0 B17R2.41860 Cc1cc(Nc2cccc(Cl)c2)ncc1N Amb17214390 [0,0,0,0,0,0|4,0,0]=4 1 B17R2.41860 Cc1cc(Oc2cccc(Cl)c2)ncc1N Amb31110729 [0,0,0,0,0,0|4,0,0]=4 2 B16R2.124 O=C1C=CN(Cc2ccccc2)C=C1O Amb27624619 [1,0,0,0,0,0|3,0,0]=4 3 B16R2.124 Oc1ccc(Cc2ccccc2)cc1O Amb24060583 [1,0,0,0,0,0|2,0,1]=4 4 B16R2.131 Clc1cccc(Nc2ccc(Br)cn2)c1 Amb18080539 [1,0,0,0,0,0|3,0,0]=4 5 B16R2.131 Clc1cccc(Oc2ccc(Br)cn2)c1 Amb27168395 [1,0,0,0,0,0|3,0,0]=4 6 B16R2.131 Clc1cccc(Oc2ccc(Cl)nn2)c1 Amb2642256 [1,0,0,0,0,0|2,0,1]=4 7 B16R2.131 Nc1ccc(Cc2cccc(Cl)c2)cc1 Amb17101869 [1,0,0,0,0,0|3,0,0]=4 8 B16R2.131 Nc1ccc(Nc2cccc(Cl)c2)nc1 Amb9212056 [1,0,0,0,0,0|3,0,0]=4 9 B16R2.131 Nc1ccc(Oc2cccc(Cl)c2)nc1 Amb1138136 [1,0,0,0,0,0|3,0,0]=4 10 B16R2.131 Nc1ccc(Oc2cccc(Cl)c2)nn1 Amb18658596 [1,0,0,0,0,0|2,0,1]=4 11 B16R2.251 Fc1ccnc(Cc2cccc(Cl)c2)n1 Amb29883304 [1,0,0,0,0,0|3,0,0]=4 12 B16R2.251 Nc1cccc(Cc2cc(O)ncn2)c1 Amb18864359 [1,0,0,0,0,0|3,0,0]=4 13 B16R2.251 Nc1cccc(Cc2nccc(O)n2)c1 Amb18864358 [1,0,0,0,0,0|3,0,0]=4 14 B16R2.251 Nc1ccnc(Nc2cccc(Cl)c2)c1 Amb17341539 [1,0,0,0,0,0|3,0,0]=4 15 B16R2.251 Nc1ccnc(Oc2cccc(Cl)c2)c1 Amb18956424 [1,0,0,0,0,0|3,0,0]=4 16 B16R2.251 OC1C=C(Cc2cccc(Cl)c2)CNC1 Amb32989291 [1,0,0,0,0,0|1,0,2]=4 17 B16R2.251 Oc1cc(Cc2cccc(Br)c2)ncn1 Amb18884041 [1,0,0,0,0,0|2,1,0]=4 18 B16R2.251 Oc1cccc(Cc2cccc(O)c2)c1 Amb17595309 [1,0,0,0,0,0|3,0,0]=4 19 B16R2.251 Oc1ccnc(Cc2cccc(Br)c2)n1 Amb18884040 [1,0,0,0,0,0|2,1,0]=4 20 B16R2.2917 Cc1cc(-c2cccc(Cl)c2)ncc1Br Amb32654943 [0,0,0,0,1,0|3,0,0]=4 21 B16R2.2917 Cc1cccc(C2=CNC(=O)C(N)=C2)c1 Amb18538572 [0,0,0,0,1,0|3,0,0]=4 22 B16R2.2917 Cc1nnc(-c2cccc(Cl)c2)nc1O Amb3593299 [0,0,0,0,1,0|2,0,1]=4 23 B16R2.2917 NC1=CC(c2cccc(Cl)c2)=CNC1=O Amb18036025 [0,0,0,0,1,0|2,0,0]=3 24 B16R2.2917 NC1=CC(c2cccc(F)c2)=CNC1=O Amb18538588 [0,0,0,0,1,0|2,1,0]=4 25 B16R2.25761 Cc1cn(Cc2cccc(Cl)c2)nc1I Amb27247729 [0,0,0,0,1,0|3,0,0]=4 26 B16R2.25761 Cc1cn(Cc2cccc(Cl)c2)nc1N Amb23571682 [0,0,0,0,1,0|3,0,0]=4 27 B16R2.25761 Cc1nn(Cc2cccc(Cl)c2)cc1N Amb27247340 [0,0,0,0,1,0|3,0,0]=4 28 B16R2.25761 Clc1cccc(Cn2cc(Br)c(I)n2)c1 Amb27952896 [0,0,0,0,1,0|3,0,0]=4 29 B16R2.25761 Cn1nc(Cc2cccc(Cl)c2)cc1N Amb17245298 [0,0,0,0,1,0|3,0,0]=4 30 B16R2.25761 Nc1nn(Cc2cccc(Cl)c2)cc1Br Amb33037802 [0,0,0,0,1,0|3,0,0]=4 31 B16R2.25761 Nc1nn(Cc2cccc(Cl)c2)cc1Cl Amb33037801 [0,0,0,0,1,0|3,0,0]=4 32 B15R2.29 Brc1ccc(Cc2ccccc2)nc1 Amb25673195 [2,0,0,0,0,0|2,0,0]=4 33 B15R2.29 Clc1ccc(Cc2ccccc2)nn1 Amb2427199 [2,0,0,0,0,0|1,0,1]=4 34 B15R2.29 Fc1ccc(Cc2ccccc2)nc1 Amb24517032 [2,0,0,0,0,0|2,0,0]=4 35 B15R2.29 Nc1ccc(Cc2ccccc2)nc1 Amb18191583 [2,0,0,0,0,0|2,0,0]=4 36 B15R2.29 Nc1ccc(Cc2ccccc2)nn1 Amb18822485 [2,0,0,0,0,0|1,0,1]=4 37 B15R2.29 O=C1C=CC(Cc2ccccc2)=CO1 Amb27755369 [2,0,0,0,0,0|2,0,0]=4 38 B15R2.29 O=C1C=CC(Oc2ccccc2)=NN1 Amb26961886 [2,0,0,0,0,0|1,0,0]=3 39 B15R2.29 Oc1ccc(Cc2ccccc2)nc1 Amb18649107 [2,0,0,0,0,0|1,0,1]=4 40 B15R2.31 Clc1cccc(Nc2ccccn2)c1 Amb18269162 [2,0,0,0,0,0|2,0,0]=4 41 B15R2.31 Oc1cc(Cc2ccccc2)ncn1 Amb9174456 [2,0,0,0,0,0|2,0,0]=4 42 B15R2.31 Oc1cccc(Cc2ccccc2)c1 Amb10602238 [2,0,0,0,0,0|2,0,0]=4 43 B15R2.31 Oc1ccnc(Cc2cccnc2)c1 Amb27628895 [2,0,0,0,0,0|2,0,0]=4 44 B15R2.31 Oc1cncc(Cc2ccccc2)c1 Amb4466318 [2,0,0,0,0,0|1,0,1]=4 45 B17R2.5352 O=C1NC(=O)N(Cc2ccccc2)C=C1O Amb27614333 [1,1,0,0,0,0|2,0,0]=4 46 B17R2.408 Cc1ccc(C2=NNC(=O)C(N)=C2)cc1C Amb18016090 [0,1,0,0,1,0|2,0,0]=4 47 B17R2.2417 Cc1cc(-c2cccc(Cl)c2)ncc1C=O Amb33872971 [0,1,0,0,1,0|2,0,0]=4 48 B17R2.2491 N#CC1=CC(c2cccc(Cl)c2)=CNC1=O Amb18038663 [0,1,0,0,1,0|2,0,0]=4 49 B17R2.3485 Cc1ccc(C)c(C2=NNC(=O)C(N)=C2)c1 Amb18016092 [0,1,0,0,1,0|2,0,0]=4 50 B17R2.3485 NC1=CC(c2cc(Cl)ccc2Cl)=NNC1=O Amb18016097 [0,1,0,0,1,0|1,0,0]=3 51 B17R2.2599 Cc1nc(Cc2cccc(Cl)c2)sc1CO Amb17354590 [0,1,0,0,1,0|2,0,0]=4 52 B17R2.222 NNC(=O)c1ccc(-c2cccc(Cl)c2)o1 Amb23491184 [0,0,1,1,0,0|0,0,2]=4 53 B17R2.222 O=C(NO)c1ccc(-c2cccc(Cl)c2)o1 Amb23551884 [0,0,1,1,0,0|1,0,1]=4 54 B15R2.94 CC1=CC(c2ccccc2)=CNC1=O Amb27454275 [1,0,0,0,1,0|2,0,0]=4 55 B15R2.94 CC1=CC(c2ccccc2)=NNC1=O Amb22034430 [1,0,0,0,1,0|1,0,0]=3 56 B15R2.94 Cc1cnc(-c2ccccc2)cc1O Amb27634087 [1,0,0,0,1,0|2,0,0]=4 57 B15R2.94 NC1=CC(c2ccccc2)=CNC1=O Amb18538522 [1,0,0,0,1,0|2,0,0]=4 58 B15R2.94 NC1=CC(c2ccccc2)=NNC1=O Amb18016084 [1,0,0,0,1,0|1,0,0]=3 59 B15R2.94 O=C1NC=C(c2ccccc2)C=C1F Amb25935149 [1,0,0,0,1,0|2,0,0]=4 60 B15R2.94 O=C1NC=C(c2ccccc2)C=C1O Amb27629139 [1,0,0,0,1,0|1,0,0]=3 61 B15R2.94 O=C1NN=C(c2ccccc2)CC1O Amb28340508 [1,0,0,0,1,0|0,0,2]=4 62 B15R2.94 Oc1cc(-c2ccccc2)ncc1Cl Amb28284541 [1,0,0,0,1,0|2,0,0]=4 63 B15R2.314 CC1=C[C@H](Cc2ccccc2)NC1=O Amb27602226 [1,0,0,0,1,0|1,0,1]=4 64 B15R2.314 CC1=C\C(=C/c2ccccc2)NC1=O Amb28118377 [1,0,0,0,1,0|1,0,1]=4 65 B15R2.314 CC1=C\C(=C\c2ccccc2)NC1=O Amb27248402 [1,0,0,0,1,0|1,0,1]=4 66 B15R2.314 O=C1N=C(Cc2ccccc2)NC1=O Amb28044485 [1,0,0,0,1,0|1,0,1]=4 67 B15R2.28 Cc1cncc(C2=NNC(=O)C=C2)c1 Amb27397888 [1,0,0,0,1,0|2,0,0]=4 68 B15R2.28 Clc1cccc(-c2ccc(Br)cn2)c1 Amb24320471 [1,0,0,0,1,0|2,0,0]=4 69 B15R2.28 Clc1cccc(-c2ccc(Cl)nn2)c1 Amb9174382 [1,0,0,0,1,0|1,0,1]=4 70 B15R2.28 Nc1ccc(-c2cccc(Cl)c2)nc1 Amb17238280 [1,0,0,0,1,0|2,0,0]=4 71 B15R2.28 Nc1ccc(-c2cccc(Cl)c2)nn1 Amb18280556 [1,0,0,0,1,0|1,0,1]=4 72 B15R2.28 Nc1cccc(C2=NNC(=O)C=C2)c1 Amb17991245 [1,0,0,0,1,0|1,0,0]=3 73 B15R2.28 O=C1C=CC(c2cccc(Br)c2)=NN1 Amb19823662 [1,0,0,0,1,0|0,1,0]=3 74 B15R2.28 O=C1C=CC(c2cccc(Cl)c2)=NN1 Amb19747877 [1,0,0,0,1,0|0,0,0]=2 75 B15R2.28 O=C1C=CC(c2cccc(O)c2)=CN1 Amb18649499 [1,0,0,0,1,0|2,0,0]=4 76 B15R2.28 O=C1C=CC(c2cccc(O)c2)=NN1 Amb18038075 [1,0,0,0,1,0|1,0,0]=3 77 B15R2.28 O=C1C=CC(c2cncc(Br)c2)=NN1 Amb35676770 [1,0,0,0,1,0|1,1,0]=4 78 B15R2.28 O=C1C=CC(c2cncc(F)c2)=NN1 Amb27243524 [1,0,0,0,1,0|1,1,0]=4 79 B15R2.28 O=C1C=NC(c2cccc(Cl)c2)=CN1 Amb25827451 [1,0,0,0,1,0|2,0,0]=4 80 B15R2.28 O=C1N=CC(c2cccc(Cl)c2)=CN1 Amb18540833 [1,0,0,0,1,0|2,0,0]=4 81 B15R2.28 Oc1ccc(-c2cccc(Cl)c2)nn1 Amb9174344 [1,0,0,0,1,0|0,0,2]=4 82 B15R2.28 S=C1C=CC(c2cccc(Br)c2)=NN1 Amb19747885 [1,0,0,0,1,0|0,2,0]=4 83 B15R2.28 S=C1C=CC(c2cccc(Cl)c2)=NN1 Amb19747491 [1,0,0,0,1,0|0,1,0]=3 84 B15R2.1115 Clc1cccc(Cn2ccc(Br)n2)c1 Amb28128411 [1,0,0,0,1,0|2,0,0]=4 85 B15R2.1115 Nc1cc(Cc2cccc(Cl)c2)no1 Amb17240111 [1,0,0,0,1,0|2,0,0]=4 86 B15R2.1115 Nc1ccn(Cc2cccc(Cl)c2)n1 Amb33534852 [1,0,0,0,1,0|2,0,0]=4 87 B15R2.1115 Nc1nc(Cc2cccc(Cl)c2)cs1 Amb8887725 [1,0,0,0,1,0|2,0,0]=4 88 B15R2.1115 O=C1CSC(Cc2cccc(Cl)c2)=N1 Amb27395707 [1,0,0,0,1,0|1,0,1]=4 89 B15R2.1115 O=C1NC(Cc2cccc(Cl)c2)=NO1 Amb27975127 [1,0,0,0,1,0|2,0,0]=4 90 B15R2.1115 O=C1NN=C(Cc2cccc(Cl)c2)O1 Amb26478890 [1,0,0,0,1,0|1,0,0]=3 91 B15R2.1115 O=C1NN=C(Cc2cccc(F)c2)O1 Amb26504478 [1,0,0,0,1,0|1,1,0]=4 92 B15R2.30 Cc1cccc(-c2cc(O)ccn2)c1 Amb10599790 [1,0,0,0,1,0|2,0,0]=4 93 B15R2.30 Clc1cccc(-c2cc(Br)ccn2)c1 Amb22480129 [1,0,0,0,1,0|2,0,0]=4 94 B15R2.30 Nc1ccnc(-c2cccc(Cl)c2)c1 Amb24320475 [1,0,0,0,1,0|2,0,0]=4 95 B15R2.30 Oc1cccc(-c2cc(O)ccn2)c1 Amb27956932 [1,0,0,0,1,0|2,0,0]=4 96 B15R2.30 Oc1cccc(-c2cccc(Cl)c2)c1 Amb7094562 [1,0,0,0,1,0|2,0,0]=4 97 B15R2.30 Oc1ccnc(-c2cccc(Br)c2)c1 Amb30028082 [1,0,0,0,1,0|1,1,0]=4 98 B15R2.30 Oc1ccnc(-c2cccc(Cl)c2)c1 Amb25118730 [1,0,0,0,1,0|1,0,0]=3 99 B15R2.30 Oc1ccnc(-c2cccc(F)c2)c1 Amb27772272 [1,0,0,0,1,0|1,1,0]=4 100 B15R2.30 Oc1cncc(-c2cccc(Cl)c2)c1 Amb20617761 [1,0,0,0,1,0|1,0,1]=4 101 B15R2.7137 Cc1onc(-c2cccc(Cl)c2)c1O Amb33297683 [0,0,0,0,2,0|2,0,0]=4 102 B17R2.215 Clc1cccc(COc2ccc(Br)cn2)c1 Amb32666841 [1,0,0,0,0,1|2,0,0]=4 103 B17R2.215 Nc1ccc(NCc2cccc(Cl)c2)nc1 Amb18992522 [1,0,0,0,0,1|2,0,0]=4 104 B17R2.215 Nc1ccc(OCc2cccc(Cl)c2)nc1 Amb31110728 [1,0,0,0,0,1|2,0,0]=4 105 B17R2.215 Nc1ccc(SCc2cccc(Cl)c2)nc1 Amb8932494 [1,0,0,0,0,1|2,0,0]=4 106 B17R2.5300 Clc1cccc(COc2cc(Cl)ccn2)c1 Amb22236304 [1,0,0,0,0,1|2,0,0]=4 107 B17R2.5300 Clc1cccc(CSc2cc(Cl)ccn2)c1 Amb22236305 [1,0,0,0,0,1|2,0,0]=4 108 B17R2.5300 Nc1ccnc(NCc2cccc(Cl)c2)c1 Amb18299324 [1,0,0,0,0,1|2,0,0]=4 109 B17R2.5300 Oc1cccc(CNc2cccc(Cl)c2)c1 Amb6695726 [1,0,0,0,0,1|2,0,0]=4 110 B17R2.5300 Oc1cccc(OCc2cccc(Cl)c2)c1 Amb9211006 [1,0,0,0,0,1|2,0,0]=4