amb4358611 [0,1,0,0,0,1|1,0,0]=3 2258 B17R2.216 Clc1ccc(CCNc2cncnc2)cc1 Amb18932696 [0,1,0,0,0,1|2,0,0]=4 2259 B17R2.216 Clc1ccc(CNCc2ccccc2)cc1 Amb6364679 [0,1,0,0,0,1|1,0,0]=3 2260 B17R2.216 Clc1ccc(CNCc2ccccc2)nc1 Amb28342095 [0,1,0,0,0,1|2,0,0]=4 2261 B17R2.216 Clc1ccc(CNCc2ccccn2)cc1 Amb6699017 [0,1,0,0,0,1|2,0,0]=4 2262 B17R2.216 Clc1ccc(CNCc2cccnc2)cc1 Amb6336244 [0,1,0,0,0,1|0,0,0]=2 2263 B17R2.216 Clc1ccc(CNCc2ccncc2)cc1 Amb1923364 [0,1,0,0,0,1|2,0,0]=4 2264 B17R2.216 Clc1ccc(CSCc2ccccc2)cn1 Amb6675876 [0,1,0,0,0,1|1,0,0]=3 2265 B17R2.216 Clc1ccc(CSCc2ccccn2)cn1 Amb21984720 [0,1,0,0,0,1|2,0,0]=4 2266 B17R2.216 Clc1ccc(NCCc2ccccc2)cc1 Amb6624606 [0,1,0,0,0,1|1,0,0]=3 2267 B17R2.216 Clc1ccc(NCCc2ccccc2)nn1 Amb6645304 [0,1,0,0,0,1|2,0,0]=4 2268 B17R2.216 Clc1ccc(OCCc2ccccc2)nn1 Amb9208566 [0,1,0,0,0,1|2,0,0]=4 2269 B17R2.216 Clc1ccc(\C=N\Nc2ccccc2)cc1 Amb2703784 [0,1,0,0,0,1|1,0,1]=4 2270 B17R2.216 Fc1ccc(CNCc2ccccc2)cc1 Amb6352461 [0,1,0,0,0,1|1,0,0]=3 2271 B17R2.216 Fc1ccc(CNCc2ccccc2)cc1 Amb8468188 [0,1,0,0,0,1|1,0,0]=3 2272 B17R2.216 Fc1ccc(CNCc2ccccn2)cc1 Amb6699019 [0,1,0,0,0,1|2,0,0]=4 2273 B17R2.216 Fc1ccc(CNCc2cccnc2)cc1 Amb6355690 [0,1,0,0,0,1|0,0,0]=2 2274 B17R2.216 Fc1ccc(CNCc2ccncc2)cc1 Amb6332080 [0,1,0,0,0,1|2,0,0]=4 2275 B17R2.216 Fc1ccc(NCCc2ccccc2)cc1 Amb6696718 [0,1,0,0,0,1|1,0,0]=3 2276 B17R2.216 Ic1ccc(CNCc2ccccc2)cc1 Amb27644269 [0,1,0,0,0,1|1,0,0]=3 2277 B17R2.216 Ic1ccc(COCc2ccccc2)cc1 Amb28381491 [0,1,0,0,0,1|2,0,0]=4 2278 B17R2.216 Ic1ccc(OCCc2ccccc2)cc1 Amb20669160 [0,1,0,0,0,1|2,0,0]=4 2279 B17R2.216 Nc1ccc(CCCc2ccccc2)cc1 Amb13952637 [0,1,0,0,0,1|2,0,0]=4 2280 B17R2.216 Nc1ccc(CCOc2ccccc2)cc1 Amb9380875 [0,1,0,0,0,1|2,0,0]=4 2281 B17R2.216 Nc1ccc(COCc2ccccc2)cc1 Amb1138750 [0,1,0,0,0,1|2,0,0]=4 2282 B17R2.216 Nc1ccc(NCCc2ccccc2)cc1 Amb1103721 [0,1,0,0,0,1|1,0,0]=3 2283 B17R2.216 Nc1ccc(NCCc2ccccc2)cn1 Amb7767921 [0,1,0,0,0,1|1,0,0]=3 2284 B17R2.216 Nc1ccc(NCCc2ccccc2)nc1 Amb5786808 [0,1,0,0,0,1|2,0,0]=4 2285 B17R2.216 Nc1ccc(NCCc2ccncc2)cc1 Amb18308616 [0,1,0,0,0,1|2,0,0]=4 2286 B17R2.216 Nc1ccc(OCCc2ccccc2)cc1 Amb1112778 [0,1,0,0,0,1|2,0,0]=4 2287 B17R2.216 Nc1ccc(OCCc2cccnc2)cc1 Amb17241674 [0,1,0,0,0,1|1,0,0]=3 2288 B17R2.216 Nc1cnc(COCc2ccccc2)cn1 Amb27619126 [0,1,0,0,0,1|2,0,0]=4 2289 B17R2.216 O=C1C=CC(CNCc2ccccc2)=CN1 Amb27866225 [0,1,0,0,0,1|0,0,1]=3 2290 B17R2.216 Oc1ccc(CNCc2ccccc2)cc1 Amb6687336 [0,1,0,0,0,1|1,0,0]=3 2291 B17R2.216 Oc1ccc(CNCc2ccccn2)cc1 Amb6699014 [0,1,0,0,0,1|2,0,0]=4 2292 B17R2.216 Oc1ccc(CNCc2cccnc2)cc1 Amb6729778 [0,1,0,0,0,1|0,0,0]=2 2293 B17R2.216 Oc1ccc(CNCc2ccncc2)cc1 Amb6729559 [0,1,0,0,0,1|2,0,0]=4 2294 B17R2.216 Oc1ccc(NCCc2ccccc2)cc1 Amb33548437 [0,1,0,0,0,1|1,0,0]=3 2295 B17R2.216 Oc1ccc(NCCc2ccccc2)cc1 Amb9608650 [0,1,0,0,0,1|1,0,0]=3 2296 B17R2.216 Oc1ccc(OCCc2ccccc2)cc1 Amb9210954 [0,1,0,0,0,1|2,0,0]=4 2297 B17R2.216 Oc1ccc(\C=N\Cc2ccccc2)cc1 Amb4297814 [0,1,0,0,0,1|1,0,1]=4 2298 B17R2.2342 Br\C(=N/Nc1ccccc1)c2ccccc2 Amb10563287 [0,1,0,0,0,1|1,0,1]=4 2299 B17R2.2342 CC(CCc1ccccc1)c2ccccc2 Amb23437762 [0,1,0,0,0,1|2,0,0]=4 2300 B17R2.2342 CC(NCc1ccccc1)c2ccccc2 Amb21959684 [0,1,0,0,0,1|1,0,0]=3 2301 B17R2.2342 CC(NCc1ccccc1)c2ccccc2 Amb9743575 [0,1,0,0,0,1|1,0,0]=3 2302 B17R2.2342 CC(NCc1ccccc1)c2ccccn2 Amb9743592 [0,1,0,0,0,1|2,0,0]=4 2303 B17R2.2342 CC(NCc1ccccn1)c2ccccc2 Amb2690283 [0,1,0,0,0,1|2,0,0]=4 2304 B17R2.2342 CC(NCc1cccnc1)c2ccccc2 Amb837833 [0,1,0,0,0,1|0,0,0]=2 2305 B17R2.2342 CC(NCc1ccncc1)c2ccccc2 Amb1551290 [0,1,0,0,0,1|2,0,0]=4 2306 B17R2.2342 CC(OCc1ccccc1)c2ccccc2 Amb28141227 [0,1,0,0,0,1|2,0,0]=4 2307 B17R2.2342 CC(\C=C\c1ccccc1)c2ccccc2 Amb17673649 [0,1,0,0,0,1|2,0,0]=4 2308 B17R2.2342 CN(CCc1ccccn1)c2ccccc2 Amb24096770 [0,1,0,0,0,1|2,0,0]=4 2309 B17R2.2342 C[C@@H](NCc1ccccc1)c2ccccc2 Amb2719978 [0,1,0,0,0,1|1,0,0]=3 2310 B17R2.2342 C[C@@H](NCc1ccccc1)c2ccccc2 Amb3939870 [0,1,0,0,0,1|1,0,0]=3 2311 B17R2.2342 C[C@H](NCc1ccccc1)c2ccccc2 Amb2786750 [0,1,0,0,0,1|1,0,0]=3 2312 B17R2.2342 C[C@H](NCc1ccccc1)c2ccccc2 Amb32663250 [0,1,0,0,0,1|1,0,0]=3 2313 B17R2.2342 C\C(=N/Nc1ccccc1)c2ccccc2 Amb16225041 [0,1,0,0,0,1|1,0,1]=4 2314 B17R2.2342 ClC(\C=C\c1ccccc1)c2ccccc2 Amb24121369 [0,1,0,0,0,1|2,0,0]=4 2315 B17R2.2342 Cl\C(=N/Nc1ccccc1)c2ccccc2 Amb2780895 [0,1,0,0,0,1|1,0,1]=4 2316 B17R2.2342 Cl\C(=N\Cc1ccccc1)c2ccccc2 Amb28400953 [0,1,0,0,0,1|1,0,1]=4 2317 B17R2.2342 N=C(NCc1ccccc1)c2ccccc2 Amb23447124 [0,1,0,0,0,1|1,0,0]=3 2318 B17R2.2342 NC(CCc1ccccc1)c2ccccc2 Amb10609173 [0,1,0,0,0,1|2,0,0]=4 2319 B17R2.2342 NC(CCc1ccccc1)c2ccccc2 Amb5737005 [0,1,0,0,0,1|2,0,0]=4 2320 B17R2.2342 NC(CCc1ccccc1)c2cccnc2 Amb18303480 [0,1,0,0,0,1|1,0,0]=3 2321 B17R2.2342 NC(CCc1ccccc1)c2cnccn2 Amb18303483 [0,1,0,0,0,1|2,0,0]=4 2322 B17R2.2342 NC(CNc1ccccc1)c2ccccc2 Amb19009672 [0,1,0,0,0,1|1,0,0]=3 2323 B17R2.2342 NC(COc1ccccc1)c2ccccc2 Amb1139757 [0,1,0,0,0,1|2,0,0]=4 2324 B17R2.2342 NC(COc1ccccc1)c2ccccc2 Amb19341662 [0,1,0,0,0,1|2,0,0]=4 2325 B17R2.2342 NC(CSc1ccccc1)c2ccccc2 Amb21988447 [0,1,0,0,0,1|2,0,0]=4 2326 B17R2.2342 N[C@@H](CNc1ccccc1)c2ccccc2 Amb33838333 [0,1,0,0,0,1|1,0,0]=3 2327 B17R2.2342 N\C(=N/Cc1ccccc1)c2cccnc2 Amb21970341 [0,1,0,0,0,1|0,0,2]=4 2328 B17R2.2342 O=C(CCc1ccccc1)c2ccccc2 Amb2228399 [0,1,0,0,0,1|2,0,0]=4 2329 B17R2.2342 O=C(CCc1ccccc1)c2cccnc2 Amb17240896 [0,1,0,0,0,1|1,0,0]=3 2330 B17R2.2342 O=C(CCc1cccnc1)c2ccccc2 Amb17507860 [0,1,0,0,0,1|1,0,0]=3 2331 B17R2.2342 O=C(CNc1ccccc1)c2ccccc2 Amb32929163 [0,1,0,0,0,1|1,0,0]=3 2332 B17R2.2342 O=C(CNc1ccccc1)c2ccccc2 Amb6543315 [0,1,0,0,0,1|1,0,0]=3 2333 B17R2.2342 O=C(COc1ccccc1)c2ccccc2 Amb6360737 [0,1,0,0,0,1|2,0,0]=4 2334 B17R2.2342 O=C(CSc1ccccc1)c2ccccc2 Amb2703541 [0,1,0,0,0,1|2,0,0]=4 2335 B17R2.2342 O=C(NCc1ccccc1)c2ccccc2 Amb6339622 [0,1,0,0,0,1|1,0,0]=3 2336 B17R2.2342 O=C(NCc1ccccc1)c2ccccn2 Amb1239907 [0,1,0,0,0,1|2,0,0]=4 2337 B17R2.2342 O=C(NCc1ccccc1)c2cccnc2 Amb1195994 [0,1,0,0,0,1|0,0,1]=3 2338 B17R2.2342 O=C(NCc1ccccc1)c2ccncc2 Amb6317618 [0,1,0,0,0,1|2,0,0]=4 2339 B17R2.2342 O=C(NCc1ccccc1)c2cnccn2 Amb6879520 [0,1,0,0,0,1|1,0,1]=4 2340 B17R2.2342 O=C(NCc1ccnnc1)c2ccccc2 Amb22493904 [0,1,0,0,0,1|1,0,0]=3 2341 B17R2.2342 O=C(NCc1cnccn1)c2ccccc2 Amb32653398 [0,1,0,0,0,1|1,0,0]=3 2342 B17R2.2342 O=C(NNc1ccccc1)c2ccccc2 Amb1229298 [0,1,0,0,0,1|1,0,1]=4 2343 B17R2.2342 O=C(OCc1ccccc1)c2ccccc2 Amb4889094 [0,1,0,0,0,1|2,0,0]=4 2344 B17R2.2342 O=C(OCc1ccccc1)c2cccnc2 Amb1548203 [0,1,0,0,0,1|1,0,1]=4 2345 B17R2.2342 O=C(\C=C\c1cccnc1)c2ccccc2 Amb135551 [0,1,0,0,0,1|1,0,1]=4 2346 B17R2.2342 OC(CCc1ccccc1)c2ccccc2 Amb4019920 [0,1,0,0,0,1|2,0,0]=4 2347 B17R2.2342 OC(CNc1ccccc1)c2ccccc2 Amb17140784 [0,1,0,0,0,1|1,0,0]=3 2348 B17R2.2342 OC(CNc1ccccc1)c2ccccn2 Amb17140847 [0,1,0,0,0,1|2,0,0]=4 2349 B17R2.2342 OC(CNc1ccccc1)c2cccnc2 Amb17140848 [0,1,0,0,0,1|0,0,0]=2 2350 B17R2.2342 OC(CNc1ccccc1)c2ccncc2 Amb17140849 [0,1,0,0,0,1|2,0,0]=4 2351 B17R2.2342 OC(COc1ccccc1)c2ccccc2 Amb22479800 [0,1,0,0,0,1|2,0,0]=4 2352 B17R2.2342 OC(CSc1ccccc1)c2ccccc2 Amb21988442 [0,1,0,0,0,1|2,0,0]=4 2353 B17R2.2342 OC(\C=C\c1ccccc1)c2ccccc2 Amb5493999 [0,1,0,0,0,1|2,0,0]=4 2354 B17R2.2342 OC(\C=C\c1ccccc1)c2cccnc2 Amb23600230 [0,1,0,0,0,1|1,0,0]=3 2355 B17R2.2342 ON(\C=C\c1ccccc1)c2ccccc2 Amb17778079 [0,1,0,0,0,1|1,0,1]=4 2356 B17R2.2342 O[C@@H](CNc1ccccc1)c2ccccc2 Amb29838296 [0,1,0,0,0,1|1,0,0]=3 2357 B17R2.2342 O[C@H](CNc1ccccc1)c2ccccc2 Amb28556777 [0,1,0,0,0,1|1,0,0]=3 2358 B17R2.2342 S=C(NCc1ccccc1)c2ccccc2 Amb1212595 [0,1,0,0,0,1|1,0,0]=3 2359 B17R2.2342 S=C(NCc1ccccc1)c2ccccn2 Amb6346046 [0,1,0,0,0,1|2,0,0]=4 2360 B17R2.3956 Brc1ccccc1NCCc2ccccc2 Amb6696373 [0,1,0,0,0,1|1,0,0]=3 2361 B17R2.3956 Brc1ccccc1OCCc2ccccc2 Amb6665082 [0,1,0,0,0,1|2,0,0]=4 2362 B17R2.3956 Brc1ccccc1\C=N\Nc2ccccc2 Amb24092518 [0,1,0,0,0,1|1,0,1]=4 2363 B17R2.3956 Brc1ncccc1OCCc2ccccn2 Amb33321503 [0,1,0,0,0,1|2,0,0]=4 2364 B17R2.3956 Cc1ccccc1CNCc2ccccc2 Amb6687345 [0,1,0,0,0,1|1,0,0]=3 2365 B17R2.3956 Cc1ccccc1CNCc2ccccn2 Amb15702952 [0,1,0,0,0,1|2,0,0]=4 2366 B17R2.3956 Cc1ccccc1CNCc2ccccn2 Amb2689360 [0,1,0,0,0,1|2,0,0]=4 2367 B17R2.3956 Cc1ccccc1CNCc2cccnc2 Amb6355621 [0,1,0,0,0,1|0,0,0]=2 2368 B17R2.3956 Cc1ccccc1CNCc2ccncc2 Amb6356681 [0,1,0,0,0,1|2,0,0]=4 2369 B17R2.3956 Cc1ccccc1NCCc2ccccc2 Amb4358612 [0,1,0,0,0,1|1,0,0]=3 2370 B17R2.3956 Cc1ccccc1NCCc2ccccn2 Amb2777989 [0,1,0,0,0,1|2,0,0]=4 2371 B17R2.3956 Cc1cccnc1CNCc2ccccc2 Amb13949059 [0,1,0,0,0,1|2,0,0]=4 2372 B17R2.3956 Cc1cccnc1CNCc2ccccc2 Amb5559957 [0,1,0,0,0,1|2,0,0]=4 2373 B17R2.3956 Cc1cccnc1CNCc2cccnc2 Amb5501629 [0,1,0,0,0,1|1,0,0]=3 2374 B17R2.3956 Clc1ccccc1CNCc2ccccc2 Amb6364680 [0,1,0,0,0,1|1,0,0]=3 2375 B17R2.3956 Clc1ccccc1CNCc2ccccn2 Amb6352474 [0,1,0,0,0,1|2,0,0]=4 2376 B17R2.3956 Clc1ccccc1CNCc2cccnc2 Amb6364681 [0,1,0,0,0,1|0,0,0]=2 2377 B17R2.3956 Clc1ccccc1CNCc2ccncc2 Amb838186 [0,1,0,0,0,1|2,0,0]=4 2378 B17R2.3956 Clc1ccccc1NCCc2ccccc2 Amb6610978 [0,1,0,0,0,1|1,0,0]=3 2379 B17R2.3956 Clc1ncccc1CNCc2ccccc2 Amb25372702 [0,1,0,0,0,1|0,0,0]=2 2380 B17R2.3956 Fc1ccccc1CNCc2ccccc2 Amb6352459 [0,1,0,0,0,1|1,0,0]=3 2381 B17R2.3956 Fc1ccccc1CNCc2ccccn2 Amb6355715 [0,1,0,0,0,1|2,0,0]=4 2382 B17R2.3956 Fc1ccccc1CNCc2cccnc2 Amb6355612 [0,1,0,0,0,1|0,0,0]=2 2383 B17R2.3956 Fc1ccccc1CNCc2ccncc2 Amb6697918 [0,1,0,0,0,1|2,0,0]=4 2384 B17R2.3956 Fc1ccccc1NCCc2ccccc2 Amb6697268 [0,1,0,0,0,1|1,0,0]=3 2385 B17R2.3956 Nc1ccccc1CNCc2ccccc2 Amb19010879 [0,1,0,0,0,1|1,0,0]=3 2386 B17R2.3956 Nc1ccccc1COCc2ccccc2 Amb6244669 [0,1,0,0,0,1|2,0,0]=4 2387 B17R2.3956 Nc1ccccc1NCCc2ccccc2 Amb1103711 [0,1,0,0,0,1|1,0,0]=3 2388 B17R2.3956 Nc1ccccc1NCCc2ccccc2 Amb2603080 [0,1,0,0,0,1|1,0,0]=3 2389 B17R2.3956 Nc1ccccc1NCCc2ccccn2 Amb7767418 [0,1,0,0,0,1|2,0,0]=4 2390 B17R2.3956 Nc1ccccc1NCCc2ccncc2 Amb19009293 [0,1,0,0,0,1|2,0,0]=4 2391 B17R2.3956 Nc1ccccc1NNCc2ccccc2 Amb27248419 [0,1,0,0,0,1|1,0,0]=3 2392 B17R2.3956 Nc1ccccc1OCCc2ccccc2 Amb1112568 [0,1,0,0,0,1|2,0,0]=4 2393 B17R2.3956 Nc1ccccc1\C=N\Nc2ccccc2 Amb20665806 [0,1,0,0,0,1|1,0,1]=4 2394 B17R2.3956 Nc1cccnc1NCCc2ccccc2 Amb7767925 [0,1,0,0,0,1|2,0,0]=4 2395 B17R2.3956 Nc1ccncc1CNCc2ccccc2 Amb27969199 [0,1,0,0,0,1|0,0,0]=2 2396 B17R2.3956 Nc1cnccc1CNCc2ccccc2 Amb22751233 [0,1,0,0,0,1|2,0,0]=4 2397 B17R2.3956 Nc1cnccc1NCCc2ccccc2 Amb24077828 [0,1,0,0,0,1|2,0,0]=4 2398 B17R2.3956 Nc1cnccc1NCCc2ccccc2 Amb7767920 [0,1,0,0,0,1|2,0,0]=4 2399 B17R2.3956 Nc1ncccc1OCCc2ccccc2 Amb7787280 [0,1,0,0,0,1|1,0,0]=3 2400 B17R2.3956 Oc1ccccc1CNCc2ccccc2 Amb2781942 [0,1,0,0,0,1|1,0,0]=3 2401 B17R2.3956 Oc1ccccc1CNCc2ccccn2 Amb33527557 [0,1,0,0,0,1|2,0,0]=4 2402 B17R2.3956 Oc1ccccc1CNCc2cccnc2 Amb6729815 [0,1,0,0,0,1|0,0,0]=2 2403 B17R2.3956 Oc1ccccc1CNCc2ccncc2 Amb6729601 [0,1,0,0,0,1|2,0,0]=4 2404 B17R2.3956 Oc1ccccc1COCc2ccccc2 Amb27859423 [0,1,0,0,0,1|2,0,0]=4 2405 B17R2.3956 Oc1ccccc1C\C=C\c2ccccc2 Amb1806020 [0,1,0,0,0,1|2,0,0]=4 2406 B17R2.3956 Oc1ccccc1OCCc2ccccc2 Amb9210976 [0,1,0,0,0,1|2,0,0]=4 2407 B17R2.3956 Oc1ccccc1\C=N\Cc2ccccc2 Amb576127 [0,1,0,0,0,1|1,0,1]=4 2408 B17R2.3956 Oc1ccccc1\C=N\Nc2ccccc2 Amb6538801 [0,1,0,0,0,1|1,0,1]=4 2409 B17R2.5301 Brc1cccc(CNCc2ccccc2)c1 Amb22588026 [0,1,0,0,0,1|1,0,0]=3 2410 B17R2.5301 Brc1cccc(CNCc2ccccc2)c1 Amb6687338 [0,1,0,0,0,1|1,0,0]=3 2411 B17R2.5301 Brc1cccc(CNCc2ccccc2)n1 Amb28422591 [0,1,0,0,0,1|2,0,0]=4 2412 B17R2.5301 Brc1cccc(CNCc2ccccn2)c1 Amb6456043 [0,1,0,0,0,1|2,0,0]=4 2413 B17R2.5301 Brc1cccc(CNCc2cccnc2)c1 Amb837881 [0,1,0,0,0,1|0,0,0]=2 2414 B17R2.5301 Brc1cccc(CNCc2ccncc2)c1 Amb6465188 [0,1,0,0,0,1|2,0,0]=4 2415 B17R2.5301 Brc1cccc(NCCc2ccccc2)c1 Amb6696593 [0,1,0,0,0,1|1,0,0]=3 2416 B17R2.5301 Brc1cccc(OCCc2ccccc2)c1 Amb6628830 [0,1,0,0,0,1|2,0,0]=4 2417 B17R2.5301 Brc1cncc(COCc2ccccc2)c1 Amb27222014 [0,1,0,0,0,1|1,0,0]=3 2418 B17R2.5301 Cc1cccc(CNCc2ccccc2)c1 Amb1833778 [0,1,0,0,0,1|1,0,0]=3 2419 B17R2.5301 Cc1cccc(CNCc2ccccc2)c1 Amb6335361 [0,1,0,0,0,1|1,0,0]=3 2420 B17R2.5301 Cc1cccc(CNCc2ccccc2)n1 Amb13949058 [0,1,0,0,0,1|2,0,0]=4 2421 B17R2.5301 Cc1cccc(CNCc2ccccc2)n1 Amb5501628 [0,1,0,0,0,1|2,0,0]=4 2422 B17R2.5301 Cc1cccc(CNCc2ccccn2)c1 Amb15702953 [0,1,0,0,0,1|2,0,0]=4 2423 B17R2.5301 Cc1cccc(CNCc2ccccn2)c1 Amb6699029 [0,1,0,0,0,1|2,0,0]=4 2424 B17R2.5301 Cc1cccc(CNCc2cccnc2)c1 Amb6355622 [0,1,0,0,0,1|0,0,0]=2 2425 B17R2.5301 Cc1cccc(CNCc2ccncc2)c1 Amb6728547 [0,1,0,0,0,1|2,0,0]=4 2426 B17R2.5301 Cc1cccc(NCCc2ccccc2)c1 Amb6684422 [0,1,0,0,0,1|1,0,0]=3 2427 B17R2.5301 Clc1cc(CNCc2ccccc2)ccn1 Amb27750704 [0,1,0,0,0,1|2,0,0]=4 2428 B17R2.5301 Clc1cccc(CNCc2ccccc2)c1 Amb1923462 [0,1,0,0,0,1|1,0,0]=3 2429 B17R2.5301 Clc1cccc(CNCc2ccccn2)c1 Amb1838736 [0,1,0,0,0,1|2,0,0]=4 2430 B17R2.5301 Clc1cccc(CNCc2cccnc2)c1 Amb6352462 [0,1,0,0,0,1|0,0,0]=2 2431 B17R2.5301 Clc1cccc(CNCc2ccncc2)c1 Amb1923502 [0,1,0,0,0,1|2,0,0]=4 2432 B17R2.5301 Clc1cccc(NCCc2ccccc2)c1 Amb6649485 [0,1,0,0,0,1|1,0,0]=3 2433 B17R2.5301 Clc1cncc(OCCc2ccccc2)n1 Amb9208567 [0,1,0,0,0,1|2,0,0]=4 2434 B17R2.5301 Fc1cccc(CNCc2ccccc2)c1 Amb6352465 [0,1,0,0,0,1|1,0,0]=3 2435 B17R2.5301 Fc1cccc(CNCc2ccccn2)c1 Amb6699027 [0,1,0,0,0,1|2,0,0]=4 2436 B17R2.5301 Fc1cccc(NCCc2ccccc2)c1 Amb6695783 [0,1,0,0,0,1|1,0,0]=3 2437 B17R2.5301 Ic1cccc(CNCc2ccccc2)c1 Amb26550498 [0,1,0,0,0,1|1,0,0]=3 2438 B17R2.5301 Nc1cccc(CCCc2ccccc2)c1 Amb13952732 [0,1,0,0,0,1|2,0,0]=4 2439 B17R2.5301 Nc1cccc(COCc2ccccc2)c1 Amb2699336 [0,1,0,0,0,1|2,0,0]=4 2440 B17R2.5301 Nc1cccc(CSCc2ccccc2)c1 Amb6676518 [0,1,0,0,0,1|2,0,0]=4 2441 B17R2.5301 Nc1cccc(OCCc2ccccc2)c1 Amb1119309 [0,1,0,0,0,1|2,0,0]=4 2442 B17R2.5301 Nc1cccc(OCCc2ccccc2)c1 Amb2111108 [0,1,0,0,0,1|2,0,0]=4 2443 B17R2.5301 Nc1cccc(OCCc2cccnc2)c1 Amb17241675 [0,1,0,0,0,1|1,0,0]=3 2444 B17R2.5301 Nc1ccnc(NCCc2ccccc2)c1 Amb17340020 [0,1,0,0,0,1|2,0,0]=4 2445 B17R2.5301 Oc1cccc(CNCc2ccccc2)c1 Amb6687458 [0,1,0,0,0,1|1,0,0]=3 2446 B17R2.5301 Oc1cccc(CNCc2ccccn2)c1 Amb6699165 [0,1,0,0,0,1|2,0,0]=4 2447 B17R2.5301 Oc1cccc(CNCc2cccnc2)c1 Amb4552899 [0,1,0,0,0,1|0,0,0]=2 2448 B17R2.5301 Oc1cccc(CNCc2ccncc2)c1 Amb6729691 [0,1,0,0,0,1|2,0,0]=4 2449 B17R2.5301 Oc1cccc(OCCc2ccccc2)c1 Amb8837429 [0,1,0,0,0,1|2,0,0]=4 2450 B17R2.5301 Oc1cccc(\C=N\Cc2ccccc2)c1 Amb8485956 [0,1,0,0,0,1|1,0,1]=4 2451 B17R2.3395 O=C1C=CC=CC=C1NCc2ccccc2 Amb21913360 [0,1,0,0,0,1|1,0,0]=3 2452 B17R2.3395 S=C1C=CC=CC=C1NCc2ccccc2 Amb21867642 [0,1,0,0,0,1|1,0,0]=3 2453 B17R2.24159 O=C1C=CC=C(NCc2ccccc2)C=C1 Amb28192628 [0,1,0,0,0,1|1,0,0]=3 2454 B17R2.262 BrCc1ccccc1OCc2ccccc2 Amb2695510 [0,2,0,0,0,0|2,0,0]=4 2455 B17R2.262 C#Cc1ccccc1OCc2ccccc2 Amb33080652 [0,2,0,0,0,0|2,0,0]=4 2456 B17R2.262 C=Cc1ccccc1OCc2ccccc2 Amb33080692 [0,2,0,0,0,0|2,0,0]=4 2457 B17R2.262 CCc1ccccc1NCc2ccccc2 Amb6698997 [0,2,0,0,0,0|1,0,0]=3 2458 B17R2.262 CCc1ncccc1CCc2ccccn2 Amb24083995 [0,2,0,0,0,0|2,0,0]=4 2459 B17R2.262 CNc1ccccc1OCc2ccccc2 Amb20138963 [0,2,0,0,0,0|2,0,0]=4 2460 B17R2.262 CNc1ccccc1OCc2ccccc2 Amb32655949 [0,2,0,0,0,0|2,0,0]=4 2461 B17R2.262 CNc1cccnc1NCc2ccccc2 Amb27967248 [0,2,0,0,0,0|2,0,0]=4 2462 B17R2.262 COc1ccccc1CNc2ccccc2 Amb1845980 [0,2,0,0,0,0|1,0,0]=3 2463 B17R2.262 COc1ccccc1CNc2ccccc2 Amb22291620 [0,2,0,0,0,0|1,0,0]=3 2464 B17R2.262 COc1ccccc1CNc2ccccn2 Amb6611074 [0,2,0,0,0,0|2,0,0]=4 2465 B17R2.262 COc1ccccc1NCc2ccccc2 Amb838890 [0,2,0,0,0,0|1,0,0]=3 2466 B17R2.262 COc1ccccc1NCc2ccccn2 Amb6688455 [0,2,0,0,0,0|2,0,0]=4 2467 B17R2.262 COc1ccccc1NCc2cccnc2 Amb6688335 [0,2,0,0,0,0|0,0,0]=2 2468 B17R2.262 COc1ccccc1NCc2ccncc2 Amb6688339 [0,2,0,0,0,0|2,0,0]=4 2469 B17R2.262 COc1ncccc1OCc2ccccc2 Amb25047515 [0,2,0,0,0,0|2,0,0]=4 2470 B17R2.262 CSc1ccccc1NCc2ccccc2 Amb928267 [0,2,0,0,0,0|1,0,0]=3 2471 B17R2.262 ClCc1ccccc1OCc2ccccc2 Amb6659077 [0,2,0,0,0,0|2,0,0]=4 2472 B17R2.262 ClCc1ccccc1SCc2ccccc2 Amb32789705 [0,2,0,0,0,0|2,0,0]=4 2473 B17R2.262 N#Cc1ccccc1COc2ccccc2 Amb270391 [0,2,0,0,0,0|2,0,0]=4 2474 B17R2.262 N#Cc1ccccc1NCc2ccccc2 Amb6359194 [0,2,0,0,0,0|1,0,0]=3 2475 B17R2.262 N#Cc1ccccc1NCc2ccncc2 Amb6696037 [0,2,0,0,0,0|2,0,0]=4 2476 B17R2.262 N#Cc1ccccc1OCc2ccccc2 Amb3992454 [0,2,0,0,0,0|2,0,0]=4 2477 B17R2.262 N#Cc1cccnc1NCc2ccccc2 Amb2182795 [0,2,0,0,0,0|2,0,0]=4 2478 B17R2.262 N#Cc1cccnc1NCc2cccnc2 Amb1914872 [0,2,0,0,0,0|1,0,0]=3 2479 B17R2.262 N#Cc1ccncc1OCc2ccccc2 Amb18131180 [0,2,0,0,0,0|2,0,0]=4 2480 B17R2.262 N#Cc1ncccc1OCc2ccccc2 Amb21857570 [0,2,0,0,0,0|2,0,0]=4 2481 B17R2.262 NCc1ccccc1COc2ccccc2 Amb1230543 [0,2,0,0,0,0|2,0,0]=4 2482 B17R2.262 NCc1ccccc1COc2ccccc2 Amb6892759 [0,2,0,0,0,0|2,0,0]=4 2483 B17R2.262 NCc1ccccc1NCc2ccccc2 Amb5786769 [0,2,0,0,0,0|1,0,0]=3 2484 B17R2.262 NCc1ccccc1OCc2ccccc2 Amb10201449 [0,2,0,0,0,0|2,0,0]=4 2485 B17R2.262 NCc1ccccc1OCc2ccccc2 Amb1111634 [0,2,0,0,0,0|2,0,0]=4 2486 B17R2.262 NCc1ccccc1OCc2cccnc2 Amb1113479 [0,2,0,0,0,0|1,0,0]=3 2487 B17R2.262 NCc1cccnc1NCc2ccccc2 Amb17205196 [0,2,0,0,0,0|2,0,0]=4 2488 B17R2.262 NCc1cccnc1NCc2cccnc2 Amb17241707 [0,2,0,0,0,0|1,0,0]=3 2489 B17R2.262 NCc1ccncc1OCc2ccccc2 Amb23598340 [0,2,0,0,0,0|2,0,0]=4 2490 B17R2.262 NNc1ccccc1OCc2ccccc2 Amb1771530 [0,2,0,0,0,0|2,0,0]=4 2491 B17R2.262 NNc1ccccc1OCc2ccccc2 Amb2234786 [0,2,0,0,0,0|2,0,0]=4 2492 B17R2.262 NNc1ncccc1OCc2ccccc2 Amb17207279 [0,2,0,0,0,0|2,0,0]=4 2493 B17R2.262 O=Cc1ccccc1CCc2ccccc2 Amb24081218 [0,2,0,0,0,0|2,0,0]=4 2494 B17R2.262 O=Cc1ccccc1COc2ccccc2 Amb2724076 [0,2,0,0,0,0|2,0,0]=4 2495 B17R2.262 O=Cc1ccccc1NCc2ccccc2 Amb27257940 [0,2,0,0,0,0|1,0,0]=3 2496 B17R2.262 O=Cc1ccccc1OCc2ccccc2 Amb1207492 [0,2,0,0,0,0|2,0,0]=4 2497 B17R2.262 O=Cc1ccccc1OCc2cccnc2 Amb1110120 [0,2,0,0,0,0|1,0,0]=3 2498 B17R2.262 O=Cc1ccccc1OCc2cnccn2 Amb17131830 [0,2,0,0,0,0|2,0,0]=4 2499 B17R2.262 O=Cc1ccccc1SCc2ccccc2 Amb9767660 [0,2,0,0,0,0|2,0,0]=4 2500 B17R2.262 O=Cc1ccncc1CCc2ccccc2 Amb18175943 [0,2,0,0,0,0|1,0,0]=3 2501 B17R2.262 OCc1ccccc1CCc2ccccc2 Amb3939372 [0,2,0,0,0,0|2,0,0]=4 2502 B17R2.262 OCc1ccccc1COc2ccccc2 Amb2724079 [0,2,0,0,0,0|2,0,0]=4 2503 B17R2.262 OCc1ccccc1NCc2ccccc2 Amb4016425 [0,2,0,0,0,0|1,0,0]=3 2504 B17R2.262 OCc1ccccc1OCc2ccccc2 Amb1110001 [0,2,0,0,0,0|2,0,0]=4 2505 B17R2.262 OCc1ccccc1SCc2ccccc2 Amb32941823 [0,2,0,0,0,0|2,0,0]=4 2506 B17R2.262 OCc1cccnc1NCc2ccccc2 Amb17241681 [0,2,0,0,0,0|2,0,0]=4 2507 B17R2.262 OCc1cccnc1NCc2cccnc2 Amb17241954 [0,2,0,0,0,0|1,0,0]=3 2508 B17R2.262 OCc1cnccc1NCc2ccccc2 Amb27455030 [0,2,0,0,0,0|2,0,0]=4 2509 B17R2.262 OCc1cncnc1NCc2cccnc2 Amb17072479 [0,2,0,0,0,0|2,0,0]=4 2510 B17R2.262 SCc1ccccc1OCc2ccccc2 Amb33080702 [0,2,0,0,0,0|2,0,0]=4 2511 B17R2.262 [C-]#[N+]c1ccccc1OCc2ccccc2 Amb3973091 [0,2,0,0,0,0|2,0,0]=4 2512 B17R2.496 Cc1ccc(CCc2ccccc2N)cc1 Amb31118103 [0,2,0,0,0,0|2,0,0]=4 2513 B17R2.496 Cc1ccc(CNc2ccccc2Br)cc1 Amb6696360 [0,2,0,0,0,0|1,0,0]=3 2514 B17R2.496 Cc1ccc(CNc2ccccc2C)cc1 Amb6701115 [0,2,0,0,0,0|1,0,0]=3 2515 B17R2.496 Cc1ccc(CNc2ccccc2Cl)cc1 Amb4313278 [0,2,0,0,0,0|1,0,0]=3 2516 B17R2.496 Cc1ccc(CNc2ccccc2F)cc1 Amb6697254 [0,2,0,0,0,0|1,0,0]=3 2517 B17R2.496 Cc1ccc(CNc2ccncc2N)cc1 Amb7768064 [0,2,0,0,0,0|2,0,0]=4 2518 B17R2.496 Cc1ccc(CNc2ncccc2N)cc1 Amb7768070 [0,2,0,0,0,0|2,0,0]=4 2519 B17R2.496 Cc1ccc(COc2ccccc2N)cc1 Amb1118655 [0,2,0,0,0,0|2,0,0]=4 2520 B17R2.496 Cc1ccc(COc2cccnc2N)cc1 Amb7787279 [0,2,0,0,0,0|2,0,0]=4 2521 B17R2.496 Cc1ccc(CSc2ccccc2N)cc1 Amb2149342 [0,2,0,0,0,0|2,0,0]=4 2522 B17R2.496 Cc1ccc(CSc2ccccc2N)cc1 Amb6666827 [0,2,0,0,0,0|2,0,0]=4 2523 B17R2.496 Cc1ccc(NCc2ccccc2C)cc1 Amb4313315 [0,2,0,0,0,0|1,0,0]=3 2524 B17R2.496 Cc1ccc(NCc2ccccc2Cl)cc1 Amb4313407 [0,2,0,0,0,0|1,0,0]=3 2525 B17R2.496 Cc1ccc(NCc2ccccc2F)cc1 Amb6700864 [0,2,0,0,0,0|1,0,0]=3 2526 B17R2.496 Cc1ccc(NCc2ccccc2O)cc1 Amb3547080 [0,2,0,0,0,0|1,0,0]=3 2527 B17R2.496 Cc1ccc(OCc2ccccc2N)cc1 Amb6249936 [0,2,0,0,0,0|2,0,0]=4 2528 B17R2.496 Cc1ccccc1CNc2ccc(Br)cc2 Amb4313324 [0,2,0,0,0,0|1,0,0]=3 2529 B17R2.496 Cc1ccccc1CNc2ccc(Cl)cc2 Amb4313319 [0,2,0,0,0,0|1,0,0]=3 2530 B17R2.496 Cc1ccccc1CNc2ccc(F)cc2 Amb4313325 [0,2,0,0,0,0|1,0,0]=3 2531 B17R2.496 Cc1ccccc1CNc2ccc(N)cn2 Amb18979477 [0,2,0,0,0,0|2,0,0]=4 2532 B17R2.496 Cc1ccccc1CNc2ccc(O)cc2 Amb9608621 [0,2,0,0,0,0|1,0,0]=3 2533 B17R2.496 Cc1ccccc1COc2ccc(N)cc2 Amb1115826 [0,2,0,0,0,0|2,0,0]=4 2534 B17R2.496 Cc1ccccc1COc2ccc(N)nc2 Amb31133492 [0,2,0,0,0,0|2,0,0]=4 2535 B17R2.496 Cc1ccccc1COc2ccc(O)cc2 Amb8837217 [0,2,0,0,0,0|2,0,0]=4 2536 B17R2.496 Cc1ccccc1CSc2ccc(N)cc2 Amb8930366 [0,2,0,0,0,0|2,0,0]=4 2537 B17R2.496 Cc1ccccc1NCc2ccc(Br)cc2 Amb838875 [0,2,0,0,0,0|1,0,0]=3 2538 B17R2.496 Cc1ccccc1NCc2ccc(Cl)cc2 Amb838876 [0,2,0,0,0,0|1,0,0]=3 2539 B17R2.496 Cc1ccccc1NCc2ccc(O)cc2 Amb3543416 [0,2,0,0,0,0|1,0,0]=3 2540 B17R2.496 Clc1ccc(CNc2ccccc2Cl)cc1 Amb10609658 [0,2,0,0,0,0|1,0,0]=3 2541 B17R2.496 Clc1ccc(CNc2ccccc2Cl)cc1 Amb4313432 [0,2,0,0,0,0|1,0,0]=3 2542 B17R2.496 Clc1ccc(COc2ccccc2Br)cc1 Amb6636192 [0,2,0,0,0,0|2,0,0]=4 2543 B17R2.496 Clc1ccc(NCc2ccccc2Cl)cc1 Amb4313411 [0,2,0,0,0,0|1,0,0]=3 2544 B17R2.496 Clc1ccc(\C=N\c2cccnc2Cl)cc1 Amb21952774 [0,2,0,0,0,0|2,0,0]=4 2545 B17R2.496 Fc1ccc(CNc2ccccc2Cl)cc1 Amb4313370 [0,2,0,0,0,0|1,0,0]=3 2546 B17R2.496 Fc1ccc(CNc2ccccc2F)cc1 Amb6697238 [0,2,0,0,0,0|1,0,0]=3 2547 B17R2.496 Fc1ccc(COc2cccnc2Cl)cc1 Amb9174211 [0,2,0,0,0,0|2,0,0]=4 2548 B17R2.496 Fc1ccc(NCc2ccccc2Cl)cc1 Amb4313417 [0,2,0,0,0,0|1,0,0]=3 2549 B17R2.496 Fc1ccc(NCc2ccccc2F)cc1 Amb6696814 [0,2,0,0,0,0|1,0,0]=3 2550 B17R2.496 Fc1ccccc1CNc2ccc(Cl)cc2 Amb6695982 [0,2,0,0,0,0|1,0,0]=3 2551 B17R2.496 Fc1ccccc1CNc2ccc(I)cc2 Amb7760851 [0,2,0,0,0,0|1,0,0]=3 2552 B17R2.496 Fc1ccccc1COc2ccc(Br)cc2 Amb6665061 [0,2,0,0,0,0|2,0,0]=4 2553 B17R2.496 Fc1ccccc1NCc2ccc(Cl)cc2 Amb6697235 [0,2,0,0,0,0|1,0,0]=3 2554 B17R2.496 Nc1ccc(COc2ccccc2Br)cc1 Amb5780590 [0,2,0,0,0,0|2,0,0]=4 2555 B17R2.496 Nc1ccc(NCc2ccccc2Br)nc1 Amb32419304 [0,2,0,0,0,0|2,0,0]=4 2556 B17R2.496 Nc1ccc(NCc2ccccc2Cl)cn1 Amb7767762 [0,2,0,0,0,0|2,0,0]=4 2557 B17R2.496 Nc1ccc(NCc2ccccc2Cl)nc1 Amb7767772 [0,2,0,0,0,0|2,0,0]=4 2558 B17R2.496 Nc1ccc(NCc2ccccc2F)cn1 Amb7768001 [0,2,0,0,0,0|2,0,0]=4 2559 B17R2.496 Nc1ccc(NCc2ccccc2F)nc1 Amb22049908 [0,2,0,0,0,0|2,0,0]=4 2560 B17R2.496 Nc1ccc(NCc2ccccc2F)nc1 Amb7768011 [0,2,0,0,0,0|2,0,0]=4 2561 B17R2.496 Nc1ccc(OCc2ccccc2Br)cn1 Amb31115819 [0,2,0,0,0,0|2,0,0]=4 2562 B17R2.496 Nc1ccc(OCc2ccccc2Cl)cc1 Amb1260935 [0,2,0,0,0,0|2,0,0]=4 2563 B17R2.496 Nc1ccc(OCc2ccccc2Cl)cc1 Amb843446 [0,2,0,0,0,0|2,0,0]=4 2564 B17R2.496 Nc1ccc(OCc2ccccc2F)cc1 Amb13951769 [0,2,0,0,0,0|2,0,0]=4 2565 B17R2.496 Nc1ccc(OCc2ccccc2F)cc1 Amb843445 [0,2,0,0,0,0|2,0,0]=4 2566 B17R2.496 Nc1ccc(OCc2ccccc2F)cn1 Amb31180740 [0,2,0,0,0,0|2,0,0]=4 2567 B17R2.496 Nc1ccc(SCc2ccccc2Cl)cc1 Amb8930398 [0,2,0,0,0,0|2,0,0]=4 2568 B17R2.496 Nc1ccc(SCc2ccccc2Cl)cn1 Amb8933207 [0,2,0,0,0,0|2,0,0]=4 2569 B17R2.496 Nc1ccc(SCc2ccccc2F)cc1 Amb8930411 [0,2,0,0,0,0|2,0,0]=4 2570 B17R2.496 Nc1ccccc1CCc2ccc(Br)cc2 Amb31122480 [0,2,0,0,0,0|2,0,0]=4 2571 B17R2.496 Nc1ccccc1CCc2ccc(Cl)cc2 Amb22011653 [0,2,0,0,0,0|2,0,0]=4 2572 B17R2.496 Nc1ccccc1CCc2ccc(F)cc2 Amb31135812 [0,2,0,0,0,0|2,0,0]=4 2573 B17R2.496 Nc1ccccc1COc2ccc(Cl)cc2 Amb6251567 [0,2,0,0,0,0|2,0,0]=4 2574 B17R2.496 Nc1ccccc1NCc2ccc(Cl)cc2 Amb7767431 [0,2,0,0,0,0|1,0,0]=3 2575 B17R2.496 Nc1ccccc1OCc2ccc(Br)cc2 Amb6243546 [0,2,0,0,0,0|2,0,0]=4 2576 B17R2.496 Nc1ccccc1OCc2ccc(Cl)cc2 Amb6660975 [0,2,0,0,0,0|2,0,0]=4 2577 B17R2.496 Nc1ccccc1OCc2ccc(F)cc2 Amb1112688 [0,2,0,0,0,0|2,0,0]=4 2578 B17R2.496 Nc1ccccc1SCc2ccc(Cl)cc2 Amb6666817 [0,2,0,0,0,0|2,0,0]=4 2579 B17R2.496 Nc1ccccc1SCc2ccc(F)cc2 Amb2092231 [0,2,0,0,0,0|2,0,0]=4 2580 B17R2.496 Nc1ccccc1SCc2ccc(F)cc2 Amb6277363 [0,2,0,0,0,0|2,0,0]=4 2581 B17R2.496 Nc1cccnc1NCc2ccc(Br)cc2 Amb32418460 [0,2,0,0,0,0|2,0,0]=4 2582 B17R2.496 Nc1cccnc1NCc2ccc(Cl)cc2 Amb7767425 [0,2,0,0,0,0|2,0,0]=4 2583 B17R2.496 Nc1cccnc1NCc2ccc(F)cc2 Amb2444863 [0,2,0,0,0,0|2,0,0]=4 2584 B17R2.496 Nc1cnccc1NCc2ccc(F)cc2 Amb7767957 [0,2,0,0,0,0|2,0,0]=4 2585 B17R2.496 Nc1ncccc1OCc2ccc(Br)cc2 Amb2436421 [0,2,0,0,0,0|2,0,0]=4 2586 B17R2.496 Nc1ncccc1OCc2ccc(Cl)cc2 Amb9208353 [0,2,0,0,0,0|2,0,0]=4 2587 B17R2.496 Nc1ncccc1OCc2ccc(F)cc2 Amb2760121 [0,2,0,0,0,0|2,0,0]=4 2588 B17R2.496 Oc1ccc(CNc2ccccc2Br)cc1 Amb6696343 [0,2,0,0,0,0|1,0,0]=3 2589 B17R2.496 Oc1ccc(CNc2ccccc2Cl)cc1 Amb6696830 [0,2,0,0,0,0|1,0,0]=3 2590 B17R2.496 Oc1ccc(CNc2ccccc2F)cc1 Amb6697231 [0,2,0,0,0,0|1,0,0]=3 2591 B17R2.496 Oc1ccc(NCc2ccccc2Cl)cc1 Amb9608606 [0,2,0,0,0,0|1,0,0]=3 2592 B17R2.496 Oc1ccc(NCc2ccccc2F)cc1 Amb9608871 [0,2,0,0,0,0|1,0,0]=3 2593 B17R2.496 Oc1ccc(OCc2ccccc2F)cc1 Amb8837259 [0,2,0,0,0,0|2,0,0]=4 2594 B17R2.496 Oc1ccccc1CNc2ccc(Br)cc2 Amb661333 [0,2,0,0,0,0|1,0,0]=3 2595 B17R2.496 Oc1ccccc1CNc2ccc(Cl)cc2 Amb1102149 [0,2,0,0,0,0|1,0,0]=3 2596 B17R2.496 Oc1ccccc1CNc2ccc(F)cc2 Amb1071431 [0,2,0,0,0,0|1,0,0]=3 2597 B17R2.496 Oc1ccccc1NCc2ccc(Cl)cc2 Amb6422819 [0,2,0,0,0,0|1,0,0]=3 2598 B17R2.496 Oc1ccccc1OCc2ccc(F)cc2 Amb8837331 [0,2,0,0,0,0|2,0,0]=4 2599 B17R2.3417 CC(Nc1ccccc1)c2ccccc2O Amb9739100 [0,2,0,0,0,0|1,0,0]=3 2600 B17R2.3417 CN(Cc1ccccc1)c2ccccc2N Amb6249827 [0,2,0,0,0,0|1,0,0]=3 2601 B17R2.3417 CN(Cc1ccccc1)c2cnccc2N Amb26386264 [0,2,0,0,0,0|2,0,0]=4 2602 B17R2.3417 CN(Cc1ccccc1)c2ncccc2N Amb6250115 [0,2,0,0,0,0|2,0,0]=4 2603 B17R2.3417 Cc1ccccc1C(=O)Nc2ccccc2 Amb1196301 [0,2,0,0,0,0|1,0,1]=4 2604 B17R2.3417 Cc1ccccc1C(N)Cc2ccccc2 Amb5736371 [0,2,0,0,0,0|2,0,0]=4 2605 B17R2.3417 Cc1ccccc1C(O)Cc2ccccc2 Amb17241190 [0,2,0,0,0,0|2,0,0]=4 2606 B17R2.3417 Cc1cccnc1N(C)Cc2ccccc2 Amb27485940 [0,2,0,0,0,0|2,0,0]=4 2607 B17R2.3417 NC(Cc1ccccc1)c2ccccc2Cl Amb5736380 [0,2,0,0,0,0|2,0,0]=4 2608 B17R2.3417 NC(Cc1ccccc1)c2ccccc2F Amb5736374 [0,2,0,0,0,0|2,0,0]=4 2609 B17R2.3417 Nc1ccccc1C(=O)Cc2ccccc2 Amb6315840 [0,2,0,0,0,0|2,0,0]=4 2610 B17R2.3417 Nc1ccccc1C(=O)Nc2ccccc2 Amb6358044 [0,2,0,0,0,0|1,0,1]=4 2611 B17R2.3417 Nc1ccccc1C(=O)Nc2cccnc2 Amb1101738 [0,2,0,0,0,0|2,0,0]=4 2612 B17R2.3417 Nc1ccccc1C(=O)Nc2cccnc2 Amb22033665 [0,2,0,0,0,0|2,0,0]=4 2613 B17R2.3417 Nc1nccnc1C(=O)Nc2ccccc2 Amb16128140 [0,2,0,0,0,0|1,0,1]=4 2614 B17R2.3417 O=C(Cc1ccccc1)c2ccccc2Br Amb3941070 [0,2,0,0,0,0|2,0,0]=4 2615 B17R2.3417 O=C(Cc1ccccc1)c2ccccc2Cl Amb6301907 [0,2,0,0,0,0|2,0,0]=4 2616 B17R2.3417 O=C(Cc1ccccc1)c2ccccc2F Amb6301905 [0,2,0,0,0,0|2,0,0]=4 2617 B17R2.3417 O=C(Cc1ccccc1)c2ccccc2I Amb6301909 [0,2,0,0,0,0|2,0,0]=4 2618 B17R2.3417 O=C(Cc1ccccc1)c2ccccc2O Amb4477031 [0,2,0,0,0,0|2,0,0]=4 2619 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2Br Amb1233982 [0,2,0,0,0,0|1,0,1]=4 2620 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2Cl Amb1571971 [0,2,0,0,0,0|1,0,1]=4 2621 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2F Amb6465778 [0,2,0,0,0,0|1,0,1]=4 2622 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2I Amb2703718 [0,2,0,0,0,0|1,0,1]=4 2623 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2O Amb264316 [0,2,0,0,0,0|1,0,1]=4 2624 B17R2.3417 O=C(Nc1ccccc1)c2cccnc2Cl Amb2433700 [0,2,0,0,0,0|0,0,1]=3 2625 B17R2.3417 O=C(Nc1cccnc1)c2ccccc2O Amb6352603 [0,2,0,0,0,0|2,0,0]=4 2626 B17R2.3417 O=C1NC=CC=C1C(=O)Nc2ccccc2 Amb19420403 [0,2,0,0,0,0|0,0,2]=4 2627 B17R2.3417 OC(Cc1ccccc1)c2ccccc2Cl Amb17250537 [0,2,0,0,0,0|2,0,0]=4 2628 B17R2.3417 OC(Cc1ccccc1)c2ccccc2F Amb17242249 [0,2,0,0,0,0|2,0,0]=4 2629 B17R2.3417 Oc1ccccc1C(O)Cc2ccccc2 Amb18657634 [0,2,0,0,0,0|2,0,0]=4 2630 B17R2.3426 CC(Nc1ccccc1N)c2ccccc2 Amb7767588 [0,2,0,0,0,0|1,0,0]=3 2631 B17R2.3426 CC(Nc1ccccc1N)c2ccccn2 Amb9385696 [0,2,0,0,0,0|2,0,0]=4 2632 B17R2.3426 CC(Nc1ccccc1N)c2cccnc2 Amb9385007 [0,2,0,0,0,0|0,0,0]=2 2633 B17R2.3426 CC(Nc1ccccc1N)c2ccncc2 Amb9385361 [0,2,0,0,0,0|2,0,0]=4 2634 B17R2.3426 CC(Nc1ncccc1N)c2ccccc2 Amb7767584 [0,2,0,0,0,0|2,0,0]=4 2635 B17R2.3426 CC(Nc1ncccc1N)c2cccnc2 Amb9385002 [0,2,0,0,0,0|1,0,0]=3 2636 B17R2.3426 CC(Nc1nccnc1Cl)c2cccnc2 Amb18981264 [0,2,0,0,0,0|2,0,0]=4 2637 B17R2.3426 CC(Oc1ccccc1N)c2ccccc2 Amb19515284 [0,2,0,0,0,0|2,0,0]=4 2638 B17R2.3426 CC(Oc1ccccc1N)c2ccccc2 Amb6676328 [0,2,0,0,0,0|2,0,0]=4 2639 B17R2.3426 CC(Oc1cccnc1N)c2ccccc2 Amb18131787 [0,2,0,0,0,0|2,0,0]=4 2640 B17R2.3426 CC(Oc1ncccc1Cl)c2cccnc2 Amb33612342 [0,2,0,0,0,0|2,0,0]=4 2641 B17R2.3426 CC(Sc1ccccc1N)c2ccccc2 Amb17305637 [0,2,0,0,0,0|2,0,0]=4 2642 B17R2.3426 CN(Cc1ccccc1N)c2ccccc2 Amb6242622 [0,2,0,0,0,0|1,0,0]=3 2643 B17R2.3426 Cc1ccccc1CC(=O)c2ccccc2 Amb6301927 [0,2,0,0,0,0|2,0,0]=4 2644 B17R2.3426 Cc1ccccc1CC(N)c2ccccc2 Amb5736397 [0,2,0,0,0,0|2,0,0]=4 2645 B17R2.3426 Cc1ccccc1CC(O)c2ccccc2 Amb17241185 [0,2,0,0,0,0|2,0,0]=4 2646 B17R2.3426 Cc1ccccc1CC(O)c2cccnc2 Amb17241426 [0,2,0,0,0,0|1,0,0]=3 2647 B17R2.3426 Cc1ccccc1NC(=O)c2ccccc2 Amb2736447 [0,2,0,0,0,0|1,0,1]=4 2648 B17R2.3426 Cc1ccccc1OC(=O)c2cccnc2 Amb2620572 [0,2,0,0,0,0|1,0,1]=4 2649 B17R2.3426 Cc1cccnc1OC(C)c2cccnc2 Amb33612268 [0,2,0,0,0,0|2,0,0]=4 2650 B17R2.3426 Cc1ccncc1NC(=O)c2ccccc2 Amb8394428 [0,2,0,0,0,0|2,0,0]=4 2651 B17R2.3426 Clc1ccccc1CC(Cl)c2ccccc2 Amb2794068 [0,2,0,0,0,0|2,0,0]=4 2652 B17R2.3426 NC(Cc1ccccc1Cl)c2ccccc2 Amb13951457 [0,2,0,0,0,0|2,0,0]=4 2653 B17R2.3426 NC(Cc1ccccc1Cl)c2ccccc2 Amb5736637 [0,2,0,0,0,0|2,0,0]=4 2654 B17R2.3426 NC(Cc1ccccc1F)c2ccccc2 Amb5736476 [0,2,0,0,0,0|2,0,0]=4 2655 B17R2.3426 Nc1ccccc1NC(=O)c2ccccc2 Amb6242079 [0,2,0,0,0,0|1,0,1]=4 2656 B17R2.3426 Nc1ccccc1NC(=O)c2cccnc2 Amb1115265 [0,2,0,0,0,0|0,0,1]=3 2657 B17R2.3426 Nc1ccccc1NC(=O)c2cnccn2 Amb33536570 [0,2,0,0,0,0|1,0,1]=4 2658 B17R2.3426 Nc1ncccc1NC(=O)c2ccccc2 Amb2612676 [0,2,0,0,0,0|2,0,0]=4 2659 B17R2.3426 O=C(CN1C=CC=NC1=O)c2ccccc2 Amb33292522 [0,2,0,0,0,0|2,0,0]=4 2660 B17R2.3426 O=C(Cc1ccccc1Br)c2ccccc2 Amb2731627 [0,2,0,0,0,0|2,0,0]=4 2661 B17R2.3426 O=C(Cc1ccccc1Cl)c2ccccc2 Amb4019024 [0,2,0,0,0,0|2,0,0]=4 2662 B17R2.3426 O=C(Cc1ccccc1F)c2ccccc2 Amb6301923 [0,2,0,0,0,0|2,0,0]=4 2663 B17R2.3426 O=C(Nc1ccccc1Br)c2cccnc2 Amb2660805 [0,2,0,0,0,0|0,0,1]=3 2664 B17R2.3426 O=C(Nc1ccccc1Cl)c2ccccc2 Amb1333810 [0,2,0,0,0,0|1,0,1]=4 2665 B17R2.3426 O=C(Nc1ccccc1I)c2ccccc2 Amb1210670 [0,2,0,0,0,0|1,0,1]=4 2666 B17R2.3426 O=C(Nc1ccccc1O)c2ccccc2 Amb6344853 [0,2,0,0,0,0|1,0,1]=4 2667 B17R2.3426 O=C(Oc1ccccc1Cl)c2cccnc2 Amb24102548 [0,2,0,0,0,0|1,0,1]=4 2668 B17R2.3426 OC(Cc1ccccc1Cl)c2ccccc2 Amb17250529 [0,2,0,0,0,0|2,0,0]=4 2669 B17R2.3426 OC(Cc1ccccc1Cl)c2cccnc2 Amb17251231 [0,2,0,0,0,0|1,0,0]=3 2670 B17R2.3426 OC(Cc1ccccc1F)c2ccccc2 Amb17242242 [0,2,0,0,0,0|2,0,0]=4 2671 B17R2.3426 OC(Cc1ccccc1F)c2cccnc2 Amb17242542 [0,2,0,0,0,0|1,0,0]=3 2672 B17R2.3426 S=C(Nc1ccccc1Cl)c2ccccc2 Amb2611263 [0,2,0,0,0,0|1,0,1]=4 2673 B17R2.3933 Cc1cccc(Br)c1NCc2ccccc2 Amb35717900 [0,2,0,0,0,0|1,0,0]=3 2674 B17R2.3933 Cc1cccc(C)c1NCc2ccccc2 Amb17140632 [0,2,0,0,0,0|1,0,0]=3 2675 B17R2.3933 Cc1cccc(C)c1NCc2ccccn2 Amb17140693 [0,2,0,0,0,0|2,0,0]=4 2676 B17R2.3933 Cc1cccc(C)c1NCc2cccnc2 Amb17140694 [0,2,0,0,0,0|0,0,0]=2 2677 B17R2.3933 Cc1cccc(C)c1NCc2ccncc2 Amb17140695 [0,2,0,0,0,0|2,0,0]=4 2678 B17R2.3933 Cc1cccc(Cl)c1OCc2ccccc2 Amb28344000 [0,2,0,0,0,0|2,0,0]=4 2679 B17R2.3933 Cc1cccc(N)c1NCc2ccccc2 Amb18131493 [0,2,0,0,0,0|1,0,0]=3 2680 B17R2.3933 Cc1cccc(N)c1OCc2ccccc2 Amb26479740 [0,2,0,0,0,0|2,0,0]=4 2681 B17R2.3933 Cc1ccnc(N)c1OCc2ccccc2 Amb18657650 [0,2,0,0,0,0|2,0,0]=4 2682 B17R2.3933 Cc1nccc(Cl)c1OCc2ccccc2 Amb22057883 [0,2,0,0,0,0|2,0,0]=4 2683 B17R2.3933 Clc1cccc(Cl)c1CNc2ccccc2 Amb837967 [0,2,0,0,0,0|1,0,0]=3 2684 B17R2.3933 Fc1cccc(Br)c1CNc2ccccc2 Amb33838477 [0,2,0,0,0,0|1,0,0]=3 2685 B17R2.3933 Fc1cccc(Cl)c1CNc2ccccc2 Amb838312 [0,2,0,0,0,0|1,0,0]=3 2686 B17R2.3933 Fc1cccc(Cl)c1CNc2ccccn2 Amb13882157 [0,2,0,0,0,0|2,0,0]=4 2687 B17R2.3933 Fc1cccc(Cl)c1CNc2ccccn2 Amb17098066 [0,2,0,0,0,0|2,0,0]=4 2688 B17R2.3933 Fc1cccc(Cl)c1NCc2ccccc2 Amb27874642 [0,2,0,0,0,0|1,0,0]=3 2689 B17R2.3933 Fc1cccc(Cl)c1OCc2ccccc2 Amb22228143 [0,2,0,0,0,0|2,0,0]=4 2690 B17R2.3933 Fc1cccc(F)c1CNc2cccnc2 Amb6686484 [0,2,0,0,0,0|2,0,0]=4 2691 B17R2.3933 Fc1cccc(F)c1NCc2ccccc2 Amb7761108 [0,2,0,0,0,0|1,0,0]=3 2692 B17R2.3933 Fc1cccc(F)c1NCc2ccccn2 Amb9207994 [0,2,0,0,0,0|2,0,0]=4 2693 B17R2.3933 Fc1cccc(F)c1NCc2cccnc2 Amb9208006 [0,2,0,0,0,0|0,0,0]=2 2694 B17R2.3933 Fc1cccc(F)c1NCc2ccncc2 Amb9203712 [0,2,0,0,0,0|2,0,0]=4 2695 B17R2.3933 Fc1cccc(F)c1OCc2ccccc2 Amb26912612 [0,2,0,0,0,0|2,0,0]=4 2696 B17R2.3933 Nc1cccc(Br)c1NCc2ccccc2 Amb35654455 [0,2,0,0,0,0|1,0,0]=3 2697 B17R2.3933 Nc1cccc(Br)c1OCc2ccccc2 Amb26380786 [0,2,0,0,0,0|2,0,0]=4 2698 B17R2.3933 Nc1cccc(Cl)c1OCc2ccccc2 Amb6676068 [0,2,0,0,0,0|2,0,0]=4 2699 B17R2.3933 Nc1cccc(Cl)c1OCc2cccnc2 Amb9773728 [0,2,0,0,0,0|1,0,0]=3 2700 B17R2.3933 Nc1cccc(F)c1OCc2ccccc2 Amb24393486 [0,2,0,0,0,0|2,0,0]=4 2701 B17R2.5121 Cc1ccccc1CCc2ccccc2C Amb2701814 [0,2,0,0,0,0|2,0,0]=4 2702 B17R2.5121 Cc1ccccc1CCc2ccccc2N Amb31118104 [0,2,0,0,0,0|2,0,0]=4 2703 B17R2.5121 Cc1ccccc1CNc2ccccc2Br Amb6696359 [0,2,0,0,0,0|1,0,0]=3 2704 B17R2.5121 Cc1ccccc1CNc2ccccc2C Amb6701114 [0,2,0,0,0,0|1,0,0]=3 2705 B17R2.5121 Cc1ccccc1CNc2ccccc2Cl Amb4313318 [0,2,0,0,0,0|1,0,0]=3 2706 B17R2.5121 Cc1ccccc1CNc2ccccc2F Amb6697253 [0,2,0,0,0,0|1,0,0]=3 2707 B17R2.5121 Cc1ccccc1CNc2ccccc2N Amb32712052 [0,2,0,0,0,0|1,0,0]=3 2708 B17R2.5121 Cc1ccccc1CNc2ncccc2N Amb18979475 [0,2,0,0,0,0|2,0,0]=4 2709 B17R2.5121 Cc1ccccc1COc2ccccc2Br Amb6613202 [0,2,0,0,0,0|2,0,0]=4 2710 B17R2.5121 Cc1ccccc1COc2ccccc2N Amb1113683 [0,2,0,0,0,0|2,0,0]=4 2711 B17R2.5121 Cc1ccccc1COc2cccnc2N Amb7787277 [0,2,0,0,0,0|2,0,0]=4 2712 B17R2.5121 Cc1ccccc1CSc2ccccc2N Amb6278456 [0,2,0,0,0,0|2,0,0]=4 2713 B17R2.5121 Cc1ccccc1NCc2ccccc2Cl Amb6701103 [0,2,0,0,0,0|1,0,0]=3 2714 B17R2.5121 Cc1ccccc1NCc2ccccc2F Amb6701225 [0,2,0,0,0,0|1,0,0]=3 2715 B17R2.5121 Cc1cnccc1NCc2ccccc2F Amb32411667 [0,2,0,0,0,0|2,0,0]=4 2716 B17R2.5121 Clc1ccccc1CNc2ccccc2Cl Amb4313410 [0,2,0,0,0,0|1,0,0]=3 2717 B17R2.5121 Fc1ccccc1CCc2ccccc2F Amb20075849 [0,2,0,0,0,0|2,0,0]=4 2718 B17R2.5121 Fc1ccccc1CNc2ccccc2Cl Amb6696912 [0,2,0,0,0,0|1,0,0]=3 2719 B17R2.5121 Fc1ccccc1CNc2ccccc2F Amb6697373 [0,2,0,0,0,0|1,0,0]=3 2720 B17R2.5121 Fc1ccccc1COc2cccnc2Cl Amb9175214 [0,2,0,0,0,0|2,0,0]=4 2721 B17R2.5121 Fc1ccccc1NCc2ccccc2Cl Amb6697232 [0,2,0,0,0,0|1,0,0]=3 2722 B17R2.5121 Nc1ccccc1CCc2ccccc2F Amb31135813 [0,2,0,0,0,0|2,0,0]=4 2723 B17R2.5121 Nc1ccccc1CCc2ccccc2N Amb17701597 [0,2,0,0,0,0|2,0,0]=4 2724 B17R2.5121 Nc1ccccc1CNc2ccccc2N Amb15695095 [0,2,0,0,0,0|1,0,0]=3 2725 B17R2.5121 Nc1ccccc1OCc2ccccc2Cl Amb6662205 [0,2,0,0,0,0|2,0,0]=4 2726 B17R2.5121 Nc1ccccc1OCc2ccccc2F Amb6248717 [0,2,0,0,0,0|2,0,0]=4 2727 B17R2.5121 Nc1ccccc1SCc2ccccc2Cl Amb2092093 [0,2,0,0,0,0|2,0,0]=4 2728 B17R2.5121 Nc1ccccc1SCc2ccccc2Cl Amb2748148 [0,2,0,0,0,0|2,0,0]=4 2729 B17R2.5121 Nc1ccccc1SCc2ccccc2F Amb2092230 [0,2,0,0,0,0|2,0,0]=4 2730 B17R2.5121 Nc1ccccc1SCc2ccccc2F Amb6281419 [0,2,0,0,0,0|2,0,0]=4 2731 B17R2.5121 Nc1cccnc1NCc2ccccc2Br Amb32418464 [0,2,0,0,0,0|2,0,0]=4 2732 B17R2.5121 Nc1cccnc1NCc2ccccc2Cl Amb7767767 [0,2,0,0,0,0|2,0,0]=4 2733 B17R2.5121 Nc1cccnc1NCc2ccccc2F Amb7768006 [0,2,0,0,0,0|2,0,0]=4 2734 B17R2.5121 Nc1cnccc1NCc2ccccc2Cl Amb7767761 [0,2,0,0,0,0|2,0,0]=4 2735 B17R2.5121 Nc1ncccc1OCc2ccccc2Br Amb9208349 [0,2,0,0,0,0|2,0,0]=4 2736 B17R2.5121 Nc1ncccc1OCc2ccccc2Cl Amb7787268 [0,2,0,0,0,0|2,0,0]=4 2737 B17R2.5121 Nc1ncccc1OCc2ccccc2F Amb7787270 [0,2,0,0,0,0|2,0,0]=4 2738 B17R2.5121 Oc1ccccc1CCc2ccccc2O Amb17595820 [0,2,0,0,0,0|2,0,0]=4 2739 B17R2.5121 Oc1ccccc1CNc2ccccc2Cl Amb2272479 [0,2,0,0,0,0|1,0,0]=3 2740 B17R2.5121 Oc1ccccc1OCc2ccccc2F Amb8837358 [0,2,0,0,0,0|2,0,0]=4 2741 B17R2.5121 [NH3+]c1ccccc1CCc2ccccc2[NH3+] Amb21947789 [0,2,0,0,0,0|2,0,0]=4 2742 B17R2.5274 Cc1c(Cl)cccc1NCc2ccccc2 Amb4313274 [0,2,0,0,0,0|1,0,0]=3 2743 B17R2.5274 Cc1c(Cl)cccc1NCc2ccccn2 Amb6689951 [0,2,0,0,0,0|2,0,0]=4 2744 B17R2.5274 Cc1c(Cl)cccc1NCc2cccnc2 Amb6689915 [0,2,0,0,0,0|0,0,0]=2 2745 B17R2.5274 Cc1c(Cl)cccc1NCc2ccncc2 Amb6689919 [0,2,0,0,0,0|2,0,0]=4 2746 B17R2.5274 Cc1c(Cl)cncc1NCc2ccccc2 Amb35706770 [0,2,0,0,0,0|2,0,0]=4 2747 B17R2.5274 Cc1c(N)cccc1COc2ccccc2 Amb9369817 [0,2,0,0,0,0|2,0,0]=4 2748 B17R2.5274 Cc1c(N)cccc1NCc2ccccc2 Amb27791510 [0,2,0,0,0,0|1,0,0]=3 2749 B17R2.5274 Cc1c(N)cccc1OCc2ccccc2 Amb2696796 [0,2,0,0,0,0|2,0,0]=4 2750 B17R2.5274 Cc1c(N)cncc1OCc2ccccc2 Amb22498581 [0,2,0,0,0,0|2,0,0]=4 2751 B17R2.5274 Cc1c(O)cccc1OCc2ccccc2 Amb8837123 [0,2,0,0,0,0|2,0,0]=4 2752 B17R2.5274 Cc1cccc(NCc2ccccc2)c1C Amb6700742 [0,2,0,0,0,0|1,0,0]=3 2753 B17R2.5274 Cc1cccc(NCc2ccccc2)c1F Amb27443455 [0,2,0,0,0,0|1,0,0]=3 2754 B17R2.5274 Cc1cccc(NCc2ccccc2)c1O Amb27798989 [0,2,0,0,0,0|1,0,0]=3 2755 B17R2.5274 Cc1cccc(NCc2ccccn2)c1C Amb6700749 [0,2,0,0,0,0|2,0,0]=4 2756 B17R2.5274 Cc1cccc(NCc2cccnc2)c1C Amb6700673 [0,2,0,0,0,0|0,0,0]=2 2757 B17R2.5274 Cc1cccc(NCc2ccncc2)c1C Amb6700678 [0,2,0,0,0,0|2,0,0]=4 2758 B17R2.5274 Cc1cccc(OCc2ccccc2)c1Br Amb26496779 [0,2,0,0,0,0|2,0,0]=4 2759 B17R2.5274 Cc1cccc(OCc2ccccc2)c1C Amb27168883 [0,2,0,0,0,0|2,0,0]=4 2760 B17R2.5274 Cc1cccc(OCc2ccccc2)c1N Amb35746349 [0,2,0,0,0,0|2,0,0]=4 2761 B17R2.5274 Cc1cccc(OCc2ccccc2)c1N Amb9296564 [0,2,0,0,0,0|2,0,0]=4 2762 B17R2.5274 Cc1ccnc(NCc2ccccc2)c1N Amb17213634 [0,2,0,0,0,0|2,0,0]=4 2763 B17R2.5274 Cc1ncnc(NCc2cccnc2)c1C Amb31201301 [0,2,0,0,0,0|2,0,0]=4 2764 B17R2.5274 Clc1c(Br)cccc1NCc2ccccc2 Amb29865339 [0,2,0,0,0,0|1,0,0]=3 2765 B17R2.5274 Clc1c(Br)cccc1OCc2ccccc2 Amb26368722 [0,2,0,0,0,0|2,0,0]=4 2766 B17R2.5274 Clc1cccc(CNc2ccccn2)c1Cl Amb17100053 [0,2,0,0,0,0|2,0,0]=4 2767 B17R2.5274 Clc1cccc(NCc2ccccc2)c1Br Amb27631219 [0,2,0,0,0,0|1,0,0]=3 2768 B17R2.5274 Clc1cccc(NCc2ccccn2)c1Cl Amb6742378 [0,2,0,0,0,0|2,0,0]=4 2769 B17R2.5274 Clc1cccc(NCc2cccnc2)c1Cl Amb6742363 [0,2,0,0,0,0|0,0,0]=2 2770 B17R2.5274 Clc1cccc(NCc2ccncc2)c1Cl Amb6742365 [0,2,0,0,0,0|2,0,0]=4 2771 B17R2.5274 Clc1cccc(OCc2ccccc2)c1Br Amb25128182 [0,2,0,0,0,0|2,0,0]=4 2772 B17R2.5274 Fc1c(Br)cccc1CNc2ccccc2 Amb33830239 [0,2,0,0,0,0|1,0,0]=3 2773 B17R2.5274 Fc1c(Br)cccc1NCc2ccccc2 Amb35615322 [0,2,0,0,0,0|1,0,0]=3 2774 B17R2.5274 Fc1cccc(COc2cccnc2)c1F Amb33549670 [0,2,0,0,0,0|2,0,0]=4 2775 B17R2.5274 NC1=C(NCc2ccccc2)C=CNC1=O Amb29853507 [0,2,0,0,0,0|2,0,0]=4 2776 B17R2.5274 Nc1c(Br)cccc1OCc2ccccc2 Amb25768799 [0,2,0,0,0,0|2,0,0]=4 2777 B17R2.5274 Nc1c(Cl)cccc1NCc2ccccc2 Amb27832180 [0,2,0,0,0,0|1,0,0]=3 2778 B17R2.5274 Nc1c(Cl)cccc1OCc2ccccc2 Amb27413374 [0,2,0,0,0,0|2,0,0]=4 2779 B17R2.5274 Nc1c(Cl)ccnc1NCc2ccccc2 Amb18625109 [0,2,0,0,0,0|2,0,0]=4 2780 B17R2.5274 Nc1c(F)cccc1OCc2ccccc2 Amb18968074 [0,2,0,0,0,0|2,0,0]=4 2781 B17R2.5274 Nc1c(O)cccc1OCc2ccccc2 Amb27446663 [0,2,0,0,0,0|2,0,0]=4 2782 B17R2.5274 Nc1cccc(OCc2ccccc2)c1Cl Amb26535046 [0,2,0,0,0,0|2,0,0]=4 2783 B17R2.5274 Nc1cccc(OCc2ccccc2)c1N Amb18657647 [0,2,0,0,0,0|2,0,0]=4 2784 B17R2.5274 Oc1cccc(NCc2ccccc2)c1O Amb27221122 [0,2,0,0,0,0|1,0,0]=3 2785 B17R2.5360 Brc1cc(I)ccc1NCc2ccccc2 Amb27637540 [0,2,0,0,0,0|1,0,0]=3 2786 B17R2.5360 Brc1cc(I)ccc1OCc2ccccc2 Amb24372146 [0,2,0,0,0,0|2,0,0]=4 2787 B17R2.5360 Brc1ccc(OCc2ccccc2)c(I)c1 Amb22755774 [0,2,0,0,0,0|2,0,0]=4 2788 B17R2.5360 Brc1nc(I)ccc1OCc2ccccc2 Amb13890032 [0,2,0,0,0,0|2,0,0]=4 2789 B17R2.5360 Cc1cc(Br)ccc1NCc2ccccc2 Amb6690052 [0,2,0,0,0,0|1,0,0]=3 2790 B17R2.5360 Cc1cc(Br)ccc1NCc2ccccn2 Amb1845947 [0,2,0,0,0,0|2,0,0]=4 2791 B17R2.5360 Cc1cc(Br)ccc1NCc2cccnc2 Amb6415356 [0,2,0,0,0,0|0,0,0]=2 2792 B17R2.5360 Cc1cc(Br)ccc1NCc2ccncc2 Amb6690001 [0,2,0,0,0,0|2,0,0]=4 2793 B17R2.5360 Cc1cc(Br)ccc1OCc2ccccc2 Amb19148837 [0,2,0,0,0,0|2,0,0]=4 2794 B17R2.5360 Cc1cc(Br)ncc1NCc2ccccc2 Amb28054208 [0,2,0,0,0,0|2,0,0]=4 2795 B17R2.5360 Cc1cc(Cl)ccc1NCc2ccccc2 Amb6641372 [0,2,0,0,0,0|1,0,0]=3 2796 B17R2.5360 Cc1cc(Cl)ccc1NCc2ccccn2 Amb6722568 [0,2,0,0,0,0|2,0,0]=4 2797 B17R2.5360 Cc1cc(Cl)ccc1NCc2cccnc2 Amb6722546 [0,2,0,0,0,0|0,0,0]=2 2798 B17R2.5360 Cc1cc(Cl)ccc1NCc2ccncc2 Amb6722549 [0,2,0,0,0,0|2,0,0]=4 2799 B17R2.5360 Cc1cc(Cl)ccc1OCc2ccccc2 Amb28344007 [0,2,0,0,0,0|2,0,0]=4 2800 B17R2.5360 Cc1cc(N)ccc1OCc2ccccc2 Amb19959348 [0,2,0,0,0,0|2,0,0]=4 2801 B17R2.5360 Cc1cc(N)ccc1OCc2ccccc2 Amb8855868 [0,2,0,0,0,0|2,0,0]=4 2802 B17R2.5360 Cc1cc(N)cnc1NCc2ccccc2 Amb17210915 [0,2,0,0,0,0|2,0,0]=4 2803 B17R2.5360 Cc1cc(O)ccc1OCc2ccccc2 Amb17200691 [0,2,0,0,0,0|2,0,0]=4 2804 B17R2.5360 Cc1ccc(CNc2ccccc2)c(C)c1 Amb6685058 [0,2,0,0,0,0|1,0,0]=3 2805 B17R2.5360 Cc1ccc(CNc2ccccn2)c(C)c1 Amb31133334 [0,2,0,0,0,0|2,0,0]=4 2806 B17R2.5360 Cc1ccc(CNc2ccncc2)c(C)c1 Amb31133335 [0,2,0,0,0,0|2,0,0]=4 2807 B17R2.5360 Cc1ccc(NCc2ccccc2)c(Br)c1 Amb6688274 [0,2,0,0,0,0|1,0,0]=3 2808 B17R2.5360 Cc1ccc(NCc2ccccc2)c(C)c1 Amb839002 [0,2,0,0,0,0|1,0,0]=3 2809 B17R2.5360 Cc1ccc(NCc2ccccc2)c(F)c1 Amb7761304 [0,2,0,0,0,0|1,0,0]=3 2810 B17R2.5360 Cc1ccc(NCc2ccccn2)c(Br)c1 Amb6688277 [0,2,0,0,0,0|2,0,0]=4 2811 B17R2.5360 Cc1ccc(NCc2ccccn2)c(C)c1 Amb6684614 [0,2,0,0,0,0|2,0,0]=4 2812 B17R2.5360 Cc1ccc(NCc2cccnc2)c(Br)c1 Amb3993496 [0,2,0,0,0,0|0,0,0]=2 2813 B17R2.5360 Cc1ccc(NCc2cccnc2)c(C)c1 Amb6684552 [0,2,0,0,0,0|0,0,0]=2 2814 B17R2.5360 Cc1ccc(NCc2ccncc2)c(Br)c1 Amb4086237 [0,2,0,0,0,0|2,0,0]=4 2815 B17R2.5360 Cc1ccc(NCc2ccncc2)c(C)c1 Amb6684556 [0,2,0,0,0,0|2,0,0]=4 2816 B17R2.5360 Cc1ccc(OCc2ccccc2)c(Br)c1 Amb6638908 [0,2,0,0,0,0|2,0,0]=4 2817 B17R2.5360 Cc1ccc(OCc2ccccc2)c(I)c1 Amb27443670 [0,2,0,0,0,0|2,0,0]=4 2818 B17R2.5360 Cc1ccc(OCc2ccccc2)c(N)c1 Amb8860093 [0,2,0,0,0,0|2,0,0]=4 2819 B17R2.5360 Cc1ccc(OCc2ccccc2)c(N)n1 Amb18296627 [0,2,0,0,0,0|2,0,0]=4 2820 B17R2.5360 Cc1ccc(OCc2cccnc2)c(N)c1 Amb17131960 [0,2,0,0,0,0|1,0,0]=3 2821 B17R2.5360 Cc1ccc(OCc2cnccn2)c(N)c1 Amb17131962 [0,2,0,0,0,0|2,0,0]=4 2822 B17R2.5360 Cc1cnc(NCc2ccccc2)c(Br)c1 Amb18888029 [0,2,0,0,0,0|2,0,0]=4 2823 B17R2.5360 Cc1cnc(NCc2ccccc2)c(N)c1 Amb17209074 [0,2,0,0,0,0|2,0,0]=4 2824 B17R2.5360 Cc1cnc(NCc2cccnc2)c(Br)c1 Amb18236085 [0,2,0,0,0,0|1,0,0]=3 2825 B17R2.5360 Cc1cnc(NCc2cccnc2)c(N)c1 Amb18866526 [0,2,0,0,0,0|1,0,0]=3 2826 B17R2.5360 Cc1nc(Br)ccc1OCc2ccccc2 Amb34911159 [0,2,0,0,0,0|2,0,0]=4 2827 B17R2.5360 Cc1nc(I)ccc1OCc2ccccc2 Amb22751362 [0,2,0,0,0,0|2,0,0]=4 2828 B17R2.5360 Clc1cc(Br)ccc1NCc2ccccc2 Amb8858616 [0,2,0,0,0,0|1,0,0]=3 2829 B17R2.5360 Clc1cc(Br)ccc1NCc2cccnc2 Amb2444216 [0,2,0,0,0,0|0,0,0]=2 2830 B17R2.5360 Clc1cc(Br)ccc1OCc2ccccc2 Amb20672006 [0,2,0,0,0,0|2,0,0]=4 2831 B17R2.5360 Clc1cc(I)ccc1OCc2ccccc2 Amb28386545 [0,2,0,0,0,0|2,0,0]=4 2832 B17R2.5360 Clc1ccc(CNc2ccccc2)c(Cl)c1 Amb3742830 [0,2,0,0,0,0|1,0,0]=3 2833 B17R2.5360 Clc1ccc(CNc2ccccn2)c(Cl)c1 Amb2382992 [0,2,0,0,0,0|2,0,0]=4 2834 B17R2.5360 Clc1ccc(NCc2ccccn2)c(Cl)c1 Amb6689980 [0,2,0,0,0,0|2,0,0]=4 2835 B17R2.5360 Clc1ccc(NCc2cccnc2)c(Cl)c1 Amb2734531 [0,2,0,0,0,0|0,0,0]=2 2836 B17R2.5360 Clc1ccc(NCc2ccncc2)c(Cl)c1 Amb6689961 [0,2,0,0,0,0|2,0,0]=4 2837 B17R2.5360 Clc1ccc(OCc2ccccc2)c(Br)c1 Amb25168726 [0,2,0,0,0,0|2,0,0]=4 2838 B17R2.5360 Clc1ccc(OCc2ccccc2)c(Cl)c1 Amb9682468 [0,2,0,0,0,0|2,0,0]=4 2839 B17R2.5360 Clc1ccc(OCc2ccccc2)c(I)n1 Amb26890972 [0,2,0,0,0,0|2,0,0]=4 2840 B17R2.5360 Fc1cc(Br)ccc1OCc2ccccc2 Amb8631468 [0,2,0,0,0,0|2,0,0]=4 2841 B17R2.5360 Fc1cc(Br)cnc1NCc2ccccc2 Amb25168519 [0,2,0,0,0,0|2,0,0]=4 2842 B17R2.5360 Fc1cc(Cl)ccc1NCc2ccccc2 Amb9228077 [0,2,0,0,0,0|1,0,0]=3 2843 B17R2.5360 Fc1cc(Cl)cnc1NCc2ccccc2 Amb20075688 [0,2,0,0,0,0|2,0,0]=4 2844 B17R2.5360 Fc1cc(I)c(OCc2ccccc2)cn1 Amb34911571 [0,2,0,0,0,0|2,0,0]=4 2845 B17R2.5360 Fc1cc(I)ccc1NCc2ccccc2 Amb35589461 [0,2,0,0,0,0|1,0,0]=3 2846 B17R2.5360 Fc1ccc(CNc2ccccn2)c(Cl)c1 Amb13882158 [0,2,0,0,0,0|2,0,0]=4 2847 B17R2.5360 Fc1ccc(NCc2ccccc2)c(F)c1 Amb6698335 [0,2,0,0,0,0|1,0,0]=3 2848 B17R2.5360 Fc1ccc(NCc2ccccn2)c(Br)c1 Amb9206259 [0,2,0,0,0,0|2,0,0]=4 2849 B17R2.5360 Fc1ccc(NCc2ccccn2)c(F)c1 Amb6698343 [0,2,0,0,0,0|2,0,0]=4 2850 B17R2.5360 Fc1ccc(NCc2cccnc2)c(Cl)c1 Amb9204455 [0,2,0,0,0,0|0,0,0]=2 2851 B17R2.5360 Fc1ccc(NCc2cccnc2)c(F)c1 Amb6698250 [0,2,0,0,0,0|0,0,0]=2 2852 B17R2.5360 Fc1ccc(NCc2ccncc2)c(Br)c1 Amb9206264 [0,2,0,0,0,0|2,0,0]=4 2853 B17R2.5360 Fc1ccc(NCc2ccncc2)c(Cl)c1 Amb9203709 [0,2,0,0,0,0|2,0,0]=4 2854 B17R2.5360 Fc1ccc(NCc2ccncc2)c(F)c1 Amb6698255 [0,2,0,0,0,0|2,0,0]=4 2855 B17R2.5360 Fc1ccc(OCc2ccccc2)c(Br)c1 Amb6665090 [0,2,0,0,0,0|2,0,0]=4 2856 B17R2.5360 Fc1ccc(OCc2ccccc2)c(Cl)c1 Amb20678515 [0,2,0,0,0,0|2,0,0]=4 2857 B17R2.5360 Fc1ccc(OCc2ccccc2)c(F)c1 Amb10766356 [0,2,0,0,0,0|2,0,0]=4 2858 B17R2.5360 Fc1ccc(\N=C\c2cccnc2)c(F)c1 Amb33756743 [0,2,0,0,0,0|0,0,2]=4 2859 B17R2.5360 Fc1cnc(NCc2ccccc2)c(F)c1 Amb26916895 [0,2,0,0,0,0|2,0,0]=4 2860 B17R2.5360 Nc1cc(Br)ccc1NCc2ccccc2 Amb7767653 [0,2,0,0,0,0|1,0,0]=3 2861 B17R2.5360 Nc1cc(Br)ccc1NCc2cccnc2 Amb9205307 [0,2,0,0,0,0|0,0,0]=2 2862 B17R2.5360 Nc1cc(Br)ccc1OCc2ccccc2 Amb6676066 [0,2,0,0,0,0|2,0,0]=4 2863 B17R2.5360 Nc1cc(Br)cnc1NCc2ccccc2 Amb17209018 [0,2,0,0,0,0|2,0,0]=4 2864 B17R2.5360 Nc1cc(Br)cnc1NCc2cccnc2 Amb17281441 [0,2,0,0,0,0|1,0,0]=3 2865 B17R2.5360 Nc1cc(Cl)ccc1NCc2ccccc2 Amb2258838 [0,2,0,0,0,0|1,0,0]=3 2866 B17R2.5360 Nc1cc(Cl)ccc1OCc2ccccc2 Amb6540782 [0,2,0,0,0,0|2,0,0]=4 2867 B17R2.5360 Nc1cc(Cl)ccc1OCc2ccccc2 Amb6540868 [0,2,0,0,0,0|2,0,0]=4 2868 B17R2.5360 Nc1cc(Cl)ccc1SCc2ccccc2 Amb6668653 [0,2,0,0,0,0|2,0,0]=4 2869 B17R2.5360 Nc1cc(Cl)cnc1NCc2ccccc2 Amb17208952 [0,2,0,0,0,0|2,0,0]=4 2870 B17R2.5360 Nc1cc(Cl)cnc1NCc2cccnc2 Amb18228318 [0,2,0,0,0,0|1,0,0]=3 2871 B17R2.5360 Nc1cc(F)ccc1NCc2ccccn2 Amb845889 [0,2,0,0,0,0|2,0,0]=4 2872 B17R2.5360 Nc1cc(F)ccc1NCc2cccnc2 Amb845882 [0,2,0,0,0,0|0,0,0]=2 2873 B17R2.5360 Nc1cc(F)ccc1NCc2ccncc2 Amb845890 [0,2,0,0,0,0|2,0,0]=4 2874 B17R2.5360 Nc1cc(F)ccc1OCc2ccccc2 Amb32658025 [0,2,0,0,0,0|2,0,0]=4 2875 B17R2.5360 Nc1cc(F)ccc1OCc2ccccc2 Amb6679787 [0,2,0,0,0,0|2,0,0]=4 2876 B17R2.5360 Nc1cc(F)cnc1NCc2ccccc2 Amb27866747 [0,2,0,0,0,0|2,0,0]=4 2877 B17R2.5360 Nc1cc(I)ccc1OCc2ccccc2 Amb24379153 [0,2,0,0,0,0|2,0,0]=4 2878 B17R2.5360 Nc1ccc(NCc2ccccc2)c(Br)c1 Amb25223655 [0,2,0,0,0,0|1,0,0]=3 2879 B17R2.5360 Nc1ccc(NCc2ccccc2)c(Cl)c1 Amb7767656 [0,2,0,0,0,0|1,0,0]=3 2880 B17R2.5360 Nc1ccc(NCc2ccccc2)c(F)c1 Amb7783353 [0,2,0,0,0,0|1,0,0]=3 2881 B17R2.5360 Nc1ccc(NCc2cccnc2)c(F)c1 Amb845934 [0,2,0,0,0,0|0,0,0]=2 2882 B17R2.5360 Nc1ccc(NCc2ccncc2)c(F)c1 Amb845943 [0,2,0,0,0,0|2,0,0]=4 2883 B17R2.5360 Nc1ccc(OCc2ccccc2)c(Br)c1 Amb22059012 [0,2,0,0,0,0|2,0,0]=4 2884 B17R2.5360 Nc1ccc(OCc2ccccc2)c(Br)c1 Amb33548460 [0,2,0,0,0,0|2,0,0]=4 2885 B17R2.5360 Nc1ccc(OCc2ccccc2)c(Cl)c1 Amb1130066 [0,2,0,0,0,0|2,0,0]=4 2886 B17R2.5360 Nc1ccc(OCc2ccccc2)c(F)c1 Amb7783394 [0,2,0,0,0,0|2,0,0]=4 2887 B17R2.5360 Nc1ccc(OCc2ccccc2)c(F)c1 Amb8630049 [0,2,0,0,0,0|2,0,0]=4 2888 B17R2.5360 Nc1ccc(OCc2ccccc2)c(I)c1 Amb28192586 [0,2,0,0,0,0|2,0,0]=4 2889 B17R2.5360 Nc1ccc(OCc2cccnc2)c(Cl)c1 Amb1139807 [0,2,0,0,0,0|1,0,0]=3 2890 B17R2.5360 Nc1ccc(OCc2cccnc2)c(Cl)c1 Amb7969423 [0,2,0,0,0,0|1,0,0]=3 2891 B17R2.5360 Nc1ccc(OCc2cccnc2)c(F)c1 Amb22282208 [0,2,0,0,0,0|1,0,0]=3 2892 B17R2.5360 Nc1ccc(OCc2cccnc2)c(F)c1 Amb8886636 [0,2,0,0,0,0|1,0,0]=3 2893 B17R2.5360 Nc1ccc(SCc2ccccc2)c(Br)c1 Amb28556376 [0,2,0,0,0,0|2,0,0]=4 2894 B17R2.5360 Nc1ccc(\N=N\c2ccccc2)c(N)n1 Amb22492447 [0,2,0,0,0,0|1,0,1]=4 2895 B17R2.5360 Nc1ccc(\N=N\c2ccccc2)c(N)n1 Amb4015161 [0,2,0,0,0,0|1,0,1]=4 2896 B17R2.5360 Nc1ccc(\N=N\c2ccccc2)c(N)n1 Amb6355187 [0,2,0,0,0,0|1,0,1]=4 2897 B17R2.5360 Nc1cnc(NCc2ccccc2)c(Br)c1 Amb17213701 [0,2,0,0,0,0|2,0,0]=4 2898 B17R2.5360 Nc1cnc(NCc2ccccc2)c(Cl)c1 Amb18870126 [0,2,0,0,0,0|2,0,0]=4 2899 B17R2.5360 Nc1cnc(NCc2ccccc2)c(N)c1 Amb28192623 [0,2,0,0,0,0|2,0,0]=4 2900 B17R2.5360 Nc1cnc(NCc2cccnc2)c(Br)c1 Amb18888879 [0,2,0,0,0,0|1,0,0]=3 2901 B17R2.5360 Nc1cnc(NCc2cccnc2)c(Cl)c1 Amb18228315 [0,2,0,0,0,0|1,0,0]=3 2902 B17R2.5360 Nc1nc(Br)ccc1OCc2ccccc2 Amb26913330 [0,2,0,0,0,0|2,0,0]=4 2903 B17R2.5360 Oc1cc(Br)ccc1OCc2ccccc2 Amb26347129 [0,2,0,0,0,0|2,0,0]=4 2904 B17R2.5360 Oc1cc(F)ccc1OCc2ccccc2 Amb27960702 [0,2,0,0,0,0|2,0,0]=4 2905 B17R2.5360 Oc1ccc(NCc2ccccc2)c(Cl)c1 Amb30017174 [0,2,0,0,0,0|1,0,0]=3 2906 B17R2.5360 Oc1ccc(NCc2ccccc2)c(O)c1 Amb27481668 [0,2,0,0,0,0|1,0,0]=3 2907 B17R2.5360 Oc1ccc(OCc2ccccc2)c(Cl)c1 Amb21964645 [0,2,0,0,0,0|2,0,0]=4 2908 B17R2.5360 Oc1ccc(OCc2ccccc2)c(F)c1 Amb2413178 [0,2,0,0,0,0|2,0,0]=4 2909 B17R2.5360 Oc1ccc(OCc2ccccc2)c(I)c1 Amb28066119 [0,2,0,0,0,0|2,0,0]=4 2910 B17R2.5365 Brc1ccc(Br)c(OCc2ccccc2)c1 Amb22489992 [0,2,0,0,0,0|2,0,0]=4 2911 B17R2.5365 Brc1ccc(I)c(NCc2ccccc2)c1 Amb27453148 [0,2,0,0,0,0|1,0,0]=3 2912 B17R2.5365 Brc1ccc(I)cc1COc2ccccc2 Amb32414576 [0,2,0,0,0,0|2,0,0]=4 2913 B17R2.5365 Brc1cnc(Br)c(NCc2ccccc2)c1 Amb28047947 [0,2,0,0,0,0|2,0,0]=4 2914 B17R2.5365 Cc1ccc(Br)c(OCc2ccccc2)c1 Amb26535133 [0,2,0,0,0,0|2,0,0]=4 2915 B17R2.5365 Cc1ccc(Br)cc1NCc2ccccc2 Amb9595438 [0,2,0,0,0,0|1,0,0]=3 2916 B17R2.5365 Cc1ccc(Br)cc1OCc2ccccc2 Amb22228642 [0,2,0,0,0,0|2,0,0]=4 2917 B17R2.5365 Cc1ccc(C)c(CNc2ccccc2)c1 Amb17404125 [0,2,0,0,0,0|1,0,0]=3 2918 B17R2.5365 Cc1ccc(C)c(NCc2ccccc2)c1 Amb4313273 [0,2,0,0,0,0|1,0,0]=3 2919 B17R2.5365 Cc1ccc(C)c(NCc2ccccn2)c1 Amb1845990 [0,2,0,0,0,0|2,0,0]=4 2920 B17R2.5365 Cc1ccc(C)c(NCc2cccnc2)c1 Amb6700896 [0,2,0,0,0,0|0,0,0]=2 2921 B17R2.5365 Cc1ccc(C)c(NCc2ccncc2)c1 Amb4132439 [0,2,0,0,0,0|2,0,0]=4 2922 B17R2.5365 Cc1ccc(Cl)c(NCc2ccccc2)c1 Amb27791520 [0,2,0,0,0,0|1,0,0]=3 2923 B17R2.5365 Cc1ccc(Cl)c(NCc2cccnc2)c1 Amb33172808 [0,2,0,0,0,0|0,0,0]=2 2924 B17R2.5365 Cc1ccc(Cl)c(NCc2cccnc2)c1 Amb33473724 [0,2,0,0,0,0|0,0,0]=2 2925 B17R2.5365 Cc1ccc(Cl)c(OCc2ccccc2)c1 Amb20678879 [0,2,0,0,0,0|2,0,0]=4 2926 B17R2.5365 Cc1ccc(Cl)cc1NCc2ccccc2 Amb838954 [0,2,0,0,0,0|1,0,0]=3 2927 B17R2.5365 Cc1ccc(Cl)cc1NCc2ccccn2 Amb6683520 [0,2,0,0,0,0|2,0,0]=4 2928 B17R2.5365 Cc1ccc(Cl)cc1NCc2cccnc2 Amb6683482 [0,2,0,0,0,0|0,0,0]=2 2929 B17R2.5365 Cc1ccc(Cl)cc1NCc2ccncc2 Amb6683486 [0,2,0,0,0,0|2,0,0]=4 2930 B17R2.5365 Cc1ccc(F)c(NCc2cccnc2)c1 Amb9207612 [0,2,0,0,0,0|0,0,0]=2 2931 B17R2.5365 Cc1ccc(F)c(OCc2ccccc2)c1 Amb27392047 [0,2,0,0,0,0|2,0,0]=4 2932 B17R2.5365 Cc1ccc(F)cc1OCc2ccccc2 Amb2447362 [0,2,0,0,0,0|2,0,0]=4 2933 B17R2.5365 Cc1ccc(I)cc1OCc2ccccc2 Amb27620993 [0,2,0,0,0,0|2,0,0]=4 2934 B17R2.5365 Cc1ccc(N)c(NCc2ccccc2)n1 Amb17209144 [0,2,0,0,0,0|2,0,0]=4 2935 B17R2.5365 Cc1ccc(N)c(OCc2ccccc2)c1 Amb21954468 [0,2,0,0,0,0|2,0,0]=4 2936 B17R2.5365 Cc1ccc(N)c(OCc2ccccc2)c1 Amb6263514 [0,2,0,0,0,0|2,0,0]=4 2937 B17R2.5365 Cc1ccc(N)cc1OCc2ccccc2 Amb2608597 [0,2,0,0,0,0|2,0,0]=4 2938 B17R2.5365 Cc1ccc(O)c(CNc2ccccn2)c1 Amb1814089 [0,2,0,0,0,0|2,0,0]=4 2939 B17R2.5365 Cc1ccc(O)c(NCc2ccccc2)c1 Amb28288325 [0,2,0,0,0,0|1,0,0]=3 2940 B17R2.5365 Cc1ccc(O)c(OCc2ccccc2)c1 Amb27750277 [0,2,0,0,0,0|2,0,0]=4 2941 B17R2.5365 Cc1ccc(O)cc1OCc2ccccc2 Amb27802752 [0,2,0,0,0,0|2,0,0]=4 2942 B17R2.5365 Cc1cnc(C)c(NCc2ccccc2)c1 Amb30019432 [0,2,0,0,0,0|2,0,0]=4 2943 B17R2.5365 Clc1ccc(Br)cc1OCc2ccccc2 Amb21856191 [0,2,0,0,0,0|2,0,0]=4 2944 B17R2.5365 Clc1ccc(Br)cc1OCc2cccnc2 Amb19959515 [0,2,0,0,0,0|1,0,0]=3 2945 B17R2.5365 Clc1ccc(Cl)c(CNc2cccnc2)c1 Amb32455804 [0,2,0,0,0,0|2,0,0]=4 2946 B17R2.5365 Clc1ccc(Cl)c(NCc2ccccn2)c1 Amb6687676 [0,2,0,0,0,0|2,0,0]=4 2947 B17R2.5365 Clc1ccc(Cl)c(NCc2cccnc2)c1 Amb6687656 [0,2,0,0,0,0|0,0,0]=2 2948 B17R2.5365 Clc1ccc(Cl)c(NCc2ccncc2)c1 Amb6687658 [0,2,0,0,0,0|2,0,0]=4 2949 B17R2.5365 Clc1ccc(I)c(NCc2ccccc2)c1 Amb30016093 [0,2,0,0,0,0|1,0,0]=3 2950 B17R2.5365 Clc1ccc(I)c(OCc2ccccc2)c1 Amb24632187 [0,2,0,0,0,0|2,0,0]=4 2951 B17R2.5365 Clc1ncc(Br)cc1OCc2ccccc2 Amb22494200 [0,2,0,0,0,0|2,0,0]=4 2952 B17R2.5365 Fc1ccc(Br)c(OCc2ccccc2)c1 Amb7172556 [0,2,0,0,0,0|2,0,0]=4 2953 B17R2.5365 Fc1ccc(Br)cc1CNc2ccccc2 Amb6685060 [0,2,0,0,0,0|1,0,0]=3 2954 B17R2.5365 Fc1ccc(Br)cc1OCc2ccccc2 Amb22489994 [0,2,0,0,0,0|2,0,0]=4 2955 B17R2.5365 Fc1ccc(F)c(CNc2ccccc2)c1 Amb8945080 [0,2,0,0,0,0|1,0,0]=3 2956 B17R2.5365 Fc1ccc(F)c(NCc2ccccc2)n1 Amb27472879 [0,2,0,0,0,0|2,0,0]=4 2957 B17R2.5365 Fc1ncc(Br)cc1OCc2ccccc2 Amb27260298 [0,2,0,0,0,0|2,0,0]=4 2958 B17R2.5365 Nc1ccc(Br)cc1OCc2ccccc2 Amb22750043 [0,2,0,0,0,0|2,0,0]=4 2959 B17R2.5365 Nc1ccc(Cl)c(OCc2ccccc2)c1 Amb25987896 [0,2,0,0,0,0|2,0,0]=4 2960 B17R2.5365 Nc1ccc(Cl)cc1OCc2ccccc2 Amb24309267 [0,2,0,0,0,0|2,0,0]=4 2961 B17R2.5365 Nc1ccc(Cl)cc1OCc2ccccc2 Amb33552633 [0,2,0,0,0,0|2,0,0]=4 2962 B17R2.5365 Nc1ccc(Cl)cc1OCc2cccnc2 Amb17132780 [0,2,0,0,0,0|1,0,0]=3 2963 B17R2.5365 Nc1ccc(Cl)cc1OCc2cnccn2 Amb17132782 [0,2,0,0,0,0|2,0,0]=4 2964 B17R2.5365 Nc1ccc(F)cc1NCc2ccccc2 Amb18298341 [0,2,0,0,0,0|1,0,0]=3 2965 B17R2.5365 Nc1ccc(F)cc1OCc2ccccc2 Amb1112813 [0,2,0,0,0,0|2,0,0]=4 2966 B17R2.5365 Nc1ncc(Br)cc1OCc2ccccc2 Amb10601959 [0,2,0,0,0,0|2,0,0]=4 2967 B17R2.5365 O=C1C=CC(=O)C(COc2ccccc2)=C1 Amb8026395 [0,2,0,0,0,0|2,0,0]=4 2968 B17R2.5365 Oc1ccc(Br)cc1CNc2ccccn2 Amb686365 [0,2,0,0,0,0|2,0,0]=4 2969 B17R2.5365 Oc1ccc(Br)cc1OCc2ccccc2 Amb22054431 [0,2,0,0,0,0|2,0,0]=4 2970 B17R2.5365 Oc1ccc(Cl)cc1CNc2ccccc2 Amb3547469 [0,2,0,0,0,0|1,0,0]=3 2971 B17R2.5365 Oc1ccc(Cl)cc1CNc2ccccn2 Amb682150 [0,2,0,0,0,0|2,0,0]=4 2972 B17R2.5365 Oc1ccc(F)c(OCc2ccccc2)c1 Amb34911566 [0,2,0,0,0,0|2,0,0]=4 2973 B17R2.5365 Oc1ccc(I)cc1OCc2ccccc2 Amb22054436 [0,2,0,0,0,0|2,0,0]=4 2974 B17R2.5365 Oc1ccc(I)nc1NCc2ccccc2 Amb25099512 [0,2,0,0,0,0|2,0,0]=4 2975 B17R2.5365 Oc1ccc(O)c(NCc2ccccc2)c1 Amb28208207 [0,2,0,0,0,0|1,0,0]=3 2976 B17R2.5365 Oc1ccc(O)c(OCc2ccccc2)c1 Amb27829024 [0,2,0,0,0,0|2,0,0]=4 2977 B17R2.5365 Oc1cnc(F)c(OCc2ccccc2)c1 Amb26385404 [0,2,0,0,0,0|2,0,0]=4 2978 B17R2.41893 Cc1cccc(CCc2ccccc2N)c1 Amb31118105 [0,2,0,0,0,0|2,0,0]=4 2979 B17R2.41893 Cc1cccc(CNc2ccccc2Br)c1 Amb6696362 [0,2,0,0,0,0|1,0,0]=3 2980 B17R2.41893 Cc1cccc(CNc2ccccc2C)c1 Amb6701117 [0,2,0,0,0,0|1,0,0]=3 2981 B17R2.41893 Cc1cccc(CNc2ccccc2Cl)c1 Amb4313247 [0,2,0,0,0,0|1,0,0]=3 2982 B17R2.41893 Cc1cccc(CNc2ccccc2F)c1 Amb6697257 [0,2,0,0,0,0|1,0,0]=3 2983 B17R2.41893 Cc1cccc(CNc2ncccc2N)c1 Amb18292814 [0,2,0,0,0,0|2,0,0]=4 2984 B17R2.41893 Cc1cccc(COc2ccccc2N)c1 Amb1111785 [0,2,0,0,0,0|2,0,0]=4 2985 B17R2.41893 Cc1cccc(CSc2ccccc2N)c1 Amb2149343 [0,2,0,0,0,0|2,0,0]=4 2986 B17R2.41893 Cc1cccc(CSc2ccccc2N)c1 Amb6666828 [0,2,0,0,0,0|2,0,0]=4 2987 B17R2.41893 Cc1cccc(NCc2ccccc2C)c1 Amb6684409 [0,2,0,0,0,0|1,0,0]=3 2988 B17R2.41893 Cc1cccc(NCc2ccccc2Cl)c1 Amb6684399 [0,2,0,0,0,0|1,0,0]=3 2989 B17R2.41893 Cc1cccc(NCc2ccccc2F)c1 Amb6684520 [0,2,0,0,0,0|1,0,0]=3 2990 B17R2.41893 Cc1cccc(NCc2ccccc2O)c1 Amb3545216 [0,2,0,0,0,0|1,0,0]=3 2991 B17R2.41893 Cc1cccc(NCc2ccccc2O)n1 Amb687200 [0,2,0,0,0,0|2,0,0]=4 2992 B17R2.41893 Cc1ccccc1CNc2cc(N)ccn2 Amb18981504 [0,2,0,0,0,0|2,0,0]=4 2993 B17R2.41893 Cc1ccccc1CNc2cccc(Br)c2 Amb6696579 [0,2,0,0,0,0|1,0,0]=3 2994 B17R2.41893 Cc1ccccc1CNc2cccc(Cl)c2 Amb6611755 [0,2,0,0,0,0|1,0,0]=3 2995 B17R2.41893 Cc1ccccc1CNc2cccc(F)c2 Amb6695768 [0,2,0,0,0,0|1,0,0]=3 2996 B17R2.41893 Cc1ccccc1COc2cccc(Br)c2 Amb2689356 [0,2,0,0,0,0|2,0,0]=4 2997 B17R2.41893 Cc1ccccc1COc2cccc(N)c2 Amb1118415 [0,2,0,0,0,0|2,0,0]=4 2998 B17R2.41893 Cc1ccccc1COc2cccc(O)c2 Amb8837422 [0,2,0,0,0,0|2,0,0]=4 2999 B17R2.41893 Cc1ccccc1NCc2cccc(Br)c2 Amb6701106 [0,2,0,0,0,0|1,0,0]=3 3000 B17R2.41893 Cc1ccccc1NCc2cccc(Cl)c2 Amb4303631 [0,2,0,0,0,0|1,0,0]=3 3001 B17R2.41893 Cc1ccccc1NCc2cccc(F)c2 Amb6701113 [0,2,0,0,0,0|1,0,0]=3 3002 B17R2.41893 Cc1ccccc1NCc2cccc(O)c2 Amb3539993 [0,2,0,0,0,0|1,0,0]=3 3003 B17R2.41893 Cc1ccnc(NCc2ccccc2O)c1 Amb1801559 [0,2,0,0,0,0|2,0,0]=4 3004 B17R2.41893 Cc1cncc(NCc2ccccc2Br)c1 Amb32952882 [0,2,0,0,0,0|2,0,0]=4 3005 B17R2.41893 Cc1cncc(NCc2ccccc2Br)c1 Amb32952908 [0,2,0,0,0,0|2,0,0]=4 3006 B17R2.41893 Clc1cccc(NCc2ccccc2Cl)c1 Amb6616045 [0,2,0,0,0,0|1,0,0]=3 3007 B17R2.41893 Clc1ccccc1CNc2cncc(Br)c2 Amb32430456 [0,2,0,0,0,0|2,0,0]=4 3008 B17R2.41893 Fc1cccc(CNc2ccccc2Cl)c1 Amb6696839 [0,2,0,0,0,0|1,0,0]=3 3009 B17R2.41893 Fc1cccc(CNc2ccccc2F)c1 Amb6697251 [0,2,0,0,0,0|1,0,0]=3 3010 B17R2.41893 Fc1cccc(NCc2ccccc2Cl)c1 Amb6695747 [0,2,0,0,0,0|1,0,0]=3 3011 B17R2.41893 Fc1cccc(NCc2ccccc2F)c1 Amb6695890 [0,2,0,0,0,0|1,0,0]=3 3012 B17R2.41893 Fc1ccccc1CNc2cccc(Cl)c2 Amb6695732 [0,2,0,0,0,0|1,0,0]=3 3013 B17R2.41893 Fc1ccccc1NCc2cccc(Cl)c2 Amb4303625 [0,2,0,0,0,0|1,0,0]=3 3014 B17R2.41893 Nc1cccc(COc2ccccc2Cl)c1 Amb22282149 [0,2,0,0,0,0|2,0,0]=4 3015 B17R2.41893 Nc1cccc(COc2ccccc2Cl)c1 Amb6249399 [0,2,0,0,0,0|2,0,0]=4 3016 B17R2.41893 Nc1cccc(COc2ccccc2F)c1 Amb6249325 [0,2,0,0,0,0|2,0,0]=4 3017 B17R2.41893 Nc1cccc(OCc2ccccc2Cl)c1 Amb6244088 [0,2,0,0,0,0|2,0,0]=4 3018 B17R2.41893 Nc1cccc(OCc2ccccc2F)c1 Amb5559923 [0,2,0,0,0,0|2,0,0]=4 3019 B17R2.41893 Nc1ccccc1CCc2cccc(Br)c2 Amb31122481 [0,2,0,0,0,0|2,0,0]=4 3020 B17R2.41893 Nc1ccccc1CCc2cccc(F)c2 Amb31135814 [0,2,0,0,0,0|2,0,0]=4 3021 B17R2.41893 Nc1ccccc1OCc2cccc(Br)c2 Amb1138739 [0,2,0,0,0,0|2,0,0]=4 3022 B17R2.41893 Nc1ccccc1OCc2cccc(Cl)c2 Amb6660312 [0,2,0,0,0,0|2,0,0]=4 3023 B17R2.41893 Nc1ccccc1OCc2cccc(F)c2 Amb1121098 [0,2,0,0,0,0|2,0,0]=4 3024 B17R2.41893 Nc1ccccc1SCc2cccc(Cl)c2 Amb2092094 [0,2,0,0,0,0|2,0,0]=4 3025 B17R2.41893 Nc1ccccc1SCc2cccc(F)c2 Amb2092232 [0,2,0,0,0,0|2,0,0]=4 3026 B17R2.41893 Nc1cccnc1NCc2cccc(Cl)c2 Amb18299325 [0,2,0,0,0,0|2,0,0]=4 3027 B17R2.41893 Nc1cccnc1NCc2cccc(F)c2 Amb7782046 [0,2,0,0,0,0|2,0,0]=4 3028 B17R2.41893 Nc1ccnc(NCc2ccccc2Br)c1 Amb32419280 [0,2,0,0,0,0|2,0,0]=4 3029 B17R2.41893 Nc1ccnc(NCc2ccccc2Cl)c1 Amb18981463 [0,2,0,0,0,0|2,0,0]=4 3030 B17R2.41893 Nc1ccnc(NCc2ccccc2F)c1 Amb18981468 [0,2,0,0,0,0|2,0,0]=4 3031 B17R2.41893 Nc1ncccc1NCc2cccc(Br)c2 Amb19929502 [0,2,0,0,0,0|2,0,0]=4 3032 B17R2.41893 Nc1ncccc1OCc2cccc(Br)c2 Amb9208358 [0,2,0,0,0,0|2,0,0]=4 3033 B17R2.41893 Nc1ncccc1OCc2cccc(Cl)c2 Amb7787269 [0,2,0,0,0,0|2,0,0]=4 3034 B17R2.41893 Nc1ncccc1OCc2cccc(F)c2 Amb7787283 [0,2,0,0,0,0|2,0,0]=4 3035 B17R2.41893 Oc1cccc(CNc2ccccc2Br)c1 Amb6696449 [0,2,0,0,0,0|1,0,0]=3 3036 B17R2.41893 Oc1cccc(CNc2ccccc2Cl)c1 Amb6696909 [0,2,0,0,0,0|1,0,0]=3 3037 B17R2.41893 Oc1cccc(CNc2ccccc2F)c1 Amb6697367 [0,2,0,0,0,0|1,0,0]=3 3038 B17R2.41893 Oc1cccc(OCc2ccccc2Cl)c1 Amb8837450 [0,2,0,0,0,0|2,0,0]=4 3039 B17R2.41893 Oc1cccc(OCc2ccccc2F)c1 Amb8837465 [0,2,0,0,0,0|2,0,0]=4 3040 B17R2.41893 Oc1ccccc1CNc2cccc(Br)c2 Amb2618408 [0,2,0,0,0,0|1,0,0]=3 3041 B17R2.41893 Oc1ccccc1CNc2cccc(Cl)c2 Amb4020615 [0,2,0,0,0,0|1,0,0]=3 3042 B17R2.41893 Oc1ccccc1CNc2cccc(F)c2 Amb6695803 [0,2,0,0,0,0|1,0,0]=3 3043 B17R2.41893 Oc1ccccc1OCc2cccc(F)c2 Amb8837334 [0,2,0,0,0,0|2,0,0]=4 3044 B17R2.162 CCN(Cc1ccccc1)c2ccccc2 Amb6357108 [0,2,0,0,0,0|1,0,0]=3 3045 B17R2.162 CNC(Cc1ccccc1)c2ccccc2 Amb3939423 [0,2,0,0,0,0|2,0,0]=4 3046 B17R2.162 N#CC(Cc1ccccc1)c2ccccc2 Amb2761506 [0,2,0,0,0,0|2,0,0]=4 3047 B17R2.162 N#CC(Cc1cccnc1)c2ccccc2 Amb17239879 [0,2,0,0,0,0|1,0,0]=3 3048 B17R2.162 N#CC(Nc1ccccc1)c2ccccc2 Amb2387118 [0,2,0,0,0,0|1,0,0]=3 3049 B17R2.162 N#CC(Nc1ccccc1)c2ccccn2 Amb10070165 [0,2,0,0,0,0|2,0,0]=4 3050 B17R2.162 N#CC(Nc1ccccc1)c2cccnc2 Amb10070164 [0,2,0,0,0,0|0,0,0]=2 3051 B17R2.162 N#CC(Nc1ccccc1)c2ccncc2 Amb10070163 [0,2,0,0,0,0|2,0,0]=4 3052 B17R2.162 N#C\C(=C\c1cccnc1)c2ccccc2 Amb2613475 [0,2,0,0,0,0|1,0,1]=4 3053 B17R2.162 NCC(Cc1ccccc1)c2ccccc2 Amb5733600 [0,2,0,0,0,0|2,0,0]=4 3054 B17R2.162 NCC(Cc1cccnc1)c2ccccc2 Amb5733598 [0,2,0,0,0,0|1,0,0]=3 3055 B17R2.162 NCC(Cc1cccnc1)c2ccccn2 Amb17241448 [0,2,0,0,0,0|2,0,0]=4 3056 B17R2.162 NCC(Nc1ccccc1)c2ccccc2 Amb17404194 [0,2,0,0,0,0|1,0,0]=3 3057 B17R2.162 NCC(Nc1ccccc1)c2ccccn2 Amb17404257 [0,2,0,0,0,0|2,0,0]=4 3058 B17R2.162 NCC(Nc1ccccc1)c2cccnc2 Amb17404258 [0,2,0,0,0,0|0,0,0]=2 3059 B17R2.162 NCC(Nc1ccccc1)c2ccncc2 Amb17404259 [0,2,0,0,0,0|2,0,0]=4 3060 B17R2.162 NCC(Oc1ccccc1)c2ccccc2 Amb17077703 [0,2,0,0,0,0|2,0,0]=4 3061 B17R2.162 NCC(Oc1ccccc1)c2ccccc2 Amb3433826 [0,2,0,0,0,0|2,0,0]=4 3062 B17R2.162 O=CC(Cc1ccccc1)c2ccccc2 Amb5749234 [0,2,0,0,0,0|2,0,0]=4 3063 B17R2.162 O=CC(Cc1cccnc1)c2ccccc2 Amb5749232 [0,2,0,0,0,0|1,0,0]=3 3064 B17R2.162 O=CN(Cc1ccccc1)c2ccccc2 Amb27611605 [0,2,0,0,0,0|1,0,0]=3 3065 B17R2.162 O=C\C(=C\c1cccnc1)c2ccccc2 Amb17339288 [0,2,0,0,0,0|1,0,1]=4 3066 B17R2.162 OCC(Cc1ccccc1)c2ccccc2 Amb4035768 [0,2,0,0,0,0|2,0,0]=4 3067 B17R2.162 OCC(Cc1cccnc1)c2ccccc2 Amb5748453 [0,2,0,0,0,0|1,0,0]=3 3068 B17R2.162 OCC(Nc1ccccc1)c2ccccc2 Amb19008888 [0,2,0,0,0,0|1,0,0]=3 3069 B17R2.162 OC[C@@H](Nc1ccccc1)c2ccccc2 Amb2700535 [0,2,0,0,0,0|1,0,0]=3 3070 B17R2.162 OC[C@H](Nc1ccccc1)c2ccccc2 Amb28556797 [0,2,0,0,0,0|1,0,0]=3 3071 B17R2.162 O\N=C(/Cc1ccccc1)c2ccccc2 Amb10975748 [0,2,0,0,0,0|2,0,0]=4 3072 B17R2.192 CC(Nc1ccccc1)c2ccc(Cl)cc2 Amb9739094 [0,2,0,0,0,0|1,0,0]=3 3073 B17R2.192 CC(Nc1ccccn1)c2ccc(F)cc2 Amb18292020 [0,2,0,0,0,0|2,0,0]=4 3074 B17R2.192 CC(Sc1ccccc1)c2ccc(N)cc2 Amb20629414 [0,2,0,0,0,0|2,0,0]=4 3075 B17R2.192 CC(Sc1ccccc1)c2ccc(N)cc2 Amb22058906 [0,2,0,0,0,0|2,0,0]=4 3076 B17R2.192 CN(Cc1ccccc1)c2ccc(Br)cc2 Amb28138525 [0,2,0,0,0,0|1,0,0]=3 3077 B17R2.192 CN(Cc1ccccc1)c2ccc(Br)cn2 Amb18595819 [0,2,0,0,0,0|2,0,0]=4 3078 B17R2.192 CN(Cc1ccccc1)c2ccc(Cl)nc2 Amb17562756 [0,2,0,0,0,0|2,0,0]=4 3079 B17R2.192 CN(Cc1ccccc1)c2ccc(N)cc2 Amb6249305 [0,2,0,0,0,0|1,0,0]=3 3080 B17R2.192 CN(Cc1ccccc1)c2ccc(N)cn2 Amb5786809 [0,2,0,0,0,0|2,0,0]=4 3081 B17R2.192 CN(Cc1ccccc1)c2ccc(N)nc2 Amb6679669 [0,2,0,0,0,0|2,0,0]=4 3082 B17R2.192 Cc1ccc(C(=O)Cc2ccccc2)cc1 Amb2221620 [0,2,0,0,0,0|2,0,0]=4 3083 B17R2.192 Cc1ccc(C(=O)Cc2cccnc2)cc1 Amb21857183 [0,2,0,0,0,0|1,0,0]=3 3084 B17R2.192 Cc1ccc(C(N)Cc2ccccc2)cc1 Amb5736373 [0,2,0,0,0,0|2,0,0]=4 3085 B17R2.192 Cc1ccc(C(O)Cc2ccccc2)cc1 Amb17241192 [0,2,0,0,0,0|2,0,0]=4 3086 B17R2.192 NC(Cc1ccccc1)c2ccc(Cl)cc2 Amb10610122 [0,2,0,0,0,0|2,0,0]=4 3087 B17R2.192 NC(Cc1ccccc1)c2ccc(Cl)cc2 Amb5736382 [0,2,0,0,0,0|2,0,0]=4 3088 B17R2.192 NC(Cc1ccccc1)c2ccc(F)cc2 Amb5736375 [0,2,0,0,0,0|2,0,0]=4 3089 B17R2.192 Nc1ccc(C(=O)Cc2ccccc2)cc1 Amb17101651 [0,2,0,0,0,0|2,0,0]=4 3090 B17R2.192 Nc1ccc(C(=O)Nc2ccccc2)cc1 Amb6447151 [0,2,0,0,0,0|1,0,1]=4 3091 B17R2.192 Nc1ccc(C(=O)Nc2cccnc2)cc1 Amb1116519 [0,2,0,0,0,0|2,0,0]=4 3092 B17R2.192 Nc1ccc(C(O)Cc2ccccc2)cc1 Amb17101769 [0,2,0,0,0,0|2,0,0]=4 3093 B17R2.192 Nc1ccc(S(=O)Nc2ccccc2)cc1 Amb18227986 [0,2,0,0,0,0|2,0,0]=4 3094 B17R2.192 O=C(Cc1ccccc1)c2ccc(Br)cc2 Amb534181 [0,2,0,0,0,0|2,0,0]=4 3095 B17R2.192 O=C(Cc1ccccc1)c2ccc(Cl)cc2 Amb2610540 [0,2,0,0,0,0|2,0,0]=4 3096 B17R2.192 O=C(Cc1ccccc1)c2ccc(F)cc2 Amb534905 [0,2,0,0,0,0|2,0,0]=4 3097 B17R2.192 O=C(Cc1ccccc1)c2ccc(I)cc2 Amb6301911 [0,2,0,0,0,0|2,0,0]=4 3098 B17R2.192 O=C(Cc1ccccc1)c2ccc(O)cc2 Amb535082 [0,2,0,0,0,0|2,0,0]=4 3099 B17R2.192 O=C(Cc1cccnc1)c2ccc(Cl)cc2 Amb33530731 [0,2,0,0,0,0|1,0,0]=3 3100 B17R2.192 O=C(Cc1cccnc1)c2ccc(F)cc2 Amb24093929 [0,2,0,0,0,0|1,0,0]=3 3101 B17R2.192 O=C(Nc1ccccc1)c2ccc(Br)cc2 Amb1212859 [0,2,0,0,0,0|1,0,1]=4 3102 B17R2.192 O=C(Nc1ccccc1)c2ccc(Cl)cc2 Amb6364930 [0,2,0,0,0,0|1,0,1]=4 3103 B17R2.192 O=C(Nc1ccccc1)c2ccc(Cl)nc2 Amb3429822 [0,2,0,0,0,0|0,0,1]=3 3104 B17R2.192 O=C(Nc1ccccc1)c2ccc(Cl)nn2 Amb19515128 [0,2,0,0,0,0|1,0,1]=4 3105 B17R2.192 O=C(Nc1ccccc1)c2ccc(O)cc2 Amb1304779 [0,2,0,0,0,0|1,0,1]=4 3106 B17R2.192 O=C(Nc1cccnc1)c2ccc(Br)cc2 Amb6350636 [0,2,0,0,0,0|2,0,0]=4 3107 B17R2.192 O=C(Nc1cccnc1)c2ccc(O)cc2 Amb6671771 [0,2,0,0,0,0|2,0,0]=4 3108 B17R2.192 OC(Cc1ccccc1)c2ccc(Br)cc2 Amb18036245 [0,2,0,0,0,0|2,0,0]=4 3109 B17R2.192 OC(Cc1ccccc1)c2ccc(Cl)cc2 Amb17250539 [0,2,0,0,0,0|2,0,0]=4 3110 B17R2.192 OC(Cc1ccccc1)c2ccc(F)cc2 Amb17242250 [0,2,0,0,0,0|2,0,0]=4 3111 B17R2.192 Oc1ccc(C(O)Cc2cccnc2)cc1 Amb18131936 [0,2,0,0,0,0|1,0,0]=3 3112 B17R2.209 CC(Nc1ccc(Br)cc1)c2ccccc2 Amb6696500 [0,2,0,0,0,0|1,0,0]=3 3113 B17R2.209 CC(Nc1ccc(Br)cn1)c2ccccc2 Amb6629473 [0,2,0,0,0,0|2,0,0]=4 3114 B17R2.209 CC(Nc1ccc(Cl)nn1)c2cccnc2 Amb9251121 [0,2,0,0,0,0|2,0,0]=4 3115 B17R2.209 CC(Nc1ccc(N)cc1)c2ccccc2 Amb7767586 [0,2,0,0,0,0|1,0,0]=3 3116 B17R2.209 CC(Nc1ccc(N)cc1)c2ccccn2 Amb9385684 [0,2,0,0,0,0|2,0,0]=4 3117 B17R2.209 CC(Nc1ccc(N)cc1)c2cccnc2 Amb9384995 [0,2,0,0,0,0|0,0,0]=2 3118 B17R2.209 CC(Nc1ccc(N)cc1)c2ccncc2 Amb9385349 [0,2,0,0,0,0|2,0,0]=4 3119 B17R2.209 CC(Nc1ccc(N)cn1)c2ccccc2 Amb5731142 [0,2,0,0,0,0|2,0,0]=4 3120 B17R2.209 CC(Nc1ccc(N)cn1)c2cccnc2 Amb9385006 [0,2,0,0,0,0|1,0,0]=3 3121 B17R2.209 CC(Nc1ccc(N)nc1)c2ccccc2 Amb7767579 [0,2,0,0,0,0|2,0,0]=4 3122 B17R2.209 CC(Oc1ccc(F)cn1)c2cccnc2 Amb33612315 [0,2,0,0,0,0|2,0,0]=4 3123 B17R2.209 CC(Oc1ccc(N)cc1)c2ccccc2 Amb6676330 [0,2,0,0,0,0|2,0,0]=4 3124 B17R2.209 CC(Oc1ccc(N)cc1)c2cccnc2 Amb17131796 [0,2,0,0,0,0|1,0,0]=3 3125 B17R2.209 CN(Cc1ccc(N)cc1)c2ccccc2 Amb1119268 [0,2,0,0,0,0|1,0,0]=3 3126 B17R2.209 C[C@H](Nc1ccc(Br)cn1)c2ccccc2 Amb23667086 [0,2,0,0,0,0|2,0,0]=4 3127 B17R2.209 Cc1ccc(CC(=O)c2ccccc2)cc1 Amb6301929 [0,2,0,0,0,0|2,0,0]=4 3128 B17R2.209 Cc1ccc(CC(=O)c2cccnc2)cc1 Amb2724766 [0,2,0,0,0,0|1,0,1]=4 3129 B17R2.209 Cc1ccc(CC(N)c2ccccc2)cc1 Amb3940067 [0,2,0,0,0,0|2,0,0]=4 3130 B17R2.209 Cc1ccc(CC(N)c2cccnc2)cc1 Amb18289057 [0,2,0,0,0,0|1,0,0]=3 3131 B17R2.209 Cc1ccc(CC(O)c2ccccc2)cc1 Amb17241187 [0,2,0,0,0,0|2,0,0]=4 3132 B17R2.209 Cc1ccc(CC(O)c2cccnc2)cc1 Amb17241428 [0,2,0,0,0,0|1,0,0]=3 3133 B17R2.209 Cc1ccc(NC(=O)c2ccccc2)cc1 Amb33533893 [0,2,0,0,0,0|1,0,1]=4 3134 B17R2.209 Cc1ccc(NC(=O)c2ccccc2)cn1 Amb32789646 [0,2,0,0,0,0|2,0,0]=4 3135 B17R2.209 Cc1ccc(NC(=O)c2cccnc2)cc1 Amb1233505 [0,2,0,0,0,0|0,0,1]=3 3136 B17R2.209 Cc1ccc(OC(=O)c2cccnc2)cc1 Amb4289561 [0,2,0,0,0,0|1,0,1]=4 3137 B17R2.209 Fc1ccc(CC(Br)c2ccccc2)cc1 Amb29845397 [0,2,0,0,0,0|2,0,0]=4 3138 B17R2.209 Fc1ccc(CC(Br)c2cccnc2)cc1 Amb29845398 [0,2,0,0,0,0|1,0,0]=3 3139 B17R2.209 NC(Cc1ccc(Cl)cc1)c2ccccc2 Amb10609790 [0,2,0,0,0,0|2,0,0]=4 3140 B17R2.209 NC(Cc1ccc(Cl)cc1)c2ccccc2 Amb5736691 [0,2,0,0,0,0|2,0,0]=4 3141 B17R2.209 NC(Cc1ccc(F)cc1)c2ccccc2 Amb9717657 [0,2,0,0,0,0|2,0,0]=4 3142 B17R2.209 NC(Cc1ccc(F)cc1)c2cccnc2 Amb18289056 [0,2,0,0,0,0|1,0,0]=3 3143 B17R2.209 Nc1ccc(NC(=O)c2ccccc2)cc1 Amb6336058 [0,2,0,0,0,0|1,0,1]=4 3144 B17R2.209 Nc1ccc(NC(=O)c2ccccc2)cn1 Amb18965494 [0,2,0,0,0,0|2,0,0]=4 3145 B17R2.209 Nc1ccc(NC(=O)c2cccnc2)cc1 Amb1112977 [0,2,0,0,0,0|0,0,1]=3 3146 B17R2.209 O=C(Cc1ccc(Br)cc1)c2ccccc2 Amb3941056 [0,2,0,0,0,0|2,0,0]=4 3147 B17R2.209 O=C(Cc1ccc(Br)cc1)c2cccnc2 Amb34912587 [0,2,0,0,0,0|1,0,1]=4 3148 B17R2.209 O=C(Cc1ccc(Cl)cc1)c2ccccc2 Amb1570222 [0,2,0,0,0,0|2,0,0]=4 3149 B17R2.209 O=C(Cc1ccc(Cl)cc1)c2cccnc2 Amb34912608 [0,2,0,0,0,0|1,0,1]=4 3150 B17R2.209 O=C(Cc1ccc(F)cc1)c2ccccc2 Amb6301925 [0,2,0,0,0,0|2,0,0]=4 3151 B17R2.209 O=C(Cc1ccc(F)cc1)c2cccnc2 Amb29845387 [0,2,0,0,0,0|1,0,1]=4 3152 B17R2.209 O=C(Nc1ccc(Br)cc1)c2ccccc2 Amb6367465 [0,2,0,0,0,0|1,0,1]=4 3153 B17R2.209 O=C(Nc1ccc(Br)cc1)c2cccnc2 Amb6347445 [0,2,0,0,0,0|0,0,1]=3 3154 B17R2.209 O=C(Nc1ccc(Cl)cc1)c2cccnc2 Amb6347444 [0,2,0,0,0,0|0,0,1]=3 3155 B17R2.209 O=C(Nc1ccc(F)cc1)c2ccccc2 Amb6347160 [0,2,0,0,0,0|1,0,1]=4 3156 B17R2.209 O=C(Nc1ccc(F)cc1)c2cccnc2 Amb6347265 [0,2,0,0,0,0|0,0,1]=3 3157 B17R2.209 O=C(Nc1ccc(F)cc1)c2cccnn2 Amb1080089 [0,2,0,0,0,0|1,0,1]=4 3158 B17R2.209 O=C(Nc1ccc(I)cc1)c2ccccc2 Amb6540614 [0,2,0,0,0,0|1,0,1]=4 3159 B17R2.209 O=C(Nc1ccc(I)cc1)c2cccnc2 Amb6381434 [0,2,0,0,0,0|0,0,1]=3 3160 B17R2.209 O=C(Nc1ccc(I)cn1)c2cccnc2 Amb6770122 [0,2,0,0,0,0|1,0,1]=4 3161 B17R2.209 O=C(Nc1ccc(O)cc1)c2ccccc2 Amb1819644 [0,2,0,0,0,0|1,0,1]=4 3162 B17R2.209 O=C(Nc1ccc(O)cc1)c2cccnc2 Amb4422050 [0,2,0,0,0,0|0,0,1]=3 3163 B17R2.209 O=C(Nc1ccc(S)nc1)c2ccccc2 Amb17206142 [0,2,0,0,0,0|2,0,0]=4 3164 B17R2.209 O=C(Oc1ccc(Cl)cc1)c2cccnc2 Amb22452030 [0,2,0,0,0,0|1,0,1]=4 3165 B17R2.209 OC(Cc1ccc(Cl)cc1)c2ccccc2 Amb17250531 [0,2,0,0,0,0|2,0,0]=4 3166 B17R2.209 OC(Cc1ccc(Cl)cc1)c2cccnc2 Amb17251233 [0,2,0,0,0,0|1,0,0]=3 3167 B17R2.209 OC(Cc1ccc(F)cc1)c2ccccc2 Amb17242243 [0,2,0,0,0,0|2,0,0]=4 3168 B17R2.209 OC(Cc1ccc(F)cc1)c2cccnc2 Amb17242543 [0,2,0,0,0,0|1,0,0]=3 3169 B17R2.209 S=C(Nc1ccc(Cl)cc1)c2ccccc2 Amb2608987 [0,2,0,0,0,0|1,0,1]=4 3170 B17R2.5273 CN(Cc1ccccc1)c2cc(Br)ccn2 Amb19959553 [0,2,0,0,0,0|2,0,0]=4 3171 B17R2.5273 CN(Cc1ccccc1)c2cc(N)ccn2 Amb17340019 [0,2,0,0,0,0|2,0,0]=4 3172 B17R2.5273 CN(Cc1ccccc1)c2cccc(Cl)c2 Amb8629392 [0,2,0,0,0,0|1,0,0]=3 3173 B17R2.5273 CN(Cc1ccccc1)c2cccc(Cl)n2 Amb21958309 [0,2,0,0,0,0|2,0,0]=4 3174 B17R2.5273 CN(Cc1ccccc1)c2cccc(N)c2 Amb8825408 [0,2,0,0,0,0|1,0,0]=3 3175 B17R2.5273 CN(Cc1ccccc1)c2ccnc(N)c2 Amb25168400 [0,2,0,0,0,0|2,0,0]=4 3176 B17R2.5273 CN(Cc1ccccc1)c2cncc(Br)c2 Amb23673541 [0,2,0,0,0,0|2,0,0]=4 3177 B17R2.5273 CN(Cc1ccccc1)c2cncc(N)c2 Amb25168417 [0,2,0,0,0,0|2,0,0]=4 3178 B17R2.5273 Cc1cccc(C(=O)Cc2ccccc2)c1 Amb6301913 [0,2,0,0,0,0|2,0,0]=4 3179 B17R2.5273 Cc1cccc(C(=O)Nc2ccccc2)c1 Amb3360913 [0,2,0,0,0,0|1,0,1]=4 3180 B17R2.5273 Cc1cccc(C(N)Cc2ccccc2)c1 Amb5736372 [0,2,0,0,0,0|2,0,0]=4 3181 B17R2.5273 Cc1cccc(C(O)Cc2ccccc2)c1 Amb17241191 [0,2,0,0,0,0|2,0,0]=4 3182 B17R2.5273 NC(Cc1ccccc1)c2cccc(Cl)c2 Amb5736381 [0,2,0,0,0,0|2,0,0]=4 3183 B17R2.5273 Nc1cccc(C(=O)Cc2ccccc2)c1 Amb17339671 [0,2,0,0,0,0|2,0,0]=4 3184 B17R2.5273 Nc1cccc(C(=O)Nc2ccccc2)c1 Amb6447152 [0,2,0,0,0,0|1,0,1]=4 3185 B17R2.5273 Nc1cccc(C(=O)Nc2cccnc2)c1 Amb1112903 [0,2,0,0,0,0|2,0,0]=4 3186 B17R2.5273 Nc1cncc(C(=O)Nc2ccccc2)c1 Amb31097442 [0,2,0,0,0,0|0,0,1]=3 3187 B17R2.5273 O=C(Cc1ccccc1)c2cccc(Br)c2 Amb3941063 [0,2,0,0,0,0|2,0,0]=4 3188 B17R2.5273 O=C(Cc1ccccc1)c2cccc(Cl)c2 Amb6301908 [0,2,0,0,0,0|2,0,0]=4 3189 B17R2.5273 O=C(Cc1ccccc1)c2cccc(I)c2 Amb6301910 [0,2,0,0,0,0|2,0,0]=4 3190 B17R2.5273 O=C(Cc1cccnc1)c2cccc(Cl)c2 Amb24064173 [0,2,0,0,0,0|1,0,0]=3 3191 B17R2.5273 O=C(Nc1ccccc1)c2ccc[n+]([O-])c2 Amb22522546 [0,2,0,0,0,0|0,0,2]=4 3192 B17R2.5273 O=C(Nc1ccccc1)c2cccc(Br)c2 Amb1852030 [0,2,0,0,0,0|1,0,1]=4 3193 B17R2.5273 O=C(Nc1ccccc1)c2cccc(Cl)c2 Amb6340869 [0,2,0,0,0,0|1,0,1]=4 3194 B17R2.5273 O=C(Nc1ccccc1)c2cccc(F)c2 Amb6397729 [0,2,0,0,0,0|1,0,1]=4 3195 B17R2.5273 O=C(Nc1ccccc1)c2cccc(O)c2 Amb6671449 [0,2,0,0,0,0|1,0,1]=4 3196 B17R2.5273 O=C(Nc1ccccc1)c2cncc(Br)c2 Amb1234274 [0,2,0,0,0,0|0,0,1]=3 3197 B17R2.5273 O=C(Nc1cccnc1)c2cccc(Br)c2 Amb3361075 [0,2,0,0,0,0|2,0,0]=4 3198 B17R2.5273 O=C(Nc1cccnc1)c2cccc(I)c2 Amb6402419 [0,2,0,0,0,0|2,0,0]=4 3199 B17R2.5273 OC(Cc1ccccc1)c2cccc(Br)c2 Amb17279931 [0,2,0,0,0,0|2,0,0]=4 3200 B17R2.5273 OC(Cc1ccccc1)c2cccc(Cl)c2 Amb17250538 [0,2,0,0,0,0|2,0,0]=4 3201 B17R2.5293 CC(Nc1cc(Cl)ncn1)c2cccnc2 Amb18974437 [0,2,0,0,0,0|2,0,0]=4 3202 B17R2.5293 CC(Nc1cc(N)ccn1)c2ccccc2 Amb17340018 [0,2,0,0,0,0|2,0,0]=4 3203 B17R2.5293 CC(Nc1cc(N)ccn1)c2cccnc2 Amb18293575 [0,2,0,0,0,0|1,0,0]=3 3204 B17R2.5293 CC(Nc1ccnc(Cl)n1)c2cccnc2 Amb18990051 [0,2,0,0,0,0|2,0,0]=4 3205 B17R2.5293 CC(Oc1cccc(N)c1)c2ccccc2 Amb18111929 [0,2,0,0,0,0|2,0,0]=4 3206 B17R2.5293 CN(Cc1cccc(Br)c1)c2ccccc2 Amb33276209 [0,2,0,0,0,0|1,0,0]=3 3207 B17R2.5293 CN(Cc1cccc(N)c1)c2ccccc2 Amb6248267 [0,2,0,0,0,0|1,0,0]=3 3208 B17R2.5293 Cc1cccc(CC(=O)c2ccccc2)c1 Amb6301928 [0,2,0,0,0,0|2,0,0]=4 3209 B17R2.5293 Cc1cccc(CC(Cl)c2ccccc2)c1 Amb2794065 [0,2,0,0,0,0|2,0,0]=4 3210 B17R2.5293 Cc1cccc(CC(N)c2ccccc2)c1 Amb5736424 [0,2,0,0,0,0|2,0,0]=4 3211 B17R2.5293 Cc1cccc(CC(O)c2ccccc2)c1 Amb17241186 [0,2,0,0,0,0|2,0,0]=4 3212 B17R2.5293 Cc1cccc(CC(O)c2cccnc2)c1 Amb17241427 [0,2,0,0,0,0|1,0,0]=3 3213 B17R2.5293 Cc1cccc(NC(=N)c2ccccc2)c1 Amb19149181 [0,2,0,0,0,0|1,0,1]=4 3214 B17R2.5293 Cc1cccc(NC(=O)c2ccccc2)c1 Amb6317805 [0,2,0,0,0,0|1,0,1]=4 3215 B17R2.5293 Cc1cccc(OC(=O)c2cccnc2)c1 Amb2660596 [0,2,0,0,0,0|1,0,1]=4 3216 B17R2.5293 Cc1cccc(OC(C)c2cccnc2)n1 Amb33612163 [0,2,0,0,0,0|2,0,0]=4 3217 B17R2.5293 NC(Cc1cccc(Cl)c1)c2ccccc2 Amb5736664 [0,2,0,0,0,0|2,0,0]=4 3218 B17R2.5293 NC(Cc1cccc(O)c1)c2ccccc2 Amb18300564 [0,2,0,0,0,0|2,0,0]=4 3219 B17R2.5293 NC(Cc1cccc(O)c1)c2ccccc2 Amb33549620 [0,2,0,0,0,0|2,0,0]=4 3220 B17R2.5293 Nc1cccc(CS(=O)c2ccccc2)c1 Amb18977539 [0,2,0,0,0,0|2,0,0]=4 3221 B17R2.5293 Nc1cccc(NC(=O)c2ccccc2)c1 Amb6315785 [0,2,0,0,0,0|1,0,1]=4 3222 B17R2.5293 Nc1cccc(NC(=O)c2cccnc2)c1 Amb1115621 [0,2,0,0,0,0|0,0,1]=3 3223 B17R2.5293 O=C(Cc1cccc(Br)c1)c2ccccc2 Amb3941064 [0,2,0,0,0,0|2,0,0]=4 3224 B17R2.5293 O=C(Cc1cccc(Cl)c1)c2ccccc2 Amb6301926 [0,2,0,0,0,0|2,0,0]=4 3225 B17R2.5293 O=C(Cc1cccc(Cl)c1)c2cccnc2 Amb17611059 [0,2,0,0,0,0|1,0,1]=4 3226 B17R2.5293 O=C(Nc1cccc(Br)c1)c2ccccc2 Amb6399038 [0,2,0,0,0,0|1,0,1]=4 3227 B17R2.5293 O=C(Nc1cccc(Br)c1)c2cccnc2 Amb1214351 [0,2,0,0,0,0|0,0,1]=3 3228 B17R2.5293 O=C(Nc1cccc(Cl)c1)c2cccnc2 Amb1776574 [0,2,0,0,0,0|0,0,1]=3 3229 B17R2.5293 O=C(Nc1cccc(Cl)c1)c2cccnn2 Amb1080094 [0,2,0,0,0,0|1,0,1]=4 3230 B17R2.5293 O=C(Nc1cccc(F)c1)c2cccnc2 Amb6347543 [0,2,0,0,0,0|0,0,1]=3 3231 B17R2.5293 O=C(Nc1cccc(F)c1)c2cccnn2 Amb1079917 [0,2,0,0,0,0|1,0,1]=4 3232 B17R2.5293 O=C(Nc1cccc(I)c1)c2cccnc2 Amb8232564 [0,2,0,0,0,0|0,0,1]=3 3233 B17R2.5293 O=C(Nc1cccc(O)c1)c2ccccc2 Amb1790104 [0,2,0,0,0,0|1,0,1]=4 3234 B17R2.5293 O=C(Nc1cccc(O)c1)c2cccnc2 Amb2549781 [0,2,0,0,0,0|0,0,1]=3 3235 B17R2.5293 O=C(Nc1cncc(Br)c1)c2ccccc2 Amb32410770 [0,2,0,0,0,0|2,0,0]=4 3236 B17R2.5293 O=C(Oc1cccc(Cl)c1)c2cccnc2 Amb24102554 [0,2,0,0,0,0|1,0,1]=4 3237 B17R2.5293 OC(Cc1cccc(Cl)c1)c2ccccc2 Amb17250530 [0,2,0,0,0,0|2,0,0]=4 3238 B17R2.5293 OC(Cc1cccc(Cl)c1)c2cccnc2 Amb17251232 [0,2,0,0,0,0|1,0,0]=3 3239 B17R2.5293 S=C(Cc1cccc(Cl)c1)c2ccccc2 Amb24308869 [0,2,0,0,0,0|2,0,0]=4 3240 B17R2.5293 S=C(Nc1cccc(Cl)c1)c2ccccc2 Amb2611262 [0,2,0,0,0,0|1,0,1]=4 3241 B17R2.10205 BrC(c1ccccc1)C(Br)c2ccccc2 Amb2721555 [0,2,0,0,0,0|2,0,0]=4 3242 B17R2.10205 Br[C@@H](c1ccccc1)[C@H](Br)c2ccccc2 Amb28463678 [0,2,0,0,0,0|2,0,0]=4 3243 B17R2.10205 CC(C(=O)c1ccccc1)c2ccccc2 Amb4036456 [0,2,0,0,0,0|2,0,0]=4 3244 B17R2.10205 CC(c1ccccc1)C(C)c2ccccc2 Amb2385896 [0,2,0,0,0,0|2,0,0]=4 3245 B17R2.10205 CN(C(=O)c1ccccc1)c2ccccc2 Amb6347163 [0,2,0,0,0,0|1,0,1]=4 3246 B17R2.10205 FC(c1ccccc1)C(F)c2ccccc2 Amb22547455 [0,2,0,0,0,0|2,0,0]=4 3247 B17R2.10205 NC(C(=O)c1ccccc1)c2ccccc2 Amb17939052 [0,2,0,0,0,0|2,0,0]=4 3248 B17R2.10205 NC(C(=O)c1ccccc1)c2ccccc2 Amb19373676 [0,2,0,0,0,0|2,0,0]=4 3249 B17R2.10205 NC(c1ccccc1)C(N)c2ccccc2 Amb8385081 [0,2,0,0,0,0|2,0,0]=4 3250 B17R2.10205 NC(c1ccccc1)C(O)c2ccccc2 Amb21984437 [0,2,0,0,0,0|2,0,0]=4 3251 B17R2.10205 NC(c1ccccc1)C(O)c2ccccc2 Amb2699027 [0,2,0,0,0,0|2,0,0]=4 3252 B17R2.10205 NN(C(=O)c1ccccc1)c2ccccc2 Amb3998357 [0,2,0,0,0,0|1,0,1]=4 3253 B17R2.10205 N[C@@H](c1ccccc1)[C@@H](N)c2ccccc2 Amb2687665 [0,2,0,0,0,0|2,0,0]=4 3254 B17R2.10205 N[C@@H](c1ccccc1)[C@@H](N)c2ccccc2 Amb33714403 [0,2,0,0,0,0|2,0,0]=4 3255 B17R2.10205 N[C@@H](c1ccccc1)[C@@H](O)c2ccccc2 Amb6306842 [0,2,0,0,0,0|2,0,0]=4 3256 B17R2.10205 N[C@@H](c1ccccc1)[C@H](N)c2ccccc2 Amb1093402 [0,2,0,0,0,0|2,0,0]=4 3257 B17R2.10205 N[C@@H](c1ccccc1)[C@H](O)c2ccccc2 Amb8628456 [0,2,0,0,0,0|2,0,0]=4 3258 B17R2.10205 N[C@H](c1ccccc1)[C@@H](O)c2ccccc2 Amb17779637 [0,2,0,0,0,0|2,0,0]=4 3259 B17R2.10205 N[C@H](c1ccccc1)[C@H](N)c2ccccc2 Amb2687664 [0,2,0,0,0,0|2,0,0]=4 3260 B17R2.10205 N[C@H](c1ccccc1)[C@H](O)c2ccccc2 Amb6306843 [0,2,0,0,0,0|2,0,0]=4 3261 B17R2.10205 O=C(c1ccccc1)C(Br)c2ccccc2 Amb2792465 [0,2,0,0,0,0|2,0,0]=4 3262 B17R2.10205 O=C(c1ccccc1)C(Cl)c2ccccc2 Amb1676617 [0,2,0,0,0,0|2,0,0]=4 3263 B17R2.10205 O=C(c1ccccc1)C(O)c2ccccc2 Amb9703088 [0,2,0,0,0,0|2,0,0]=4 3264 B17R2.10205 O=C(c1ccccc1)N(O)c2ccccc2 Amb6364934 [0,2,0,0,0,0|1,0,1]=4 3265 B17R2.10205 OC(c1ccccc1)C(O)c2ccccc2 Amb2609048 [0,2,0,0,0,0|2,0,0]=4 3266 B17R2.10205 OC(c1cccnc1)C(O)c2cccnc2 Amb21858595 [0,2,0,0,0,0|2,0,0]=4 3267 B17R2.10205 O[C@@H](c1ccccc1)[C@@H](O)c2ccccc2 Amb6356700 [0,2,0,0,0,0|2,0,0]=4 3268 B17R2.10205 O[C@H](c1ccccc1)[C@H](O)c2ccccc2 Amb2388291 [0,2,0,0,0,0|2,0,0]=4 3269 B17R2.20249 CC(N)(Cc1ccccc1)c2ccccc2 Amb32663716 [0,2,0,0,0,0|2,0,0]=4 3270 B17R2.20249 CC(N)(Cc1ccccc1)c2ccccc2 Amb9781831 [0,2,0,0,0,0|2,0,0]=4 3271 B17R2.20249 CC(O)(Cc1ccccc1)c2ccccc2 Amb6356847 [0,2,0,0,0,0|2,0,0]=4 3272 B17R2.20249 CC(O)(Cc1ccccc1)c2cccnc2 Amb32662755 [0,2,0,0,0,0|1,0,0]=3 3273 B17R2.20249 C[N+](C)(Cc1ccccc1)c2ccccc2 Amb4008644 [0,2,0,0,0,0|1,0,1]=4 3274 B17R2.20249 C[P@@+]([O-])(Cc1ccccc1)c2ccccc2 Amb17844213 [0,2,0,0,0,0|1,1,0]=4 3275 B17R2.20249 O=S(=O)(Cc1ccccc1)c2ccccc2 Amb2684671 [0,2,0,0,0,0|2,0,0]=4 3276 B17R2.20249 O=S(=O)(Cc1cccnc1)c2ccccc2 Amb8255387 [0,2,0,0,0,0|1,0,0]=3 3277 B17R2.20249 O=S(=O)(Nc1ccccc1)c2ccccc2 Amb1538809 [0,2,0,0,0,0|2,0,0]=4 3278 B17R2.20249 O=S(=O)(Nc1ccccc1)c2cccnc2 Amb24062565 [0,2,0,0,0,0|1,0,0]=3 3279 B17R2.20249 O=S(=O)(Nc1cccnc1)c2cccnc2 Amb24062564 [0,2,0,0,0,0|2,0,0]=4 3280 B17R2.20249 O=S(=O)(Oc1ccccc1)c2cccnc2 Amb2609736 [0,2,0,0,0,0|2,0,0]=4 3281 B17R2.48 BrCc1ccc(OCc2ccccc2)cc1 Amb8835462 [0,2,0,0,0,0|2,0,0]=4 3282 B17R2.48 BrCc1ccc(OCc2ccccc2)cn1 Amb23399977 [0,2,0,0,0,0|2,0,0]=4 3283 B17R2.48 C#Cc1ccc(OCc2ccccc2)cc1 Amb2413200 [0,2,0,0,0,0|2,0,0]=4 3284 B17R2.48 C=Cc1ccc(OCc2ccccc2)cc1 Amb24570123 [0,2,0,0,0,0|2,0,0]=4 3285 B17R2.48 CCc1ccc(CNc2ccccc2)cc1 Amb837896 [0,2,0,0,0,0|1,0,0]=3 3286 B17R2.48 CCc1ccc(CNc2ccccn2)cc1 Amb1763145 [0,2,0,0,0,0|2,0,0]=4 3287 B17R2.48 CCc1ccc(NCc2ccccc2)cc1 Amb837976 [0,2,0,0,0,0|1,0,0]=3 3288 B17R2.48 CCc1ccc(NCc2ccccn2)cc1 Amb6698797 [0,2,0,0,0,0|2,0,0]=4 3289 B17R2.48 CCc1ccc(NCc2cccnc2)cc1 Amb838266 [0,2,0,0,0,0|0,0,0]=2 3290 B17R2.48 CCc1ccc(NCc2ccncc2)cc1 Amb838174 [0,2,0,0,0,0|2,0,0]=4 3291 B17R2.48 CNc1ccc(OCc2ccccc2)cc1 Amb24186941 [0,2,0,0,0,0|2,0,0]=4 3292 B17R2.48 CNc1ccc(OCc2cnccn2)cc1 Amb17132021 [0,2,0,0,0,0|2,0,0]=4 3293 B17R2.48 COc1ccc(CNc2ccccc2)cc1 Amb1017320 [0,2,0,0,0,0|1,0,0]=3 3294 B17R2.48 COc1ccc(CNc2ccccn2)cc1 Amb1011760 [0,2,0,0,0,0|2,0,0]=4 3295 B17R2.48 COc1ccc(CNc2cccnc2)cc1 Amb24063667 [0,2,0,0,0,0|2,0,0]=4 3296 B17R2.48 COc1ccc(CNc2ccncc2)cc1 Amb2383019 [0,2,0,0,0,0|2,0,0]=4 3297 B17R2.48 COc1ccc(COc2ccccc2)cc1 Amb24064723 [0,2,0,0,0,0|2,0,0]=4 3298 B17R2.48 COc1ccc(NCc2ccccc2)cc1 Amb1233294 [0,2,0,0,0,0|1,0,0]=3 3299 B17R2.48 COc1ccc(NCc2ccccc2)cn1 Amb6684765 [0,2,0,0,0,0|2,0,0]=4 3300 B17R2.48 COc1ccc(NCc2ccccn2)cc1 Amb2745016 [0,2,0,0,0,0|2,0,0]=4 3301 B17R2.48 COc1ccc(NCc2cccnc2)cc1 Amb6336218 [0,2,0,0,0,0|0,0,0]=2 3302 B17R2.48 COc1ccc(NCc2ccncc2)cc1 Amb616029 [0,2,0,0,0,0|2,0,0]=4 3303 B17R2.48 COc1ccc(OCc2ccccc2)cc1 Amb1837932 [0,2,0,0,0,0|2,0,0]=4 3304 B17R2.48 CSc1ccc(CNc2ccccc2)cc1 Amb6719501 [0,2,0,0,0,0|1,0,0]=3 3305 B17R2.48 CSc1ccc(CNc2ccccn2)cc1 Amb5559610 [0,2,0,0,0,0|2,0,0]=4 3306 B17R2.48 ClCc1ccc(NCc2ccccc2)cc1 Amb27816136 [0,2,0,0,0,0|1,0,0]=3 3307 B17R2.48 ClCc1ccc(NCc2ccccc2)nc1 Amb23446498 [0,2,0,0,0,0|2,0,0]=4 3308 B17R2.48 ClCc1ccc(OCc2ccccc2)cc1 Amb2719845 [0,2,0,0,0,0|2,0,0]=4 3309 B17R2.48 ClCc1ccc(OCc2ccccc2)cn1 Amb20241420 [0,2,0,0,0,0|2,0,0]=4 3310 B17R2.48 ClCc1ccc(OCc2cccnc2)cc1 Amb10610128 [0,2,0,0,0,0|1,0,0]=3 3311 B17R2.48 N#Cc1ccc(CNc2ccccc2)cc1 Amb6685128 [0,2,0,0,0,0|1,0,0]=3 3312 B17R2.48 N#Cc1ccc(CSc2ccccc2)cc1 Amb4137246 [0,2,0,0,0,0|2,0,0]=4 3313 B17R2.48 N#Cc1ccc(NCc2ccccc2)cc1 Amb6679365 [0,2,0,0,0,0|1,0,0]=3 3314 B17R2.48 N#Cc1ccc(NCc2ccccc2)nc1 Amb33532805 [0,2,0,0,0,0|2,0,0]=4 3315 B17R2.48 N#Cc1ccc(NCc2ccccn2)cc1 Amb6679435 [0,2,0,0,0,0|2,0,0]=4 3316 B17R2.48 N#Cc1ccc(NCc2cccnc2)cc1 Amb6698088 [0,2,0,0,0,0|0,0,0]=2 3317 B17R2.48 N#Cc1ccc(NCc2cccnc2)nc1 Amb6645205 [0,2,0,0,0,0|1,0,0]=3 3318 B17R2.48 N#Cc1ccc(OCc2ccccc2)cc1 Amb2725166 [0,2,0,0,0,0|2,0,0]=4 3319 B17R2.48 N#Cc1ccc(OCc2cccnc2)cc1 Amb6263918 [0,2,0,0,0,0|1,0,0]=3 3320 B17R2.48 N#Cc1ccc(SCc2ccccc2)cc1 Amb2682493 [0,2,0,0,0,0|2,0,0]=4 3321 B17R2.48 NCc1ccc(CCc2ccccc2)cc1 Amb17101792 [0,2,0,0,0,0|2,0,0]=4 3322 B17R2.48 NCc1ccc(COc2ccccc2)cc1 Amb1137568 [0,2,0,0,0,0|2,0,0]=4 3323 B17R2.48 NCc1ccc(COc2ccccc2)cc1 Amb7969879 [0,2,0,0,0,0|2,0,0]=4 3324 B17R2.48 NCc1ccc(NCc2ccccc2)nc1 Amb18066757 [0,2,0,0,0,0|2,0,0]=4 3325 B17R2.48 NCc1ccc(NCc2cccnc2)cc1 Amb5786725 [0,2,0,0,0,0|0,0,0]=2 3326 B17R2.48 NCc1ccc(NCc2cccnc2)nc1 Amb18066802 [0,2,0,0,0,0|1,0,0]=3 3327 B17R2.48 NCc1ccc(OCc2ccccc2)cc1 Amb1117944 [0,2,0,0,0,0|2,0,0]=4 3328 B17R2.48 NCc1ccc(OCc2ccccc2)cc1 Amb15740891 [0,2,0,0,0,0|2,0,0]=4 3329 B17R2.48 NCc1ccc(OCc2ccccc2)cn1 Amb27843861 [0,2,0,0,0,0|2,0,0]=4 3330 B17R2.48 NCc1ccc(OCc2cccnc2)cc1 Amb1119622 [0,2,0,0,0,0|1,0,0]=3 3331 B17R2.48 NCc1ccc(OCc2cnccn2)cc1 Amb17132250 [0,2,0,0,0,0|2,0,0]=4 3332 B17R2.48 NNc1ccc(NCc2ccccc2)cn1 Amb17205441 [0,2,0,0,0,0|2,0,0]=4 3333 B17R2.48 NNc1ccc(NCc2ccccc2)nc1 Amb17205482 [0,2,0,0,0,0|2,0,0]=4 3334 B17R2.48 NNc1ccc(OCc2ccccc2)cc1 Amb1058728 [0,2,0,0,0,0|2,0,0]=4 3335 B17R2.48 NNc1ccc(OCc2ccccc2)cc1 Amb22640974 [0,2,0,0,0,0|2,0,0]=4 3336 B17R2.48 NNc1ccc(OCc2ccccc2)cn1 Amb27777031 [0,2,0,0,0,0|2,0,0]=4 3337 B17R2.48 O=Cc1ccc(COc2ccccc2)cc1 Amb6572321 [0,2,0,0,0,0|2,0,0]=4 3338 B17R2.48 O=Cc1ccc(CSc2ccccc2)cc1 Amb2612857 [0,2,0,0,0,0|2,0,0]=4 3339 B17R2.48 O=Cc1ccc(OCc2ccccc2)cc1 Amb1207194 [0,2,0,0,0,0|2,0,0]=4 3340 B17R2.48 O=Cc1ccc(OCc2cccnc2)cc1 Amb1110477 [0,2,0,0,0,0|1,0,0]=3 3341 B17R2.48 O=Cc1ccc(OCc2cnccn2)cc1 Amb17131921 [0,2,0,0,0,0|2,0,0]=4 3342 B17R2.48 O=Cc1ccc(SCc2ccccc2)cc1 Amb20668530 [0,2,0,0,0,0|2,0,0]=4 3343 B17R2.48 OCc1ccc(COc2ccccc2)cc1 Amb6572323 [0,2,0,0,0,0|2,0,0]=4 3344 B17R2.48 OCc1ccc(OCc2ccccc2)cc1 Amb6356514 [0,2,0,0,0,0|2,0,0]=4 3345 B17R2.48 OCc1ccc(OCc2ccccc2)cn1 Amb22494085 [0,2,0,0,0,0|2,0,0]=4 3346 B17R2.48 OCc1ccc(OCc2cccnc2)cc1 Amb6705855 [0,2,0,0,0,0|1,0,0]=3 3347 B17R2.48 OCc1ccc(SCc2ccccc2)cc1 Amb24092770 [0,2,0,0,0,0|2,0,0]=4 3348 B17R2.48 SCc1ccc(OCc2ccccc2)cc1 Amb16192528 [0,2,0,0,0,0|2,0,0]=4 3349 B17R2.48 [C-]#[N+]c1ccc(OCc2ccccc2)cc1 Amb2236628 [0,2,0,0,0,0|2,0,0]=4 3350 B17R2.48 [NH3+]Cc1ccc(OCc2ccccc2)cc1 Amb2444410 [0,2,0,0,0,0|2,0,0]=4 3351 B17R2.193 CN1C=C(NCc2ccccc2)C=CC1=O Amb18289620 [0,2,0,0,0,0|2,0,0]=4 3352 B17R2.193 CN1C=CC(NCc2ccccc2)=CC1=O Amb28140713 [0,2,0,0,0,0|2,0,0]=4 3353 B17R2.193 Cc1cc(CNc2ccccc2)ccc1F Amb17404428 [0,2,0,0,0,0|1,0,0]=3 3354 B17R2.193 Cc1cc(NCc2ccccc2)ccc1Br Amb6691704 [0,2,0,0,0,0|1,0,0]=3 3355 B17R2.193 Cc1cc(NCc2ccccc2)cnc1Br Amb27981368 [0,2,0,0,0,0|2,0,0]=4 3356 B17R2.193 Cc1cc(NCc2ccccc2)ncc1N Amb17213757 [0,2,0,0,0,0|2,0,0]=4 3357 B17R2.193 Cc1cc(NCc2ccccn2)ccc1Br Amb1897872 [0,2,0,0,0,0|2,0,0]=4 3358 B17R2.193 Cc1cc(NCc2cccnc2)ccc1Br Amb6691652 [0,2,0,0,0,0|0,0,0]=2 3359 B17R2.193 Cc1cc(NCc2cccnc2)ncc1N Amb18225247 [0,2,0,0,0,0|1,0,0]=3 3360 B17R2.193 Cc1cc(NCc2ccncc2)ccc1Br Amb6381764 [0,2,0,0,0,0|2,0,0]=4 3361 B17R2.193 Cc1cc(OCc2ccccc2)ccc1Br Amb2612257 [0,2,0,0,0,0|2,0,0]=4 3362 B17R2.193 Cc1cc(OCc2ccccc2)ccc1Cl Amb22451441 [0,2,0,0,0,0|2,0,0]=4 3363 B17R2.193 Cc1cc(OCc2ccccc2)ccc1N Amb1114913 [0,2,0,0,0,0|2,0,0]=4 3364 B17R2.193 Cc1cc(OCc2ccccc2)ccc1O Amb26380767 [0,2,0,0,0,0|2,0,0]=4 3365 B17R2.193 Cc1cc(OCc2ccccc2)cnc1Cl Amb22751360 [0,2,0,0,0,0|2,0,0]=4 3366 B17R2.193 Cc1cc(OCc2cccnc2)ccc1N Amb1121406 [0,2,0,0,0,0|1,0,0]=3 3367 B17R2.193 Cc1cc(OCc2cccnc2)ncc1N Amb31097640 [0,2,0,0,0,0|2,0,0]=4 3368 B17R2.193 Cc1cc(OCc2cnccn2)ccc1N Amb17132078 [0,2,0,0,0,0|2,0,0]=4 3369 B17R2.193 Cc1ccc(CNc2ccccc2)cc1C Amb9622211 [0,2,0,0,0,0|1,0,0]=3 3370 B17R2.193 Cc1ccc(NCc2ccccc2)cc1Br Amb17169140 [0,2,0,0,0,0|1,0,0]=3 3371 B17R2.193 Cc1ccc(NCc2ccccc2)cc1C Amb3699217 [0,2,0,0,0,0|1,0,0]=3 3372 B17R2.193 Cc1ccc(NCc2ccccc2)cc1Cl Amb6650002 [0,2,0,0,0,0|1,0,0]=3 3373 B17R2.193 Cc1ccc(NCc2ccccc2)cc1N Amb27870334 [0,2,0,0,0,0|1,0,0]=3 3374 B17R2.193 Cc1ccc(NCc2ccccn2)cc1Br Amb17169497 [0,2,0,0,0,0|2,0,0]=4 3375 B17R2.193 Cc1ccc(NCc2ccccn2)cc1C Amb6381682 [0,2,0,0,0,0|2,0,0]=4 3376 B17R2.193 Cc1ccc(NCc2ccccn2)cc1Cl Amb6687853 [0,2,0,0,0,0|2,0,0]=4 3377 B17R2.193 Cc1ccc(NCc2cccnc2)cc1Br Amb17169498 [0,2,0,0,0,0|0,0,0]=2 3378 B17R2.193 Cc1ccc(NCc2cccnc2)cc1C Amb6695579 [0,2,0,0,0,0|0,0,0]=2 3379 B17R2.193 Cc1ccc(NCc2cccnc2)cc1Cl Amb6687817 [0,2,0,0,0,0|0,0,0]=2 3380 B17R2.193 Cc1ccc(NCc2cccnc2)cc1F Amb33619208 [0,2,0,0,0,0|0,0,0]=2 3381 B17R2.193 Cc1ccc(NCc2ccncc2)cc1Br Amb17169499 [0,2,0,0,0,0|2,0,0]=4 3382 B17R2.193 Cc1ccc(NCc2ccncc2)cc1C Amb6415417 [0,2,0,0,0,0|2,0,0]=4 3383 B17R2.193 Cc1ccc(NCc2ccncc2)cc1Cl Amb6687820 [0,2,0,0,0,0|2,0,0]=4 3384 B17R2.193 Cc1ccc(OCc2ccccc2)cc1Br Amb22229507 [0,2,0,0,0,0|2,0,0]=4 3385 B17R2.193 Cc1ccc(OCc2ccccc2)cc1C Amb25168747 [0,2,0,0,0,0|2,0,0]=4 3386 B17R2.193 Cc1ccc(OCc2ccccc2)cc1F Amb22489996 [0,2,0,0,0,0|2,0,0]=4 3387 B17R2.193 Cc1ccc(OCc2ccccc2)cc1N Amb17140790 [0,2,0,0,0,0|2,0,0]=4 3388 B17R2.193 Cc1ccc(OCc2ccccc2)cc1N Amb33328732 [0,2,0,0,0,0|2,0,0]=4 3389 B17R2.193 Cc1ccc(OCc2ccccc2)cc1O Amb23568466 [0,2,0,0,0,0|2,0,0]=4 3390 B17R2.193 Cc1ccc(\N=C\c2cccnc2)cc1Br Amb6343115 [0,2,0,0,0,0|0,0,2]=4 3391 B17R2.193 Cc1ccc(\N=C\c2cccnc2)cc1C Amb6381492 [0,2,0,0,0,0|0,0,2]=4 3392 B17R2.193 Cc1cnc(NCc2ccccc2)cc1N Amb27170234 [0,2,0,0,0,0|2,0,0]=4 3393 B17R2.193 Cc1nc(NCc2ccccc2)ccc1I Amb28383082 [0,2,0,0,0,0|2,0,0]=4 3394 B17R2.193 Cc1nc(NCc2ccccc2)ccc1N Amb17213826 [0,2,0,0,0,0|2,0,0]=4 3395 B17R2.193 Cc1nc(NCc2cccnc2)ccc1N Amb18866529 [0,2,0,0,0,0|1,0,0]=3 3396 B17R2.193 Clc1cc(NCc2cccnc2)ccc1Br Amb33473696 [0,2,0,0,0,0|0,0,0]=2 3397 B17R2.193 Clc1cc(NCc2cccnc2)ccc1Br Amb33473711 [0,2,0,0,0,0|0,0,0]=2 3398 B17R2.193 Clc1cc(NCc2ccncc2)ccc1Br Amb33473725 [0,2,0,0,0,0|2,0,0]=4 3399 B17R2.193 Clc1cc(NCc2ccncc2)ccc1Br Amb33473726 [0,2,0,0,0,0|2,0,0]=4 3400 B17R2.193 Clc1cc(OCc2ccccc2)cnc1Cl Amb19959573 [0,2,0,0,0,0|2,0,0]=4 3401 B17R2.193 Clc1cc(\N=C\c2cccnc2)ccc1Br Amb6386993 [0,2,0,0,0,0|0,0,2]=4 3402 B17R2.193 Clc1ccc(NCc2ccccn2)cc1Cl Amb6693427 [0,2,0,0,0,0|2,0,0]=4 3403 B17R2.193 Clc1ccc(NCc2cccnc2)cc1Cl Amb837870 [0,2,0,0,0,0|0,0,0]=2 3404 B17R2.193 Clc1ccc(NCc2ccncc2)cc1Cl Amb837718 [0,2,0,0,0,0|2,0,0]=4 3405 B17R2.193 Clc1ccc(OCc2ccccc2)cc1Br Amb28060332 [0,2,0,0,0,0|2,0,0]=4 3406 B17R2.193 Clc1ccc(OCc2ccccc2)cc1Cl Amb22442443 [0,2,0,0,0,0|2,0,0]=4 3407 B17R2.193 Clc1ccc(\N=C\c2cccnc2)cc1Cl Amb6399780 [0,2,0,0,0,0|0,0,2]=4 3408 B17R2.193 Clc1ncc(OCc2ccccc2)cc1I Amb28189477 [0,2,0,0,0,0|2,0,0]=4 3409 B17R2.193 Fc1cc(OCc2ccccc2)ccc1Br Amb10841589 [0,2,0,0,0,0|2,0,0]=4 3410 B17R2.193 Fc1cc(OCc2ccccc2)cnc1Cl Amb28069793 [0,2,0,0,0,0|2,0,0]=4 3411 B17R2.193 Fc1ccc(NCc2ccccc2)cc1Br Amb28056800 [0,2,0,0,0,0|1,0,0]=3 3412 B17R2.193 Fc1ccc(NCc2ccccc2)cc1Cl Amb837933 [0,2,0,0,0,0|1,0,0]=3 3413 B17R2.193 Fc1ccc(NCc2ccccc2)cc1F Amb6695004 [0,2,0,0,0,0|1,0,0]=3 3414 B17R2.193 Fc1ccc(NCc2ccccn2)cc1Cl Amb9206235 [0,2,0,0,0,0|2,0,0]=4 3415 B17R2.193 Fc1ccc(NCc2ccccn2)cc1F Amb6695012 [0,2,0,0,0,0|2,0,0]=4 3416 B17R2.193 Fc1ccc(NCc2cccnc2)cc1Cl Amb1930824 [0,2,0,0,0,0|0,0,0]=2 3417 B17R2.193 Fc1ccc(NCc2cccnc2)cc1F Amb6694912 [0,2,0,0,0,0|0,0,0]=2 3418 B17R2.193 Fc1ccc(NCc2ccncc2)cc1Br Amb33473712 [0,2,0,0,0,0|2,0,0]=4 3419 B17R2.193 Fc1ccc(NCc2ccncc2)cc1Br Amb33473713 [0,2,0,0,0,0|2,0,0]=4 3420 B17R2.193 Fc1ccc(NCc2ccncc2)cc1Cl Amb837747 [0,2,0,0,0,0|2,0,0]=4 3421 B17R2.193 Fc1ccc(NCc2ccncc2)cc1F Amb6694917 [0,2,0,0,0,0|2,0,0]=4 3422 B17R2.193 Fc1ccc(OCc2ccccc2)cc1Br Amb28192649 [0,2,0,0,0,0|2,0,0]=4 3423 B17R2.193 Nc1cc(CNc2ccccn2)ccc1O Amb17100063 [0,2,0,0,0,0|2,0,0]=4 3424 B17R2.193 Nc1cc(OCc2ccccc2)ccc1Br Amb21964593 [0,2,0,0,0,0|2,0,0]=4 3425 B17R2.193 Nc1cc(OCc2ccccc2)ccc1Cl Amb17157659 [0,2,0,0,0,0|2,0,0]=4 3426 B17R2.193 Nc1cc(OCc2ccccc2)ccc1F Amb8439034 [0,2,0,0,0,0|2,0,0]=4 3427 B17R2.193 Nc1cc(OCc2ccccc2)ccc1O Amb18131930 [0,2,0,0,0,0|2,0,0]=4 3428 B17R2.193 Nc1ccc(OCc2ccccc2)cc1Br Amb24419727 [0,2,0,0,0,0|2,0,0]=4 3429 B17R2.193 Nc1ccc(OCc2ccccc2)cc1Cl Amb24309266 [0,2,0,0,0,0|2,0,0]=4 3430 B17R2.193 Nc1ccc(OCc2ccccc2)cc1F Amb18980920 [0,2,0,0,0,0|2,0,0]=4 3431 B17R2.193 Nc1ccc(OCc2ccccc2)cc1F Amb33849608 [0,2,0,0,0,0|2,0,0]=4 3432 B17R2.193 Nc1ccc(OCc2ccccc2)cc1N Amb17609273 [0,2,0,0,0,0|2,0,0]=4 3433 B17R2.193 Nc1ccc(OCc2ccccc2)cc1N Amb21964591 [0,2,0,0,0,0|2,0,0]=4 3434 B17R2.193 Nc1ccc(OCc2ccccc2)cc1N Amb32758672 [0,2,0,0,0,0|2,0,0]=4 3435 B17R2.193 Nc1ccc(OCc2ccccc2)cc1O Amb25131155 [0,2,0,0,0,0|2,0,0]=4 3436 B17R2.193 Nc1ccc(OCc2ccccc2)cc1S Amb18939291 [0,2,0,0,0,0|2,0,0]=4 3437 B17R2.193 Nc1nc(NCc2cccnc2)ncc1F Amb31175805 [0,2,0,0,0,0|2,0,0]=4 3438 B17R2.193 Nc1ncc(OCc2ccccc2)cc1Br Amb22900451 [0,2,0,0,0,0|2,0,0]=4 3439 B17R2.193 Oc1cc(OCc2ccccc2)ccc1Br Amb27762383 [0,2,0,0,0,0|2,0,0]=4 3440 B17R2.193 Oc1cc(OCc2ccccc2)ccc1Cl Amb28343858 [0,2,0,0,0,0|2,0,0]=4 3441 B17R2.193 Oc1cc(OCc2ccccc2)ccc1F Amb24548672 [0,2,0,0,0,0|2,0,0]=4 3442 B17R2.193 Oc1cc(OCc2ccccc2)ccc1I Amb27653012 [0,2,0,0,0,0|2,0,0]=4 3443 B17R2.193 Oc1cc(OCc2ccccc2)ccc1S Amb33080666 [0,2,0,0,0,0|2,0,0]=4 3444 B17R2.193 Oc1ccc(CNc2ccccn2)cc1Br Amb17100056 [0,2,0,0,0,0|2,0,0]=4 3445 B17R2.193 Oc1ccc(NCc2ccccc2)cc1F Amb27199557 [0,2,0,0,0,0|1,0,0]=3 3446 B17R2.193 Oc1ccc(NCc2ccccc2)cc1O Amb27413633 [0,2,0,0,0,0|1,0,0]=3 3447 B17R2.193 Oc1ccc(OCc2ccccc2)cc1Br Amb23438858 [0,2,0,0,0,0|2,0,0]=4 3448 B17R2.193 Oc1ccc(OCc2ccccc2)cc1Cl Amb24563131 [0,2,0,0,0,0|2,0,0]=4 3449 B17R2.193 Oc1ccc(OCc2ccccc2)cc1F Amb25050085 [0,2,0,0,0,0|2,0,0]=4 3450 B17R2.193 Oc1ccc(OCc2ccccc2)cc1O Amb27164683 [0,2,0,0,0,0|2,0,0]=4 3451 B17R2.193 Oc1ccc(OCc2ccccc2)cc1S Amb25168756 [0,2,0,0,0,0|2,0,0]=4 3452 B17R2.207 Brc1ccc(CCc2ccc(Br)cc2)cc1 Amb17672571 [0,2,0,0,0,0|2,0,0]=4 3453 B17R2.207 Cc1ccc(CCc2ccc(C)cc2)cc1 Amb6335821 [0,2,0,0,0,0|2,0,0]=4 3454 B17R2.207 Cc1ccc(CNc2ccc(Br)cc2)cc1 Amb3744256 [0,2,0,0,0,0|1,0,0]=3 3455 B17R2.207 Cc1ccc(CNc2ccc(Br)cn2)cc1 Amb6612482 [0,2,0,0,0,0|2,0,0]=4 3456 B17R2.207 Cc1ccc(CNc2ccc(C)cc2)cc1 Amb3765443 [0,2,0,0,0,0|1,0,0]=3 3457 B17R2.207 Cc1ccc(CNc2ccc(Cl)cc2)cc1 Amb3725042 [0,2,0,0,0,0|1,0,0]=3 3458 B17R2.207 Cc1ccc(CNc2ccc(F)cc2)cc1 Amb3699183 [0,2,0,0,0,0|1,0,0]=3 3459 B17R2.207 Cc1ccc(CNc2ccc(N)cn2)cc1 Amb7768075 [0,2,0,0,0,0|2,0,0]=4 3460 B17R2.207 Cc1ccc(CNc2ccc(N)nc2)cc1 Amb7768065 [0,2,0,0,0,0|2,0,0]=4 3461 B17R2.207 Cc1ccc(CNc2ccc(O)cc2)cc1 Amb6857102 [0,2,0,0,0,0|1,0,0]=3 3462 B17R2.207 Cc1ccc(COc2ccc(N)cc2)cc1 Amb1121413 [0,2,0,0,0,0|2,0,0]=4 3463 B17R2.207 Cc1ccc(COc2ccc(N)nc2)cc1 Amb31133494 [0,2,0,0,0,0|2,0,0]=4 3464 B17R2.207 Cc1ccc(CSc2ccc(N)cc2)cc1 Amb8930371 [0,2,0,0,0,0|2,0,0]=4 3465 B17R2.207 Cc1ccc(CSc2ccc(N)nc2)cc1 Amb8933177 [0,2,0,0,0,0|2,0,0]=4 3466 B17R2.207 Cc1ccc(NCc2ccc(Br)cc2)cc1 Amb838972 [0,2,0,0,0,0|1,0,0]=3 3467 B17R2.207 Cc1ccc(NCc2ccc(Cl)cc2)cc1 Amb839006 [0,2,0,0,0,0|1,0,0]=3 3468 B17R2.207 Cc1ccc(NCc2ccc(F)cc2)cc1 Amb4313369 [0,2,0,0,0,0|1,0,0]=3 3469 B17R2.207 Cc1ccc(NCc2ccc(O)cc2)cc1 Amb3547087 [0,2,0,0,0,0|1,0,0]=3 3470 B17R2.207 Cc1ccc(NNc2ccc(N)cc2)cc1 Amb24103301 [0,2,0,0,0,0|2,0,0]=4 3471 B17R2.207 Cc1ccc(OCc2ccc(Br)cc2)cc1 Amb24064692 [0,2,0,0,0,0|2,0,0]=4 3472 B17R2.207 Clc1ccc(CCc2ccc(Cl)cc2)cc1 Amb2752768 [0,2,0,0,0,0|2,0,0]=4 3473 B17R2.207 Clc1ccc(CNc2ccc(Br)cc2)cc1 Amb839010 [0,2,0,0,0,0|1,0,0]=3 3474 B17R2.207 Clc1ccc(CNc2ccc(Cl)cn2)cc1 Amb6585523 [0,2,0,0,0,0|2,0,0]=4 3475 B17R2.207 Clc1ccc(COc2ccc(I)cc2)cc1 Amb4985461 [0,2,0,0,0,0|2,0,0]=4 3476 B17R2.207 Clc1ccc(NNc2ccc(Cl)cc2)cc1 Amb22057503 [0,2,0,0,0,0|2,0,0]=4 3477 B17R2.207 Clc1ccc(OCc2ccc(Br)cc2)cc1 Amb4853935 [0,2,0,0,0,0|2,0,0]=4 3478 B17R2.207 Fc1ccc(CCc2ccc(F)cc2)cc1 Amb2759832 [0,2,0,0,0,0|2,0,0]=4 3479 B17R2.207 Fc1ccc(CNc2ccc(Cl)cn2)cc1 Amb6620995 [0,2,0,0,0,0|2,0,0]=4 3480 B17R2.207 Fc1ccc(COc2ccc(Br)cc2)cc1 Amb6665066 [0,2,0,0,0,0|2,0,0]=4 3481 B17R2.207 Fc1ccc(COc2ccc(Cl)cc2)cc1 Amb1547339 [0,2,0,0,0,0|2,0,0]=4 3482 B17R2.207 Fc1ccc(NCc2ccc(Cl)cc2)cc1 Amb4313433 [0,2,0,0,0,0|1,0,0]=3 3483 B17R2.207 Nc1ccc(CCc2ccc(N)cc2)cc1 Amb264309 [0,2,0,0,0,0|2,0,0]=4 3484 B17R2.207 Nc1ccc(CCc2ccc(N)cc2)cc1 Amb4017082 [0,2,0,0,0,0|2,0,0]=4 3485 B17R2.207 Nc1ccc(CCc2ccc(O)cc2)cc1 Amb6298293 [0,2,0,0,0,0|2,0,0]=4 3486 B17R2.207 Nc1ccc(COc2ccc(Br)cc2)cc1 Amb2371348 [0,2,0,0,0,0|2,0,0]=4 3487 B17R2.207 Nc1ccc(COc2ccc(Cl)cc2)cc1 Amb1128477 [0,2,0,0,0,0|2,0,0]=4 3488 B17R2.207 Nc1ccc(CSc2ccc(Br)cc2)cc1 Amb8996693 [0,2,0,0,0,0|2,0,0]=4 3489 B17R2.207 Nc1ccc(CSc2ccc(Cl)cc2)cc1 Amb2414967 [0,2,0,0,0,0|2,0,0]=4 3490 B17R2.207 Nc1ccc(CSc2ccc(F)cc2)cc1 Amb2414977 [0,2,0,0,0,0|2,0,0]=4 3491 B17R2.207 Nc1ccc(NCc2ccc(Br)cc2)nc1 Amb32419300 [0,2,0,0,0,0|2,0,0]=4 3492 B17R2.207 Nc1ccc(NCc2ccc(Cl)cc2)cn1 Amb7767421 [0,2,0,0,0,0|2,0,0]=4 3493 B17R2.207 Nc1ccc(NCc2ccc(Cl)cc2)nc1 Amb7767430 [0,2,0,0,0,0|2,0,0]=4 3494 B17R2.207 Nc1ccc(NCc2ccc(F)cc2)cn1 Amb7767958 [0,2,0,0,0,0|2,0,0]=4 3495 B17R2.207 Nc1ccc(NCc2ccc(F)cc2)nc1 Amb7767964 [0,2,0,0,0,0|2,0,0]=4 3496 B17R2.207 Nc1ccc(OCc2ccc(Br)cc2)cc1 Amb843450 [0,2,0,0,0,0|2,0,0]=4 3497 B17R2.207 Nc1ccc(OCc2ccc(Br)cc2)cn1 Amb31115818 [0,2,0,0,0,0|2,0,0]=4 3498 B17R2.207 Nc1ccc(OCc2ccc(Cl)cc2)cc1 Amb1395344 [0,2,0,0,0,0|2,0,0]=4 3499 B17R2.207 Nc1ccc(OCc2ccc(Cl)cc2)cn1 Amb31107439 [0,2,0,0,0,0|2,0,0]=4 3500 B17R2.207 Nc1ccc(OCc2ccc(F)cc2)cc1 Amb1119010 [0,2,0,0,0,0|2,0,0]=4 3501 B17R2.207 Nc1ccc(OCc2ccc(F)cc2)cn1 Amb31180741 [0,2,0,0,0,0|2,0,0]=4 3502 B17R2.207 Nc1ccc(SCc2ccc(Cl)cc2)cc1 Amb8930431 [0,2,0,0,0,0|2,0,0]=4 3503 B17R2.207 Nc1ccc(SCc2ccc(Cl)cc2)cn1 Amb8933243 [0,2,0,0,0,0|2,0,0]=4 3504 B17R2.207 Nc1ccc(SCc2ccc(F)cc2)cc1 Amb2719883 [0,2,0,0,0,0|2,0,0]=4 3505 B17R2.207 Oc1ccc(CCc2ccc(Cl)cc2)cc1 Amb2413167 [0,2,0,0,0,0|2,0,0]=4 3506 B17R2.207 Oc1ccc(CCc2ccc(O)cc2)cc1 Amb2445097 [0,2,0,0,0,0|2,0,0]=4 3507 B17R2.207 Oc1ccc(CNc2ccc(Br)cc2)cc1 Amb4032194 [0,2,0,0,0,0|1,0,0]=3 3508 B17R2.207 Oc1ccc(CNc2ccc(Cl)cc2)cc1 Amb4020906 [0,2,0,0,0,0|1,0,0]=3 3509 B17R2.207 Oc1ccc(CNc2ccc(F)cc2)cc1 Amb4018606 [0,2,0,0,0,0|1,0,0]=3 3510 B17R2.207 Oc1ccc(CNc2ccc(O)cc2)cc1 Amb6867964 [0,2,0,0,0,0|1,0,0]=3 3511 B17R2.207 Oc1ccc(NCc2ccc(Br)cc2)cc1 Amb6456501 [0,2,0,0,0,0|1,0,0]=3 3512 B17R2.207 Oc1ccc(NCc2ccc(Cl)cc2)cc1 Amb6857103 [0,2,0,0,0,0|1,0,0]=3 3513 B17R2.207 Oc1ccc(OCc2ccc(Br)cc2)cc1 Amb33528788 [0,2,0,0,0,0|2,0,0]=4 3514 B17R2.215 Cc1ccc(CNc2cc(N)ccn2)cc1 Amb17340017 [0,2,0,0,0,0|2,0,0]=4 3515 B17R2.215 Cc1ccc(CNc2cccc(Br)c2)cc1 Amb6696580 [0,2,0,0,0,0|1,0,0]=3 3516 B17R2.215 Cc1ccc(CNc2cccc(C)c2)cc1 Amb6684410 [0,2,0,0,0,0|1,0,0]=3 3517 B17R2.215 Cc1ccc(CNc2cccc(Cl)c2)cc1 Amb6644635 [0,2,0,0,0,0|1,0,0]=3 3518 B17R2.215 Cc1ccc(CNc2cccc(F)c2)cc1 Amb6695769 [0,2,0,0,0,0|1,0,0]=3 3519 B17R2.215 Cc1ccc(COc2cccc(N)c2)cc1 Amb1118549 [0,2,0,0,0,0|2,0,0]=4 3520 B17R2.215 Cc1ccc(COc2cccc(O)c2)cc1 Amb8837427 [0,2,0,0,0,0|2,0,0]=4 3521 B17R2.215 Cc1ccc(NCc2cccc(Br)c2)cc1 Amb837855 [0,2,0,0,0,0|1,0,0]=3 3522 B17R2.215 Cc1ccc(NCc2cccc(C)c2)cc1 Amb4313244 [0,2,0,0,0,0|1,0,0]=3 3523 B17R2.215 Cc1ccc(NCc2cccc(Cl)c2)cc1 Amb4303633 [0,2,0,0,0,0|1,0,0]=3 3524 B17R2.215 Cc1ccc(NCc2cccc(F)c2)cc1 Amb6700763 [0,2,0,0,0,0|1,0,0]=3 3525 B17R2.215 Cc1ccc(NCc2cccc(O)c2)cc1 Amb3538468 [0,2,0,0,0,0|1,0,0]=3 3526 B17R2.215 Cc1cccc(CNc2ccc(Br)cc2)c1 Amb4313253 [0,2,0,0,0,0|1,0,0]=3 3527 B17R2.215 Cc1cccc(CNc2ccc(Cl)cc2)c1 Amb4313248 [0,2,0,0,0,0|1,0,0]=3 3528 B17R2.215 Cc1cccc(CNc2ccc(F)cc2)c1 Amb4313254 [0,2,0,0,0,0|1,0,0]=3 3529 B17R2.215 Cc1cccc(CNc2ccc(N)cn2)c1 Amb18292815 [0,2,0,0,0,0|2,0,0]=4 3530 B17R2.215 Cc1cccc(COc2ccc(N)cc2)c1 Amb1119835 [0,2,0,0,0,0|2,0,0]=4 3531 B17R2.215 Cc1cccc(COc2ccc(N)nc2)c1 Amb31133493 [0,2,0,0,0,0|2,0,0]=4 3532 B17R2.215 Cc1cccc(CSc2ccc(N)cc2)c1 Amb8930369 [0,2,0,0,0,0|2,0,0]=4 3533 B17R2.215 Cc1cccc(NCc2ccc(Br)cc2)c1 Amb838880 [0,2,0,0,0,0|1,0,0]=3 3534 B17R2.215 Cc1cccc(NCc2ccc(Cl)cc2)c1 Amb838881 [0,2,0,0,0,0|1,0,0]=3 3535 B17R2.215 Cc1cccc(NCc2ccc(O)cc2)c1 Amb3542173 [0,2,0,0,0,0|1,0,0]=3 3536 B17R2.215 Cc1cccc(OCc2ccc(N)cc2)c1 Amb1134529 [0,2,0,0,0,0|2,0,0]=4 3537 B17R2.215 Cc1cccc(SCc2ccc(N)cc2)c1 Amb24091120 [0,2,0,0,0,0|2,0,0]=4 3538 B17R2.215 Cc1cncc(NCc2ccc(F)cc2)c1 Amb32952906 [0,2,0,0,0,0|2,0,0]=4 3539 B17R2.215 Cc1cncc(NCc2ccc(F)cc2)c1 Amb32952907 [0,2,0,0,0,0|2,0,0]=4 3540 B17R2.215 Clc1ccc(CNc2cccc(Br)n2)cc1 Amb24082657 [0,2,0,0,0,0|2,0,0]=4 3541 B17R2.215 Clc1ccc(CNc2cccc(Cl)c2)cc1 Amb838911 [0,2,0,0,0,0|1,0,0]=3 3542 B17R2.215 Clc1ccc(OCc2cccc(Br)c2)cc1 Amb30588926 [0,2,0,0,0,0|2,0,0]=4 3543 B17R2.215 Clc1cccc(COc2ccc(Br)nc2)c1 Amb32667005 [0,2,0,0,0,0|2,0,0]=4 3544 B17R2.215 Fc1ccc(CNc2cccc(F)c2)cc1 Amb6695752 [0,2,0,0,0,0|1,0,0]=3 3545 B17R2.215 Fc1ccc(COc2cccc(Br)c2)cc1 Amb2688061 [0,2,0,0,0,0|2,0,0]=4 3546 B17R2.215 Fc1ccc(NCc2cccc(Cl)c2)cc1 Amb4303626 [0,2,0,0,0,0|1,0,0]=3 3547 B17R2.215 Fc1ccc(NCc2cccc(F)c2)cc1 Amb6696703 [0,2,0,0,0,0|1,0,0]=3 3548 B17R2.215 Fc1cccc(CNc2ccc(Cl)cc2)c1 Amb6695914 [0,2,0,0,0,0|1,0,0]=3 3549 B17R2.215 Fc1cccc(COc2ccc(I)cc2)c1 Amb28984096 [0,2,0,0,0,0|2,0,0]=4 3550 B17R2.215 Fc1cccc(NCc2ccc(Cl)cc2)c1 Amb6695750 [0,2,0,0,0,0|1,0,0]=3 3551 B17R2.215 Nc1ccc(NCc2cccc(Cl)c2)nc1 Amb18992522 [0,2,0,0,0,0|2,0,0]=4 3552 B17R2.215 Nc1ccc(NCc2cccc(F)c2)nc1 Amb7782050 [0,2,0,0,0,0|2,0,0]=4 3553 B17R2.215 Nc1ccc(OCc2cccc(Br)c2)cc1 Amb1135336 [0,2,0,0,0,0|2,0,0]=4 3554 B17R2.215 Nc1ccc(OCc2cccc(Br)c2)cn1 Amb31115817 [0,2,0,0,0,0|2,0,0]=4 3555 B17R2.215 Nc1ccc(OCc2cccc(Cl)c2)cc1 Amb6245870 [0,2,0,0,0,0|2,0,0]=4 3556 B17R2.215 Nc1ccc(OCc2cccc(Cl)c2)cn1 Amb31107438 [0,2,0,0,0,0|2,0,0]=4 3557 B17R2.215 Nc1ccc(OCc2cccc(F)c2)cc1 Amb1117692 [0,2,0,0,0,0|2,0,0]=4 3558 B17R2.215 Nc1ccc(OCc2cccc(F)c2)cn1 Amb31180742 [0,2,0,0,0,0|2,0,0]=4 3559 B17R2.215 Nc1ccc(SCc2cccc(Cl)c2)cc1 Amb8930389 [0,2,0,0,0,0|2,0,0]=4 3560 B17R2.215 Nc1ccc(SCc2cccc(F)c2)cc1 Amb8930281 [0,2,0,0,0,0|2,0,0]=4 3561 B17R2.215 Nc1cccc(COc2ccc(Cl)cc2)c1 Amb6243774 [0,2,0,0,0,0|2,0,0]=4 3562 B17R2.215 Nc1cccc(COc2ccc(F)cc2)c1 Amb6243286 [0,2,0,0,0,0|2,0,0]=4 3563 B17R2.215 Nc1cccc(OCc2ccc(Br)cc2)c1 Amb6251570 [0,2,0,0,0,0|2,0,0]=4 3564 B17R2.215 Nc1cccc(OCc2ccc(Cl)cc2)c1 Amb6247067 [0,2,0,0,0,0|2,0,0]=4 3565 B17R2.215 Nc1cccc(OCc2ccc(F)cc2)c1 Amb1120896 [0,2,0,0,0,0|2,0,0]=4 3566 B17R2.215 Nc1ccnc(NCc2ccc(Br)cc2)c1 Amb32419275 [0,2,0,0,0,0|2,0,0]=4 3567 B17R2.215 Nc1ccnc(NCc2ccc(Cl)cc2)c1 Amb18981461 [0,2,0,0,0,0|2,0,0]=4 3568 B17R2.215 Nc1ccnc(NCc2ccc(F)cc2)c1 Amb18981466 [0,2,0,0,0,0|2,0,0]=4 3569 B17R2.215 Oc1ccc(CCc2cccc(O)c2)cc1 Amb31289382 [0,2,0,0,0,0|2,0,0]=4 3570 B17R2.215 Oc1ccc(CNc2cccc(Br)c2)cc1 Amb6696568 [0,2,0,0,0,0|1,0,0]=3 3571 B17R2.215 Oc1ccc(CNc2cccc(Cl)c2)cc1 Amb6695649 [0,2,0,0,0,0|1,0,0]=3 3572 B17R2.215 Oc1ccc(CNc2cccc(F)c2)cc1 Amb6695746 [0,2,0,0,0,0|1,0,0]=3 3573 B17R2.215 Oc1ccc(NCc2cccc(Br)c2)cc1 Amb6857128 [0,2,0,0,0,0|1,0,0]=3 3574 B17R2.215 Oc1ccc(NCc2cccc(Cl)c2)cc1 Amb9608750 [0,2,0,0,0,0|1,0,0]=3 3575 B17R2.215 Oc1ccc(OCc2cccc(Br)c2)cc1 Amb8837215 [0,2,0,0,0,0|2,0,0]=4 3576 B17R2.215 Oc1ccc(OCc2cccc(Cl)c2)cc1 Amb9210962 [0,2,0,0,0,0|2,0,0]=4 3577 B17R2.215 Oc1ccc(OCc2cccc(F)c2)cc1 Amb8837229 [0,2,0,0,0,0|2,0,0]=4 3578 B17R2.215 Oc1cccc(CNc2ccc(Br)cc2)c1 Amb6696555 [0,2,0,0,0,0|1,0,0]=3 3579 B17R2.215 Oc1cccc(CNc2ccc(Cl)cc2)c1 Amb6695979 [0,2,0,0,0,0|1,0,0]=3 3580 B17R2.215 Oc1cccc(CNc2ccc(F)cc2)c1 Amb6696810 [0,2,0,0,0,0|1,0,0]=3 3581 B17R2.215 Oc1cccc(OCc2ccc(Br)cc2)c1 Amb9210990 [0,2,0,0,0,0|2,0,0]=4 3582 B17R2.215 Oc1cccc(OCc2ccc(Cl)cc2)c1 Amb8837477 [0,2,0,0,0,0|2,0,0]=4 3583 B17R2.215 Oc1cccc(OCc2ccc(F)cc2)c1 Amb8837426 [0,2,0,0,0,0|2,0,0]=4 3584 B17R2.1819 BrCc1cccc(OCc2ccccc2)c1 Amb2694949 [0,2,0,0,0,0|2,0,0]=4 3585 B17R2.1819 C#Cc1cccc(NCc2ccccc2)c1 Amb6684379 [0,2,0,0,0,0|1,0,0]=3 3586 B17R2.1819 C#Cc1cccc(NCc2ccncc2)c1 Amb6684276 [0,2,0,0,0,0|2,0,0]=4 3587 B17R2.1819 C#Cc1cccc(OCc2ccccc2)c1 Amb19944488 [0,2,0,0,0,0|2,0,0]=4 3588 B17R2.1819 C#Cc1ccnc(NCc2ccccc2)c1 Amb26386247 [0,2,0,0,0,0|2,0,0]=4 3589 B17R2.1819 C=Cc1cccc(OCc2ccccc2)c1 Amb25201240 [0,2,0,0,0,0|2,0,0]=4 3590 B17R2.1819 CNc1cccc(NCc2ccccc2)c1 Amb28192647 [0,2,0,0,0,0|1,0,0]=3 3591 B17R2.1819 CNc1cccc(OCc2ccccc2)c1 Amb19889083 [0,2,0,0,0,0|2,0,0]=4 3592 B17R2.1819 COc1cccc(CNc2ccccc2)c1 Amb3548401 [0,2,0,0,0,0|1,0,0]=3 3593 B17R2.1819 COc1cccc(CNc2ccccn2)c1 Amb17100118 [0,2,0,0,0,0|2,0,0]=4 3594 B17R2.1819 COc1cccc(NCc2ccccc2)c1 Amb4313275 [0,2,0,0,0,0|1,0,0]=3 3595 B17R2.1819 COc1cccc(NCc2ccccn2)c1 Amb6700645 [0,2,0,0,0,0|2,0,0]=4 3596 B17R2.1819 COc1cccc(NCc2cccnc2)c1 Amb6700525 [0,2,0,0,0,0|0,0,0]=2 3597 B17R2.1819 COc1cccc(NCc2ccncc2)c1 Amb6700530 [0,2,0,0,0,0|2,0,0]=4 3598 B17R2.1819 COc1cccc(OCc2ccccc2)c1 Amb25099494 [0,2,0,0,0,0|2,0,0]=4 3599 B17R2.1819 ClCc1cccc(OCc2ccccc2)c1 Amb6618713 [0,2,0,0,0,0|2,0,0]=4 3600 B17R2.1819 ClCc1cccc(SCc2ccccc2)c1 Amb32652002 [0,2,0,0,0,0|2,0,0]=4 3601 B17R2.1819 ClCc1cncc(OCc2ccccc2)c1 Amb33473126 [0,2,0,0,0,0|2,0,0]=4 3602 B17R2.1819 N#Cc1cccc(COc2ccccc2)c1 Amb2724118 [0,2,0,0,0,0|2,0,0]=4 3603 B17R2.1819 N#Cc1cccc(NCc2ccccc2)c1 Amb6696323 [0,2,0,0,0,0|1,0,0]=3 3604 B17R2.1819 N#Cc1cccc(OCc2ccccc2)c1 Amb6664107 [0,2,0,0,0,0|2,0,0]=4 3605 B17R2.1819 N#Cc1cccc(OCc2cccnc2)c1 Amb6274523 [0,2,0,0,0,0|1,0,0]=3 3606 B17R2.1819 N#Cc1cncc(C#Cc2ccccc2)c1 Amb2724648 [0,2,0,0,0,0|1,0,1]=4 3607 B17R2.1819 N#Cc1cncc(NCc2ccccc2)c1 Amb28247156 [0,2,0,0,0,0|2,0,0]=4 3608 B17R2.1819 NCc1cccc(COc2ccccc2)c1 Amb1136372 [0,2,0,0,0,0|2,0,0]=4 3609 B17R2.1819 NCc1cccc(OCc2ccccc2)c1 Amb10767182 [0,2,0,0,0,0|2,0,0]=4 3610 B17R2.1819 NCc1cccc(OCc2ccccc2)c1 Amb1120868 [0,2,0,0,0,0|2,0,0]=4 3611 B17R2.1819 NCc1cccc(OCc2ccccc2)c1 Amb17622255 [0,2,0,0,0,0|2,0,0]=4 3612 B17R2.1819 NCc1cccc(OCc2cccnc2)c1 Amb6760973 [0,2,0,0,0,0|1,0,0]=3 3613 B17R2.1819 NCc1cccc(OCc2cnccn2)c1 Amb17132214 [0,2,0,0,0,0|2,0,0]=4 3614 B17R2.1819 NNc1cc(NCc2ccccc2)ccn1 Amb27460605 [0,2,0,0,0,0|2,0,0]=4 3615 B17R2.1819 NNc1cccc(OCc2ccccc2)c1 Amb17241686 [0,2,0,0,0,0|2,0,0]=4 3616 B17R2.1819 NNc1cccc(OCc2ccccc2)c1 Amb6298610 [0,2,0,0,0,0|2,0,0]=4 3617 B17R2.1819 O=Cc1cccc(COc2ccccc2)c1 Amb2724112 [0,2,0,0,0,0|2,0,0]=4 3618 B17R2.1819 O=Cc1cccc(OCc2ccccc2)c1 Amb1881706 [0,2,0,0,0,0|2,0,0]=4 3619 B17R2.1819 O=Cc1cccc(OCc2cccnc2)c1 Amb535874 [0,2,0,0,0,0|1,0,0]=3 3620 B17R2.1819 O=Cc1cccc(OCc2cnccn2)c1 Amb17131875 [0,2,0,0,0,0|2,0,0]=4 3621 B17R2.1819 O=Cc1cccc(SCc2ccccc2)c1 Amb32652003 [0,2,0,0,0,0|2,0,0]=4 3622 B17R2.1819 O=Cc1cncc(OCc2ccccc2)c1 Amb23401196 [0,2,0,0,0,0|2,0,0]=4 3623 B17R2.1819 OCc1cccc(COc2ccccc2)c1 Amb2724115 [0,2,0,0,0,0|2,0,0]=4 3624 B17R2.1819 OCc1cccc(NCc2ccccc2)c1 Amb9229802 [0,2,0,0,0,0|1,0,0]=3 3625 B17R2.1819 OCc1cccc(NCc2ccccc2)n1 Amb27256153 [0,2,0,0,0,0|2,0,0]=4 3626 B17R2.1819 OCc1cccc(OCc2ccccc2)c1 Amb3606262 [0,2,0,0,0,0|2,0,0]=4 3627 B17R2.1819 OCc1cccc(OCc2cccnc2)c1 Amb6706005 [0,2,0,0,0,0|1,0,0]=3 3628 B17R2.1819 OCc1cncc(OCc2ccccc2)c1 Amb26037790 [0,2,0,0,0,0|2,0,0]=4 3629 B17R2.1819 SCc1cccc(OCc2ccccc2)c1 Amb27427319 [0,2,0,0,0,0|2,0,0]=4 3630 B17R2.1819 [C-]#[N+]c1cccc(OCc2ccccc2)c1 Amb26559267 [0,2,0,0,0,0|2,0,0]=4 3631 B17R2.1819 [C-]#[N+]c1cncc(OCc2ccccc2)c1 Amb27237906 [0,2,0,0,0,0|2,0,0]=4 3632 B17R2.3212 Brc1cc(Br)cc(NCc2ccccc2)c1 Amb35725843 [0,2,0,0,0,0|1,0,0]=3 3633 B17R2.3212 Brc1cc(Br)cc(OCc2ccccc2)c1 Amb22490038 [0,2,0,0,0,0|2,0,0]=4 3634 B17R2.3212 Cc1cc(C)cc(NCc2ccccc2)c1 Amb4313272 [0,2,0,0,0,0|1,0,0]=3 3635 B17R2.3212 Cc1cc(C)cc(NCc2ccccn2)c1 Amb6698432 [0,2,0,0,0,0|2,0,0]=4 3636 B17R2.3212 Cc1cc(C)cc(NCc2cccnc2)c1 Amb6424923 [0,2,0,0,0,0|0,0,0]=2 3637 B17R2.3212 Cc1cc(C)cc(NCc2ccncc2)c1 Amb6336215 [0,2,0,0,0,0|2,0,0]=4 3638 B17R2.3212 Cc1cc(C)nc(NCc2cccnc2)n1 Amb17675347 [0,2,0,0,0,0|2,0,0]=4 3639 B17R2.3212 Cc1cc(Cl)cc(OCc2ccccc2)c1 Amb27620845 [0,2,0,0,0,0|2,0,0]=4 3640 B17R2.3212 Cc1cc(I)cc(NCc2ccccc2)c1 Amb35691018 [0,2,0,0,0,0|1,0,0]=3 3641 B17R2.3212 Cc1cc(N)cc(OCc2ccccc2)c1 Amb26078529 [0,2,0,0,0,0|2,0,0]=4 3642 B17R2.3212 Cc1cc(N)nc(NCc2cccnc2)n1 Amb21988219 [0,2,0,0,0,0|2,0,0]=4 3643 B17R2.3212 Cc1cc(NCc2ccccc2)cc(C)n1 Amb27592872 [0,2,0,0,0,0|2,0,0]=4 3644 B17R2.3212 Cc1cc(NCc2cccnc2)nc(Cl)n1 Amb18991914 [0,2,0,0,0,0|2,0,0]=4 3645 B17R2.3212 Cc1cc(O)cc(OCc2ccccc2)c1 Amb25729121 [0,2,0,0,0,0|2,0,0]=4 3646 B17R2.3212 Cc1cc(O)nc(NCc2cccnc2)n1 Amb21988212 [0,2,0,0,0,0|2,0,0]=4 3647 B17R2.3212 Clc1cc(Br)cc(OCc2ccccc2)c1 Amb21856643 [0,2,0,0,0,0|2,0,0]=4 3648 B17R2.3212 Clc1cc(Cl)cc(CNc2ccccc2)c1 Amb20076470 [0,2,0,0,0,0|1,0,0]=3 3649 B17R2.3212 Clc1cc(Cl)cc(NCc2ccccc2)c1 Amb3693314 [0,2,0,0,0,0|1,0,0]=3 3650 B17R2.3212 Clc1cc(Cl)cc(NCc2ccccn2)c1 Amb6692520 [0,2,0,0,0,0|2,0,0]=4 3651 B17R2.3212 Clc1cc(Cl)cc(NCc2cccnc2)c1 Amb837807 [0,2,0,0,0,0|0,0,0]=2 3652 B17R2.3212 Clc1cc(Cl)cc(NCc2ccncc2)c1 Amb837824 [0,2,0,0,0,0|2,0,0]=4 3653 B17R2.3212 Clc1cc(Cl)cc(OCc2ccccc2)c1 Amb28244870 [0,2,0,0,0,0|2,0,0]=4 3654 B17R2.3212 Fc1cc(Br)cc(NCc2ccccc2)c1 Amb27453756 [0,2,0,0,0,0|1,0,0]=3 3655 B17R2.3212 Fc1cc(Br)cc(OCc2ccccc2)c1 Amb19517019 [0,2,0,0,0,0|2,0,0]=4 3656 B17R2.3212 Fc1cc(F)cc(OCc2ccccc2)c1 Amb21964311 [0,2,0,0,0,0|2,0,0]=4 3657 B17R2.3212 Ic1cc(I)cc(NCc2ccccc2)c1 Amb35717719 [0,2,0,0,0,0|1,0,0]=3 3658 B17R2.3212 Nc1cc(Cl)cc(OCc2ccccc2)c1 Amb21857934 [0,2,0,0,0,0|2,0,0]=4 3659 B17R2.3212 Nc1cc(F)cc(OCc2ccccc2)c1 Amb28424227 [0,2,0,0,0,0|2,0,0]=4 3660 B17R2.3212 Nc1nc(Cl)cc(NCc2cccnc2)n1 Amb10713400 [0,2,0,0,0,0|2,0,0]=4 3661 B17R2.3212 Oc1cc(Br)cc(OCc2ccccc2)c1 Amb24698770 [0,2,0,0,0,0|2,0,0]=4 3662 B17R2.3212 Oc1cc(Cl)cc(OCc2ccccc2)c1 Amb25910282 [0,2,0,0,0,0|2,0,0]=4 3663 B17R2.3212 Oc1cc(O)cc(CCc2ccccc2)c1 Amb15692016 [0,2,0,0,0,0|2,0,0]=4 3664 B17R2.3212 Oc1cc(O)cc(OCc2ccccc2)c1 Amb27802787 [0,2,0,0,0,0|2,0,0]=4 3665 B17R2.5300 Cc1cccc(CNc2cc(N)ccn2)c1 Amb18981505 [0,2,0,0,0,0|2,0,0]=4 3666 B17R2.5300 Cc1cccc(CNc2cccc(Br)c2)c1 Amb6696582 [0,2,0,0,0,0|1,0,0]=3 3667 B17R2.5300 Cc1cccc(CNc2cccc(C)c2)c1 Amb6684411 [0,2,0,0,0,0|1,0,0]=3 3668 B17R2.5300 Cc1cccc(CNc2cccc(Cl)c2)c1 Amb6618089 [0,2,0,0,0,0|1,0,0]=3 3669 B17R2.5300 Cc1cccc(CNc2cccc(F)c2)c1 Amb6695772 [0,2,0,0,0,0|1,0,0]=3 3670 B17R2.5300 Cc1cccc(COc2cccc(N)c2)c1 Amb1112224 [0,2,0,0,0,0|2,0,0]=4 3671 B17R2.5300 Cc1cccc(COc2cccc(O)c2)c1 Amb8837425 [0,2,0,0,0,0|2,0,0]=4 3672 B17R2.5300 Cc1cccc(NCc2cccc(Br)c2)c1 Amb6684401 [0,2,0,0,0,0|1,0,0]=3 3673 B17R2.5300 Cc1cccc(NCc2cccc(Cl)c2)c1 Amb4303632 [0,2,0,0,0,0|1,0,0]=3 3674 B17R2.5300 Cc1cccc(NCc2cccc(F)c2)c1 Amb6684408 [0,2,0,0,0,0|1,0,0]=3 3675 B17R2.5300 Cc1cccc(NCc2cccc(O)c2)c1 Amb3549188 [0,2,0,0,0,0|1,0,0]=3 3676 B17R2.5300 Fc1cccc(CNc2cccc(Br)n2)c1 Amb32405376 [0,2,0,0,0,0|2,0,0]=4 3677 B17R2.5300 Fc1cccc(CNc2cccc(F)c2)c1 Amb6695765 [0,2,0,0,0,0|1,0,0]=3 3678 B17R2.5300 Fc1cccc(COc2cccc(Br)c2)c1 Amb2688060 [0,2,0,0,0,0|2,0,0]=4 3679 B17R2.5300 Fc1cccc(NCc2cccc(Cl)c2)c1 Amb6695879 [0,2,0,0,0,0|1,0,0]=3 3680 B17R2.5300 Nc1cccc(COc2cccc(F)c2)c1 Amb6245061 [0,2,0,0,0,0|2,0,0]=4 3681 B17R2.5300 Nc1cccc(COc2cccc(F)c2)c1 Amb7969467 [0,2,0,0,0,0|2,0,0]=4 3682 B17R2.5300 Nc1cccc(NNc2cccc(N)c2)c1 Amb17843263 [0,2,0,0,0,0|2,0,0]=4 3683 B17R2.5300 Nc1cccc(OCc2cccc(Br)c2)c1 Amb1127518 [0,2,0,0,0,0|2,0,0]=4 3684 B17R2.5300 Nc1cccc(OCc2cccc(Cl)c2)c1 Amb6246771 [0,2,0,0,0,0|2,0,0]=4 3685 B17R2.5300 Nc1cccc(OCc2cccc(F)c2)c1 Amb1120444 [0,2,0,0,0,0|2,0,0]=4 3686 B17R2.5300 Nc1ccnc(NCc2cccc(Cl)c2)c1 Amb18299324 [0,2,0,0,0,0|2,0,0]=4 3687 B17R2.5300 Nc1ccnc(NCc2cccc(F)c2)c1 Amb18981470 [0,2,0,0,0,0|2,0,0]=4 3688 B17R2.5300 Oc1cccc(CNc2cccc(Br)c2)c1 Amb6696670 [0,2,0,0,0,0|1,0,0]=3 3689 B17R2.5300 Oc1cccc(CNc2cccc(Cl)c2)c1 Amb6695726 [0,2,0,0,0,0|1,0,0]=3 3690 B17R2.5300 Oc1cccc(CNc2cccc(F)c2)c1 Amb6695883 [0,2,0,0,0,0|1,0,0]=3 3691 B17R2.5300 Oc1cccc(OCc2cccc(Br)c2)c1 Amb8837419 [0,2,0,0,0,0|2,0,0]=4 3692 B17R2.5300 Oc1cccc(OCc2cccc(Cl)c2)c1 Amb9211006 [0,2,0,0,0,0|2,0,0]=4 3693 B17R2.5300 Oc1cccc(OCc2cccc(F)c2)c1 Amb8837434 [0,2,0,0,0,0|2,0,0]=4 3694 B15R2.118 O=Cc1cccn1Cc2ccccc2 Amb838591 [0,0,1,1,0,0|2,0,0]=4 3695 B15R2.118 O=Cc1cccn1Cc2cccnc2 Amb1953480 [0,0,1,1,0,0|1,0,0]=3 3696 B15R2.118 O=Cc1cccn1Cc2cccnn2 Amb27758492 [0,0,1,1,0,0|2,0,0]=4 3697 B15R2.118 O=Cc1cccn1Cc2cnccn2 Amb35722931 [0,0,1,1,0,0|2,0,0]=4 3698 B15R2.2196 C(=N\Nc1ccccc1)/c2cccs2 Amb2752405 [0,0,1,1,0,0|2,0,0]=4 3699 B15R2.2196 c1ccc(NCCc2ccco2)cc1 Amb28135300 [0,0,1,1,0,0|1,0,1]=4 3700 B15R2.2196 c1ccc(NCCc2nccs2)cc1 Amb17338177 [0,0,1,1,0,0|1,0,1]=4 3701 B15R2.2196 c1cncc(CNCc2ccco2)c1 Amb5759054 [0,0,1,1,0,0|1,0,1]=4 3702 B15R2.2196 c1cncc(CNCc2ccco2)c1 Amb6335674 [0,0,1,1,0,0|1,0,1]=4 3703 B15R2.2196 c1cncc(CNCc2ccco2)c1 Amb6572588 [0,0,1,1,0,0|1,0,1]=4 3704 B15R2.2196 c1cncc(CNCc2cccs2)c1 Amb6355734 [0,0,1,1,0,0|1,0,1]=4 3705 B15R2.2196 c1cncc(CNCc2ccsc2)c1 Amb1094469 [0,0,1,1,0,0|1,0,1]=4 3706 B15R2.2196 c1cncc(CNCc2ccsc2)c1 Amb6868334 [0,0,1,1,0,0|1,0,1]=4 3707 B15R2.355 O=C1C=CC(=O)C1Nc2ccccc2 Amb27597672 [0,0,1,1,0,0|2,0,0]=4 3708 B15R2.355 O=C1C=CC(=O)N1Cc2cccnc2 Amb6618013 [0,0,1,1,0,0|2,0,0]=4 3709 B15R3.3 C1=CN2C(=CO1)Nc3ccccc32 Amb24533841 [0,0,0,1,1,0|2,0,0]=4 3710 B15R3.3 c1ccc-2c(c1)Cc3ccccc32 Amb2793085 [0,0,0,1,1,0|1,0,0]=3 3711 B15R3.3 c1ccc-2c(c1)Cc3cccnc32 Amb1056107 [0,0,0,1,1,0|0,0,0]=2 3712 B15R3.3 c1ccc-2c(c1)Cc3cncnc32 Amb27862405 [0,0,0,1,1,0|1,0,0]=3 3713 B15R3.3 c1ccc-2c(c1)Cc3nccnc32 Amb28243510 [0,0,0,1,1,0|1,0,0]=3 3714 B15R3.3 c1ccc-2c(c1)Cc3nnccc32 Amb27641472 [0,0,0,1,1,0|1,0,0]=3 3715 B15R3.3 c1ccc2c(c1)[i+]c3ccccc32 Amb22731766 [0,0,0,1,1,0|2,0,0]=4 3716 B15R3.3 c1ccc2c(c1)cc3cccnn32 Amb28144982 [0,0,0,1,1,0|1,0,1]=4 3717 B15R3.3 c1ccc2c(c1)nn3cccnc23 Amb27468611 [0,0,0,1,1,0|1,0,1]=4 3718 B15R3.3 c1ccc2c(c1)oc3ccccc32 Amb6608847 [0,0,0,1,1,0|2,0,0]=4 3719 B15R3.3 c1ccc2c(c1)oc3cccnc32 Amb27165193 [0,0,0,1,1,0|1,0,0]=3 3720 B15R3.3 c1ccc2c(c1)sc3ccccc32 Amb2686709 [0,0,0,1,1,0|2,0,0]=4 3721 B15R3.3 c1ccn2c(c1)cc3cnccc32 Amb25727985 [0,0,0,1,1,0|1,0,1]=4 3722 B15R3.3 c1cnc-2c(c1)Cc3cccnc32 Amb26853147 [0,0,0,1,1,0|1,0,0]=3 3723 B15R3.1701 c1ccc2c(c1)CC2c3cnco3 Amb35647933 [0,0,0,1,1,0|2,0,0]=4 3724 B15R3.1719 C1=CC2(C=C1)CC2c3ccccc3 Amb6600557 [0,0,0,1,1,0|1,0,1]=4 3725 B15R3.1739 c1cc-2c(cn1)NCc3ccnn32 Amb18198327 [0,0,0,1,1,0|2,0,0]=4 3726 B15R3.1739 c1cc2c(cn1)-n3cncc3CN2 Amb18825368 [0,0,0,1,1,0|2,0,0]=4 3727 B15R3.1739 c1cc2n(c1)-c3ccncc3NC2 Amb18198618 [0,0,0,1,1,0|1,0,1]=4 3728 B15R3.1739 c1ccc-2c(c1)CCc3conc32 Amb19889735 [0,0,0,1,1,0|2,0,0]=4 3729 B15R3.1739 c1ccc-2c(c1)CCc3oncc32 Amb28435283 [0,0,0,1,1,0|2,0,0]=4 3730 B15R3.1739 c1ccc-2c(c1)CCn3cccc32 Amb28243213 [0,0,0,1,1,0|2,0,0]=4 3731 B15R3.1739 c1ccc-2c(c1)NCc3cccn32 Amb20528821 [0,0,0,1,1,0|0,0,1]=3 3732 B15R3.1739 c1ccc-2c(c1)NCc3ccnn32 Amb18825435 [0,0,0,1,1,0|1,0,0]=3 3733 B15R3.1739 c1ccc-2c(c1)NCc3cncn32 Amb18560948 [0,0,0,1,1,0|1,0,0]=3 3734 B15R3.1739 c1ccc-2c(c1)NCc3ncnn32 Amb27608619 [0,0,0,1,1,0|2,0,0]=4 3735 B15R3.1739 c1ccc-2c(c1)NCc3nncn32 Amb27250048 [0,0,0,1,1,0|2,0,0]=4 3736 B15R3.1739 c1ccc-2c(c1)NCc3scnc32 Amb18820765 [0,0,0,1,1,0|1,0,0]=3 3737 B15R3.1739 c1ccc-2c(c1)NCc3snnc32 Amb18191055 [0,0,0,1,1,0|2,0,0]=4 3738 B15R3.1739 c1ccc-2c(c1)NCn3ccnc32 Amb25247273 [0,0,0,1,1,0|1,0,0]=3 3739 B15R3.1739 c1ccc-2c(c1)NCn3cncc32 Amb28066598 [0,0,0,1,1,0|1,0,0]=3 3740 B15R3.1739 c1ccc-2c(c1)NCn3nccc32 Amb27400525 [0,0,0,1,1,0|1,0,0]=3 3741 B15R3.1739 c1ccc-2c(c1)SCc3cnoc32 Amb26304140 [0,0,0,1,1,0|2,0,0]=4 3742 B15R3.1739 c1cnc-2c(c1)NCc3cccn32 Amb24651132 [0,0,0,1,1,0|1,0,1]=4 3743 B15R3.1739 c1cnc2c(c1)-n3cccc3CN2 Amb18198619 [0,0,0,1,1,0|1,0,1]=4 3744 B15R3.1739 c1cnc2c(c1)-n3cncc3CN2 Amb18198331 [0,0,0,1,1,0|2,0,0]=4 3745 B15R3.1739 c1cnc2c(c1)-n3nccc3CN2 Amb18198328 [0,0,0,1,1,0|2,0,0]=4 3746 B17R3.8 C1=C(c2ccccc2)c3ccccc3C1 Amb17778883 [0,0,0,1,0,1|2,0,0]=4 3747 B17R3.8 C1=CC(c2ccccc2)c3ccccc31 Amb20240702 [0,0,0,1,0,1|2,0,0]=4 3748 B17R3.8 c1ccc(-n2ccc3ccccc32)cc1 Amb8388379 [0,0,0,1,0,1|1,0,1]=4 3749 B17R3.8 c1ccc(-n2cnc3ccccc32)cc1 Amb2700555 [0,0,0,1,0,1|1,0,1]=4 3750 B17R3.8 c1ccc(-n2cnc3cccnc32)cc1 Amb24104697 [0,0,0,1,0,1|0,0,1]=3 3751 B17R3.8 c1ccc(-n2cnc3cnccc32)cc1 Amb6363636 [0,0,0,1,0,1|0,0,1]=3 3752 B17R3.8 c1ccc(-n2ncc3ccccc32)cc1 Amb4006218 [0,0,0,1,0,1|1,0,1]=4 3753 B17R3.8 c1ccc(-n2nnc3ccccc32)cc1 Amb2622119 [0,0,0,1,0,1|2,0,0]=4 3754 B17R3.8 c1ccc(-n2nnc3cnccc32)cc1 Amb686076 [0,0,0,1,0,1|1,0,0]=3 3755 B17R3.8 c1ccc(-n2nnc3cnccc32)nc1 Amb2609877 [0,0,0,1,0,1|2,0,0]=4 3756 B17R3.8 c1ccc(C2CNc3ccccc32)cc1 Amb32882496 [0,0,0,1,0,1|1,0,0]=3 3757 B17R3.8 c1ccc(C2NCc3ccccc32)cc1 Amb31135052 [0,0,0,1,0,1|1,0,0]=3 3758 B17R3.8 c1ccc(C2NCc3cnccc32)cc1 Amb18188884 [0,0,0,1,0,1|0,0,0]=2 3759 B17R3.8 c1ccc(N2CCc3ccccc32)cc1 Amb8392756 [0,0,0,1,0,1|1,0,0]=3 3760 B17R3.8 c1ccc(N2CCc3ccccc32)nc1 Amb18452566 [0,0,0,1,0,1|2,0,0]=4 3761 B17R3.8 c1ccc2c(c1)CCN2c3cnccn3 Amb33618684 [0,0,0,1,0,1|2,0,0]=4 3762 B17R3.8 c1ccc2c(c1)CCN2c3cncnc3 Amb17967690 [0,0,0,1,0,1|2,0,0]=4 3763 B17R3.1927 c1ccc(C2CC2c3ccccc3)cc1 Amb4302622 [0,0,0,1,0,1|2,0,0]=4 3764 B17R3.1927 c1ccc(C2OC2c3ccccc3)cc1 Amb2610165 [0,0,0,1,0,1|2,0,0]=4 3765 B17R3.1927 c1ccc([C@@H]2O[C@H]2c3ccccc3)cc1 Amb8513314 [0,0,0,1,0,1|2,0,0]=4 3766 B17R3.1927 c1ccc([C@H]2O[C@@H]2c3ccccc3)cc1 Amb8629192 [0,0,0,1,0,1|2,0,0]=4 3767 B17R3.1939 c1ccc(CC2Cc3ccccc32)cc1 Amb17778868 [0,0,0,1,0,1|2,0,0]=4 3768 B17R3.1963 C1=Cc2ccccc2-c3ccccc3N1 Amb33948453 [0,0,0,1,0,1|1,0,1]=4 3769 B17R3.1963 c1ccc-2c(c1)CCNc3ccccc32 Amb19375172 [0,0,0,1,0,1|1,0,0]=3 3770 B17R3.1963 c1ccc-2c(c1)CNCc3ccccc32 Amb13952599 [0,0,0,1,0,1|1,0,0]=3 3771 B17R3.1963 c1ccc-2c(c1)CNCc3ccccc32 Amb6740263 [0,0,0,1,0,1|1,0,0]=3 3772 B17R3.1830 c1ccc2c(c1)CCc3ccccc3N2 Amb1934143 [0,1,0,1,0,0|2,0,0]=4 3773 B17R3.1830 c1ccc2c(c1)CNc3ccccc3C2 Amb6355964 [0,1,0,1,0,0|1,0,0]=3 3774 B17R3.1830 c1ccc2c(c1)CNc3ccccc3O2 Amb1068313 [0,1,0,1,0,0|1,0,0]=3 3775 B17R3.1830 c1ccc2c(c1)COc3ccccc3N2 Amb21964317 [0,1,0,1,0,0|2,0,0]=4 3776 B17R3.4465 Brc1cccc-2c1NCc3cncnc32 Amb31115419 [0,1,0,1,0,0|1,0,0]=3 3777 B17R3.4465 Brc1ccnc2c1ccc3ccccc32 Amb27843801 [0,1,0,1,0,0|1,0,1]=4 3778 B17R3.4465 Cc1cccc-2c1NCc3cncnc32 Amb31112130 [0,1,0,1,0,0|1,0,0]=3 3779 B17R3.4465 Cc1ncnc-2c1CNc3ccccc32 Amb31112127 [0,1,0,1,0,0|1,0,0]=3 3780 B17R3.4465 Clc1cccc-2c1NCc3cncnc32 Amb31180695 [0,1,0,1,0,0|1,0,0]=3 3781 B17R3.4465 Clc1cccc2c1ccc3cccnc32 Amb33624199 [0,1,0,1,0,0|1,0,1]=4 3782 B17R3.4465 Clc1ncnc-2c1CCc3ccccc32 Amb23401187 [0,1,0,1,0,0|2,0,0]=4 3783 B17R3.4465 Fc1cccc-2c1NCc3cncnc32 Amb31112280 [0,1,0,1,0,0|1,0,0]=3 3784 B17R3.4465 Nc1ccnc2c1ccc3ccccc32 Amb19080023 [0,1,0,1,0,0|1,0,1]=4 3785 B17R3.4465 Nc1ncnc-2c1CCc3ccccc32 Amb30988262 [0,1,0,1,0,0|2,0,0]=4 3786 B17R3.8708 C1=C(c2ccccc2)Cc3ccccc31 Amb20240691 [0,1,0,1,0,0|2,0,0]=4 3787 B17R3.8708 c1ccc(-c2cc3ncccc3o2)cc1 Amb24061320 [0,1,0,1,0,0|2,0,0]=4 3788 B17R3.8708 c1ccc(-c2nc3cnccc3o2)cc1 Amb22481580 [0,1,0,1,0,0|2,0,0]=4 3789 B17R3.8708 c1ccc(-c2nc3cnccc3s2)cc1 Amb24088108 [0,1,0,1,0,0|2,0,0]=4 3790 B17R3.8708 c1ccc(-c2nc3ncccc3o2)cc1 Amb18621159 [0,1,0,1,0,0|2,0,0]=4 3791 B17R3.8708 c1ccc(-n2cc3ccccc3n2)cc1 Amb22460840 [0,1,0,1,0,0|1,0,1]=4 3792 B17R3.8708 c1ccc(-n2nc3ccccc3n2)cc1 Amb17843057 [0,1,0,1,0,0|2,0,0]=4 3793 B17R3.8708 c1ccc(C2Cc3ccccc3N2)cc1 Amb17777066 [0,1,0,1,0,0|1,0,0]=3 3794 B17R3.8708 c1ccc(C2Cc3ccccc3N2)nc1 Amb2234814 [0,1,0,1,0,0|2,0,0]=4 3795 B17R3.8708 c1ccc(C2Cc3ccccc3O2)cc1 Amb24084933 [0,1,0,1,0,0|2,0,0]=4 3796 B17R3.8708 c1ccc(N2Sc3ccccc3S2)cc1 Amb32667600 [0,1,0,1,0,0|2,0,0]=4 3797 B17R3.8708 c1cncc(-c2cc3ccccc3o2)c1 Amb23513412 [0,1,0,1,0,0|1,0,1]=4 3798 B17R3.8708 c1cncc(-c2nc3ccccc3o2)c1 Amb2227484 [0,1,0,1,0,0|0,0,2]=4 3799 B17R3.8708 c1cncc(-c2nc3ccccc3s2)c1 Amb6389417 [0,1,0,1,0,0|0,0,2]=4 3800 B17R3.8708 c1cncc(C2Cc3ccccc3O2)c1 Amb24085148 [0,1,0,1,0,0|1,0,0]=3 3801 B17R3.3135 ClC1(c2ccccc2)Cc3ccccc31 Amb17844041 [0,1,0,1,0,0|2,0,0]=4 3802 B17R3.3135 OC1(c2ccccc2)Cc3ccccc31 Amb17778681 [0,1,0,1,0,0|2,0,0]=4 3803 B17R3.54615 C[n+]1cc2cccnc2c3ccccc31 Amb2609777 [0,1,0,1,0,0|0,0,2]=4 3804 B17R3.54615 Cc1nc2ccccc2c3ncccc13 Amb765906 [0,1,0,1,0,0|0,0,2]=4 3805 B17R3.54615 Nc1nc2ccccc2c3ncccc13 Amb32454879 [0,1,0,1,0,0|0,0,2]=4 3806 B17R3.54615 O=C1Nc2ccccc2-c3ccccc31 Amb19063347 [0,1,0,1,0,0|1,0,1]=4 3807 B17R3.54615 O=C1Nc2ccccc2-c3ncncc31 Amb24119510 [0,1,0,1,0,0|1,0,1]=4 3808 B17R3.54615 OB1Nc2ccccc2-c3ccccc31 Amb2611451 [0,1,0,1,0,0|2,0,0]=4 3809 B17R3.54615 OC1Cc2ccccc2-c3ccccc31 Amb17595191 [0,1,0,1,0,0|2,0,0]=4 3810 B17R3.54615 S=C1Nc2ccccc2-c3ccccc31 Amb21933605 [0,1,0,1,0,0|1,0,1]=4 3811 B17R3.18998 Brc1ccc2c(c1)-c3ncncc3CN2 Amb31115417 [0,1,0,1,0,0|1,0,0]=3 3812 B17R3.18998 Brc1ncc2c(n1)-c3ccccc3CC2 Amb23412052 [0,1,0,1,0,0|2,0,0]=4 3813 B17R3.18998 Brc1ncc2c(n1)-c3ccccc3OC2 Amb23412055 [0,1,0,1,0,0|2,0,0]=4 3814 B17R3.18998 Cc1ccc2c(c1)-c3ncncc3CN2 Amb31112129 [0,1,0,1,0,0|1,0,0]=3 3815 B17R3.18998 Cc1ccc2ncc3cnccc3c2c1 Amb2611724 [0,1,0,1,0,0|0,0,2]=4 3816 B17R3.18998 Cc1ncc2c(n1)-c3ccccc3NC2 Amb31112128 [0,1,0,1,0,0|1,0,0]=3 3817 B17R3.18998 Clc1ccc2c(c1)-c3ncncc3CN2 Amb31180693 [0,1,0,1,0,0|1,0,0]=3 3818 B17R3.18998 Clc1ncc2c(n1)-c3ccccc3CC2 Amb21963886 [0,1,0,1,0,0|2,0,0]=4 3819 B17R3.18998 Fc1ccc2c(c1)-c3ncncc3CN2 Amb31112278 [0,1,0,1,0,0|1,0,0]=3 3820 B17R3.18998 Nc1ncc2c(n1)-c3ccccc3CC2 Amb2414617 [0,1,0,1,0,0|2,0,0]=4 3821 B17R3.18998 Oc1ncc2c(n1)-c3ccccc3NC2 Amb31112156 [0,1,0,1,0,0|1,0,0]=3 3822 B17R3.31 Cc1ccc-2c(c1)NCc3cncnc32 Amb31112131 [0,1,0,1,0,0|1,0,0]=3 3823 B17R3.31 Clc1cc2c(nn1)-c3ccccc3CC2 Amb10068339 [0,1,0,1,0,0|2,0,0]=4 3824 B17R3.31 Clc1cc2c(nn1)-c3ccccc3OC2 Amb26469295 [0,1,0,1,0,0|2,0,0]=4 3825 B17R3.31 Clc1ccc-2c(c1)NCc3cncnc32 Amb31180694 [0,1,0,1,0,0|1,0,0]=3 3826 B17R3.31 Fc1ccc-2c(c1)NCc3cncnc32 Amb31112279 [0,1,0,1,0,0|1,0,0]=3 3827 B17R3.31 O=C1C=C2CCc3ccccc3C2=NN1 Amb19066901 [0,1,0,1,0,0|2,0,0]=4 3828 B17R3.31 O=C1C=C2COc3ccccc3C2=NN1 Amb19086142 [0,1,0,1,0,0|2,0,0]=4 3829 B17R3.31 O=C1C=C2CSc3ccccc3C2=NN1 Amb33743485 [0,1,0,1,0,0|2,0,0]=4 3830 B17R3.31 Oc1ccc-2c(c1)OCc3ccccc32 Amb18652801 [0,1,0,1,0,0|2,0,0]=4 3831 B17R3.50084 Brc1cccc2c1-c3ccccc3CC2 Amb32415241 [0,1,0,1,0,0|2,0,0]=4 3832 B17R3.50084 Brc1cccc2c1-c3ccccc3CO2 Amb35825125 [0,1,0,1,0,0|2,0,0]=4 3833 B17R3.50084 Nc1cccc2c1-c3ccccc3CC2 Amb18652229 [0,1,0,1,0,0|2,0,0]=4 3834 B17R3.50084 Oc1cccc2c1-c3ccccc3CC2 Amb32415240 [0,1,0,1,0,0|2,0,0]=4 3835 B17R3.50084 Oc1cccc2c1-c3ccccc3CO2 Amb35826777 [0,1,0,1,0,0|2,0,0]=4 3836 B17R3.50084 Oc1cccc2c1-c3ccccc3OC2 Amb35826721 [0,1,0,1,0,0|2,0,0]=4 3837 B17R3.50084 Oc1cccc2ccc3cccnc3c12 Amb3939661 [0,1,0,1,0,0|1,0,1]=4 3838 B13R2.3 C1=NNC(c2ccccc2)=CN1 Amb27200296 [0,0,0,0,2,0|2,0,0]=4 3839 B13R2.3 c1cc(-c2ccnnc2)ccn1 Amb23560284 [0,0,0,0,2,0|2,0,0]=4 3840 B13R2.3 c1cc(-c2cnccn2)ccn1 Amb25052460 [0,0,0,0,2,0|2,0,0]=4 3841 B13R2.3 c1ccc(-[n+]2ccccc2)cc1 Amb10553556 [0,0,0,0,2,0|2,0,0]=4 3842 B13R2.3 c1ccc(-c2ccccc2)cc1 Amb6608799 [0,0,0,0,2,0|1,0,0]=3 3843 B13R2.3 c1ccc(-c2ccccn2)cc1 Amb2696960 [0,0,0,0,2,0|2,0,0]=4 3844 B13R2.3 c1ccc(-c2ccccn2)cc1 Amb2780012 [0,0,0,0,2,0|2,0,0]=4 3845 B13R2.3 c1ccc(-c2cccnc2)cc1 Amb6608931 [0,0,0,0,2,0|0,0,0]=2 3846 B13R2.3 c1ccc(-c2cccnc2)nc1 Amb10066897 [0,0,0,0,2,0|1,0,0]=3 3847 B13R2.3 c1ccc(-c2cccnn2)cc1 Amb2732076 [0,0,0,0,2,0|1,0,0]=3 3848 B13R2.3 c1ccc(-c2cccnn2)nc1 Amb5283910 [0,0,0,0,2,0|2,0,0]=4 3849 B13R2.3 c1ccc(-c2ccncc2)cc1 Amb2609978 [0,0,0,0,2,0|2,0,0]=4 3850 B13R2.3 c1ccc(-c2ccnnc2)nc1 Amb23560282 [0,0,0,0,2,0|2,0,0]=4 3851 B13R2.3 c1ccc(-c2cnccn2)cc1 Amb2610101 [0,0,0,0,2,0|1,0,0]=3 3852 B13R2.3 c1ccc(-c2cncnc2)cc1 Amb2196491 [0,0,0,0,2,0|1,0,0]=3 3853 B13R2.3 c1ccc(-c2nccnn2)cc1 Amb639467 [0,0,0,0,2,0|2,0,0]=4 3854 B13R2.3 c1cnc(-c2cccnc2)nc1 Amb24562773 [0,0,0,0,2,0|2,0,0]=4 3855 B13R2.3 c1cncc(-c2ccncc2)c1 Amb26020164 [0,0,0,0,2,0|1,0,0]=3 3856 B13R2.3 c1cncc(-c2ccncc2)c1 Amb33465518 [0,0,0,0,2,0|1,0,0]=3 3857 B13R2.3 c1cncc(-c2ccncn2)c1 Amb22494533 [0,0,0,0,2,0|2,0,0]=4 3858 B13R2.3 c1cncc(-c2ccnnc2)c1 Amb23560283 [0,0,0,0,2,0|2,0,0]=4 3859 B13R2.3 c1cncc(-c2cnccn2)c1 Amb26643103 [0,0,0,0,2,0|2,0,0]=4 3860 B13R2.64 c1cc(Cc2ccsc2)ccn1 Amb28244333 [0,0,0,0,2,0|2,0,0]=4 3861 B13R2.64 c1cc(Cc2nccs2)ccn1 Amb25085371 [0,0,0,0,2,0|2,0,0]=4 3862 B13R2.64 c1cc(Nc2nccs2)ccn1 Amb18269107 [0,0,0,0,2,0|2,0,0]=4 3863 B13R2.64 c1ccc(Cc2ccco2)nc1 Amb22235263 [0,0,0,0,2,0|2,0,0]=4 3864 B13R2.64 c1ccc(Cc2cccs2)cc1 Amb22045059 [0,0,0,0,2,0|1,0,0]=3 3865 B13R2.64 c1ccc(Cc2ccoc2)cc1 Amb27748433 [0,0,0,0,2,0|1,0,0]=3 3866 B13R2.64 c1ccc(Cc2cnco2)cc1 Amb22753568 [0,0,0,0,2,0|1,0,0]=3 3867 B13R2.64 c1ccc(Cc2cscn2)cc1 Amb25758293 [0,0,0,0,2,0|1,0,0]=3 3868 B13R2.64 c1ccc(Cc2ncco2)cc1 Amb17400052 [0,0,0,0,2,0|1,0,0]=3 3869 B13R2.64 c1ccc(Cc2nccs2)cc1 Amb25894291 [0,0,0,0,2,0|1,0,0]=3 3870 B13R2.64 c1ccc(Cc2nccs2)nc1 Amb27644778 [0,0,0,0,2,0|2,0,0]=4 3871 B13R2.64 c1ccc(Cc2ncon2)cc1 Amb27395776 [0,0,0,0,2,0|2,0,0]=4 3872 B13R2.64 c1ccc(Cn2cccc2)cc1 Amb9248735 [0,0,0,0,2,0|1,0,0]=3 3873 B13R2.64 c1ccc(Cn2cccc2)nc1 Amb2235031 [0,0,0,0,2,0|2,0,0]=4 3874 B13R2.64 c1ccc(Cn2cccn2)cc1 Amb33531671 [0,0,0,0,2,0|1,0,0]=3 3875 B13R2.64 c1ccc(Cn2ccnc2)cc1 Amb1815543 [0,0,0,0,2,0|1,0,0]=3 3876 B13R2.64 c1ccc(Cn2ccnc2)nc1 Amb20623499 [0,0,0,0,2,0|2,0,0]=4 3877 B13R2.64 c1ccc(Cn2cncn2)cc1 Amb843119 [0,0,0,0,2,0|2,0,0]=4 3878 B13R2.64 c1ccc(Cn2cnnc2)cc1 Amb347405 [0,0,0,0,2,0|2,0,0]=4 3879 B13R2.64 c1ccc(Nc2ccco2)cc1 Amb27774843 [0,0,0,0,2,0|1,0,0]=3 3880 B13R2.64 c1ccc(Nc2ccco2)nc1 Amb27794252 [0,0,0,0,2,0|2,0,0]=4 3881 B13R2.64 c1ccc(Nc2cccs2)cc1 Amb24394931 [0,0,0,0,2,0|1,0,0]=3 3882 B13R2.64 c1ccc(Nc2cccs2)nc1 Amb27615523 [0,0,0,0,2,0|2,0,0]=4 3883 B13R2.64 c1ccc(Nc2ccsc2)cc1 Amb26974460 [0,0,0,0,2,0|1,0,0]=3 3884 B13R2.64 c1ccc(Nc2nccs2)cc1 Amb3684247 [0,0,0,0,2,0|1,0,0]=3 3885 B13R2.64 c1ccc(Nc2nccs2)nc1 Amb6885298 [0,0,0,0,2,0|2,0,0]=4 3886 B13R2.64 c1ccc(Nc2ncns2)cc1 Amb27646563 [0,0,0,0,2,0|2,0,0]=4 3887 B13R2.64 c1ccc(Nc2nncs2)cc1 Amb1152996 [0,0,0,0,2,0|2,0,0]=4 3888 B13R2.64 c1ccc(Nn2cccc2)cc1 Amb27207071 [0,0,0,0,2,0|1,0,0]=3 3889 B13R2.64 c1ccc(Nn2cccc2)nc1 Amb27614759 [0,0,0,0,2,0|2,0,0]=4 3890 B13R2.64 c1ccc(Nn2cncn2)cc1 Amb28139485 [0,0,0,0,2,0|2,0,0]=4 3891 B13R2.64 c1ccc(Oc2ccoc2)cc1 Amb10071966 [0,0,0,0,2,0|2,0,0]=4 3892 B13R2.64 c1ccc(Oc2ccon2)cc1 Amb26600905 [0,0,0,0,2,0|2,0,0]=4 3893 B13R2.64 c1ccc(Oc2ccsc2)cc1 Amb4477180 [0,0,0,0,2,0|2,0,0]=4 3894 B13R2.64 c1ccc(Oc2nccs2)cc1 Amb28185504 [0,0,0,0,2,0|2,0,0]=4 3895 B13R2.64 c1ccc(Sc2cccs2)cc1 Amb2724546 [0,0,0,0,2,0|2,0,0]=4 3896 B13R2.64 c1ccc(Sc2nccs2)cc1 Amb10573494 [0,0,0,0,2,0|2,0,0]=4 3897 B13R2.64 c1ccn(Cc2ccncc2)c1 Amb2235051 [0,0,0,0,2,0|2,0,0]=4 3898 B13R2.64 c1ccn(Cc2cnccn2)c1 Amb30007781 [0,0,0,0,2,0|2,0,0]=4 3899 B13R2.64 c1ccn(Nc2cnccn2)c1 Amb27666779 [0,0,0,0,2,0|2,0,0]=4 3900 B13R2.64 c1cncc(Cc2nccs2)c1 Amb26545539 [0,0,0,0,2,0|2,0,0]=4 3901 B13R2.64 c1cncc(Cn2cccn2)c1 Amb27831815 [0,0,0,0,2,0|2,0,0]=4 3902 B13R2.64 c1cncc(Cn2ccnc2)c1 Amb27391786 [0,0,0,0,2,0|2,0,0]=4 3903 B13R2.64 c1cncc(Nc2nccs2)c1 Amb18269122 [0,0,0,0,2,0|2,0,0]=4 3904 B13R2.64 c1cncc(Oc2ccsc2)c1 Amb24394581 [0,0,0,0,2,0|2,0,0]=4 3905 B13R2.64 c1cnn(Cc2ccncc2)c1 Amb25291832 [0,0,0,0,2,0|2,0,0]=4 3906 B13R2.183 c1cc(CNc2ccsc2)sn1 Amb35682525 [0,0,0,0,2,0|2,0,0]=4 3907 B13R2.183 c1cc(NCc2cncs2)cs1 Amb27952362 [0,0,0,0,2,0|2,0,0]=4 3908 B13R2.183 c1ccn(NCc2ccns2)c1 Amb35720586 [0,0,0,0,2,0|2,0,0]=4 3909 B13R2.183 c1nc(CNc2ccsc2)co1 Amb27192031 [0,0,0,0,2,0|2,0,0]=4 3910 B13R2.183 c1ncc(CNc2ccsc2)o1 Amb28429138 [0,0,0,0,2,0|2,0,0]=4 3911 B17R2.2382 C(=C\c1ccccc1)/CNc2ccccn2 Amb17100159 [0,0,0,0,0,2|2,0,0]=4 3912 B17R2.2382 C(=N\OCc1ccccc1)/c2cccnc2 Amb24072697 [0,0,0,0,0,2|0,0,2]=4 3913 B17R2.2382 c1ccc(CCCNc2ccccc2)cc1 Amb4313446 [0,0,0,0,0,2|1,0,0]=3 3914 B17R2.2382 c1ccc(CCCSc2ccccc2)cc1 Amb4010759 [0,0,0,0,0,2|2,0,0]=4 3915 B17R2.2382 c1ccc(CCNCc2ccccc2)cc1 Amb1049050 [0,0,0,0,0,2|1,0,0]=3 3916 B17R2.2382 c1ccc(CCNCc2ccccc2)cc1 Amb33439 [0,0,0,0,0,2|1,0,0]=3 3917 B17R2.2382 c1ccc(CCNCc2ccccn2)cc1 Amb22279533 [0,0,0,0,0,2|2,0,0]=4 3918 B17R2.2382 c1ccc(CCNCc2ccccn2)cc1 Amb838410 [0,0,0,0,0,2|2,0,0]=4 3919 B17R2.2382 c1ccc(CCNCc2cccnc2)cc1 Amb15740914 [0,0,0,0,0,2|0,0,0]=2 3920 B17R2.2382 c1ccc(CCNCc2cccnc2)cc1 Amb33527540 [0,0,0,0,0,2|0,0,0]=2 3921 B17R2.2382 c1ccc(CCNCc2cccnc2)nc1 Amb6694375 [0,0,0,0,0,2|1,0,0]=3 3922 B17R2.2382 c1ccc(CCNCc2ccncc2)cc1 Amb838157 [0,0,0,0,0,2|2,0,0]=4 3923 B17R2.2382 c1ccc(CNCCc2ccccn2)cc1 Amb1397745 [0,0,0,0,0,2|2,0,0]=4 3924 B17R2.2382 c1ccc(CNCCc2cccnc2)cc1 Amb27947338 [0,0,0,0,0,2|0,0,0]=2 3925 B17R2.2382 c1ccc(CNCCc2ccncc2)cc1 Amb2592523 [0,0,0,0,0,2|2,0,0]=4 3926 B17R2.2382 c1ccc(CNOCc2ccccc2)cc1 Amb27611604 [0,0,0,0,0,2|1,0,0]=3 3927 B17R2.2382 c1ccc(CONCc2cccnc2)cc1 Amb28042688 [0,0,0,0,0,2|0,0,0]=2 3928 B17R2.2382 c1ccc(CONCc2ccncc2)cc1 Amb28249603 [0,0,0,0,0,2|2,0,0]=4 3929 B17R2.2382 c1ccc(CONCc2cnccn2)cc1 Amb28192646 [0,0,0,0,0,2|1,0,0]=3 3930 B17R2.2382 c1ccc(CSSCc2ccccc2)cc1 Amb3978810 [0,0,0,0,0,2|2,0,0]=4 3931 B17R2.2382 c1ccc(C[Se][Se]Cc2ccccc2)cc1 Amb8515143 [0,0,0,0,0,2|2,0,0]=4 3932 B17R2.2382 c1ccc(NCCNc2ccccc2)cc1 Amb2720079 [0,0,0,0,0,2|1,0,0]=3 3933 B17R2.2382 c1ccc(OCCNc2ccccn2)cc1 Amb17100119 [0,0,0,0,0,2|2,0,0]=4 3934 B17R2.2382 c1ccc(OCCNc2ccncc2)cc1 Amb24186955 [0,0,0,0,0,2|2,0,0]=4 3935 B17R2.2382 c1ccc(OCCOc2ccccc2)cc1 Amb6356501 [0,0,0,0,0,2|2,0,0]=4 3936 B17R2.2382 c1ccc(SCCSc2ccccc2)cc1 Amb2684781 [0,0,0,0,0,2|2,0,0]=4 3937 B17R2.2382 c1ccc(\N=N\NNc2ccccc2)cc1 Amb21953597 [0,0,0,0,0,2|2,0,0]=4