0 B17R2.2342 CC(NCC1=CC=CC=C1)C2=CC=CC=C2 Z57459594 [0,0,0,0,0,0|4,0,0]=4 1 B17R2.2342 C[C@@H](NCC1=CC=CC=C1)C2=CC=CC=C2 Z1148966384 [0,0,0,0,0,0|4,0,0]=4 2 B17R2.2342 NC(CCC1=CC=CC=C1)C2=CC=CC=C2 Z540728426 [0,0,0,0,0,0|3,0,0]=3 3 B17R2.2342 NC(COC1=CC=CC=C1)C2=CC=CC=C2 Z1266823132 [0,0,0,0,0,0|3,0,0]=3 4 B17R2.2342 O=C(CCC1=CC=CC=C1)C2=CC=CC=C2 Z385416922 [0,0,0,0,0,0|2,0,2]=4 5 B17R2.2342 O=C(CNC1=CC=CC=C1)C2=CC=CC=C2 Z2940302026 [0,0,0,0,0,0|1,0,2]=3 6 B17R2.2342 O=C(NCC1=NC=CC=C1)C2=CC=CC=C2 Z30166421 [0,0,0,0,0,0|2,0,2]=4 7 B17R2.2342 O=C(NNC1=NC=CC=C1)C2=NC=CC=C2 Z1610556569 [0,0,0,0,0,0|2,0,2]=4 8 B17R2.2342 O=C(NNC1=NC=CN=C1)C2=CC=CC=C2 Z1209594686 [0,0,0,0,0,0|2,0,2]=4 9 B17R2.2342 OC(CCC1=CC=CC=C1)C2=CC=CC=C2 Z513750588 [0,0,0,0,0,0|2,0,0]=2 10 B17R2.2342 OC(CNC1=NC=CC=C1)C2=CC=CC=C2 Z31268347 [0,0,0,0,0,0|0,0,0]=0 11 B17R2.2342 OC(CNC1=NC=CC=N1)C2=CC=CC=C2 Z31268348 [0,0,0,0,0,0|1,0,0]=1 12 B17R2.2342 O[C@H](CNC1=CC=CC=C1)C2=CC=CC=C2 Z1509334408 [0,0,0,0,0,0|1,0,0]=1 13 B16R2.2256 C1=CC=C(C=C1)CCNC2=CC=CC=C2 Z266463162 [1,0,0,0,0,0|1,0,0]=2 14 B16R2.2256 C1=CC=C(C=C1)CCOC2=NC=CC=C2 Z360509032 [1,0,0,0,0,0|1,0,0]=2 15 B16R2.2256 C1=CC=C(C=C1)CNCC2=CC=CC=C2 Z57127894 [1,0,0,0,0,0|3,0,0]=4 16 B16R2.2256 C1=CN=C(C=C1)N/N=C/C2=CC=NC=C2 Z3219996697 [1,0,0,0,0,0|2,0,1]=4 17 B16R2.2256 C1=CN=C(C=C1)SCCC2=CC=NC=C2 Z102927310 [1,0,0,0,0,0|2,0,0]=3 18 B18R2.253 CC1=CC=C(C=C1)C(=O)CNC2=CC=CC=C2 Z57057728 [0,1,0,0,0,0|1,0,2]=4 19 B18R2.253 CC1=CC=C(C=C1)[C@H](O)CNC2=NC=CN=C2 Z1888569796 [0,1,0,0,0,0|1,0,0]=2 20 B18R2.253 NC(COC1=CC=CC=C1)C2=CC=C(C=C2)Cl Z3679453541 [0,1,0,0,0,0|3,0,0]=4 21 B18R2.253 NC(COC1=CC=CC=C1)C2=CC=C(C=C2)F Z3678312057 [0,1,0,0,0,0|3,0,0]=4 22 B18R2.253 OC(CNC1=NC=CC=N1)C2=CC=C(C=C2)Cl Z304859520 [0,1,0,0,0,0|1,0,0]=2 23 B18R2.257 CC(CNC1=NC=C(C=N1)I)C2=NC=CC=C2 Z2503022658 [0,1,0,0,0,0|3,0,0]=4 24 B18R2.257 NC(CCC1=CC=C(C=C1)F)C2=CC=CC=C2 Z3619608735 [0,1,0,0,0,0|3,0,0]=4 25 B18R2.257 OC(CNC1=NC=C(C=C1)Br)C2=CC=NC=C2 Z1493427493 [0,1,0,0,0,0|1,0,0]=2 26 B18R2.257 OC(COC1=CC=C(C=C1)F)C2=CC=CC=C2 Z291815786 [0,1,0,0,0,0|2,0,0]=3 27 B18R2.257 OC(CSC1=NC=C(C=N1)Br)C2=CC=CC=C2 Z1165943399 [0,1,0,0,0,0|2,0,0]=3 28 B18R2.3606 OCC(NCC1=CC=CC=C1)C2=CC=CC=C2 Z734135116 [0,1,0,0,0,0|3,0,0]=4 29 B18R2.3634 CC(NC(=O)C1=NC=CC=C1)C2=CC=CC=C2 Z31450028 [0,1,0,0,0,0|3,0,0]=4 30 B18R2.3634 CN(CC(O)C1=CN=CC=C1)C2=NC=CN=C2 Z2975220207 [0,1,0,0,0,0|2,0,0]=3 31 B18R2.3990 NC(COC1=C(C=CC=C1)F)C2=CC=CC=C2 Z426041638 [0,1,0,0,0,0|3,0,0]=4 32 B18R2.3990 NC1=C(C=CC=C1)SCC(O)C2=CC=CC=C2 Z600451444 [0,1,0,0,0,0|2,0,0]=3 33 B18R2.3990 OC1=C(C=CC=C1)OCC(O)C2=CC=CC=C2 Z56788164 [0,1,0,0,0,0|2,0,0]=3 34 B18R2.6463 NC(CCC1=CC=CC=C1)C2=CC(=CC=C2)F Z3619662290 [0,1,0,0,0,0|3,0,0]=4 35 B18R2.6463 OC(CNC1=NC=CC=N1)C2=CC(=CC=C2)Cl Z397883056 [0,1,0,0,0,0|1,0,0]=2 36 B18R2.6463 O[C@H](CNC1=NC=CN=C1)C2=CC(=CC=C2)Br Z2017183391 [0,1,0,0,0,0|1,0,0]=2 37 B18R2.7204 CC(C(=O)NC1=NC=CC=C1)C2=CC=CC=C2 Z56859642 [0,1,0,0,0,0|1,0,1]=3 38 B18R2.7204 NC(C(=O)NC1=CC=CC=C1)C2=CC=CC=C2 Z425449794 [0,1,0,0,0,0|2,0,1]=4 39 B18R2.7204 NC(CC1=CC=CC=C1)C(O)C2=CC=CC=C2 Z2418414024 [0,1,0,0,0,0|2,0,0]=3 40 B18R2.7204 O=C(NC1=CC=CC=C1)C(Cl)C2=CC=CC=C2 Z169917702 [0,1,0,0,0,0|2,0,1]=4 41 B18R3.2122 C1=CC=C(C=C1)CC2OC2C3=CC=CC=C3 Z278165248 [0,0,0,1,0,0|2,0,0]=3 42 B18R3.2123 C1=CC=C(C=C1)C2CNC3=C(C2)C=CC=C3 Z1230088877 [0,0,0,1,0,0|2,0,0]=3 43 B18R3.2123 C1=CC=C(C=C1)C2CNC3=C(N2)C=CC=C3 Z1389345725 [0,0,0,1,0,0|2,0,0]=3 44 B18R3.2123 C1=CC=C(C=C1)C2CSC3=C(N2)C=CC=C3 Z90121767 [0,0,0,1,0,0|3,0,0]=4 45 B18R3.2123 C1=CC=C(C=C1)[C@@H]2COC3=C(N2)C=CC=C3 Z5023070093 [0,0,0,1,0,0|3,0,0]=4 46 B18R3.2123 C1=CC=C(C=C1)[C@H]2COC3=C(N2)C=CC=C3 Z5023070095 [0,0,0,1,0,0|3,0,0]=4 47 B16R2.88 CC(NC1=CC=CC=C1)C2=CC=CC=C2 Z266462602 [0,0,0,0,1,0|2,0,0]=3 48 B16R2.88 CC(NC1=NC=CC=C1)C2=CC=CC=C2 Z31195263 [0,0,0,0,1,0|1,0,0]=2 49 B16R2.88 CC(NC1=NC=CC=N1)C2=CC=CC=C2 Z31195264 [0,0,0,0,1,0|2,0,0]=3 50 B16R2.88 CC(SC1=NC=CC=N1)C2=CC=CC=C2 Z18379778 [0,0,0,0,1,0|3,0,0]=4 51 B16R2.88 NC(CC1=CC=CC=C1)C2=CC=CC=C2 Z317046552 [0,0,0,0,1,0|2,0,0]=3 52 B16R2.88 NC(CC1=CC=CC=C1)C2=CC=NC=C2 Z3899831400 [0,0,0,0,1,0|3,0,0]=4 53 B16R2.88 NC(CC1=NC=CC=C1)C2=CC=CC=C2 Z361880710 [0,0,0,0,1,0|1,0,0]=2 54 B16R2.88 NC(CC1=NC=CC=C1)C2=CN=CC=C2 Z381221294 [0,0,0,0,1,0|2,0,0]=3 55 B16R2.88 NN(CC1=CC=CC=C1)C2=CC=CC=C2 Z2686042487 [0,0,0,0,1,0|3,0,0]=4 56 B16R2.88 O=C(CC1=CC=CC=C1)C2=CC=CC=C2 Z56876371 [0,0,0,0,1,0|1,0,2]=4 57 B16R2.88 O=C(CC1=NC=CC=C1)C2=CC=CC=C2 Z361879476 [0,0,0,0,1,0|0,0,2]=3 58 B16R2.88 O=C(CC1=NC=CC=C1)C2=CN=CC=C2 Z381221274 [0,0,0,0,1,0|1,0,2]=4 59 B16R2.88 O=C(CC1=NC=CC=C1)C2=NC=CC=C2 Z1266867366 [0,0,0,0,1,0|1,0,2]=4 60 B16R2.88 O=C(NC1=CC=CC=C1)C2=CC=CC=C2 Z27782673 [0,0,0,0,1,0|1,0,2]=4 61 B16R2.88 O=C(NC1=NC=CC=C1)C2=CC=CC=C2 Z57965551 [0,0,0,0,1,0|0,0,2]=3 62 B16R2.88 O=C(NC1=NC=CC=C1)C2=CC=NC=C2 Z85525283 [0,0,0,0,1,0|1,0,2]=4 63 B16R2.88 O=C(NC1=NC=CC=C1)C2=CN=CC=C2 Z56836501 [0,0,0,0,1,0|1,0,2]=4 64 B16R2.88 O=C(NC1=NC=CC=C1)C2=NC=CC=C2 Z85525276 [0,0,0,0,1,0|1,0,2]=4 65 B16R2.88 O=C(NC1=NC=CN=C1)C2=CC=CC=C2 Z223197060 [0,0,0,0,1,0|1,0,2]=4 66 B16R2.88 O=S(CC1=CC=CC=C1)C2=CC=CC=C2 Z1154814721 [0,0,0,0,1,0|2,0,1]=4 67 B16R2.88 OC(CC1=CC=CC=C1)C2=CC=CC=C2 Z228586240 [0,0,0,0,1,0|1,0,0]=2 68 B16R2.88 OC(CC1=CC=CC=C1)C2=CN=CC=C2 Z513749568 [0,0,0,0,1,0|2,0,0]=3 69 B16R2.88 S=C(NC1=NC=CC=C1)C2=NC=CC=C2 Z1509144734 [0,0,0,0,1,0|1,1,1]=4 70 B16R2.5767 OC(CSC1=NNC=N1)C2=CC=CC=C2 Z1456185322 [0,0,0,0,1,0|3,0,0]=4 71 B18R2.2429 CC(CCC1=CC=CC=C1)NC2=CC=CC=C2 Z334877992 [0,0,0,0,0,1|3,0,0]=4 72 B18R2.2429 O=C(CNC1=CC=CC=C1)NC2=CC=CC=C2 Z56759869 [0,0,0,0,0,1|1,0,2]=4 73 B18R2.7189 NC(CCCC1=CC=CC=C1)C2=CC=CC=C2 Z115458460 [0,0,0,0,0,1|3,0,0]=4 74 B18R2.7189 O=C(NCCC1=NC=CC=C1)C2=CC=CC=C2 Z32446122 [0,0,0,0,0,1|1,0,2]=4 75 B17R2.143 CN(CC1=CC=CC=C1)CC2=NC=CC=C2 Z235571608 [1,1,0,0,0,0|2,0,0]=4 76 B17R2.143 NC(CC1=CC=CC=C1)CC2=CC=CC=C2 Z57157108 [1,1,0,0,0,0|2,0,0]=4 77 B17R2.143 OC(CC1=CC=CC=C1)CC2=CC=CC=C2 Z228586182 [1,1,0,0,0,0|2,0,0]=4 78 B17R2.143 S=C(NC1=CC=CC=C1)NC2=NC=CC=C2 Z56791085 [1,1,0,0,0,0|1,0,1]=4 79 B17R2.216 BrC1=CC=C(C=C1)OCCC2=CC=CC=C2 Z295440190 [1,1,0,0,0,0|2,0,0]=4 80 B17R2.216 BrC1=CN=C(C=C1)SCOC2=CC=CC=C2 Z1588953102 [1,1,0,0,0,0|2,0,0]=4 81 B17R2.216 CC1=CC=C(C=C1)CNCC2=NC=CC=C2 Z89266616 [1,1,0,0,0,0|2,0,0]=4 82 B17R2.216 ClC1=CC=C(C=C1)CCNC2=NC=CC=N2 Z31244480 [1,1,0,0,0,0|1,0,0]=3 83 B17R2.216 ClC1=NN=C(C=C1)NCCC2=CC=CC=C2 Z359300608 [1,1,0,0,0,0|1,0,0]=3 84 B17R2.216 FC1=CN=C(N=C1)NCCC2=CN=CC=C2 Z1481110306 [1,1,0,0,0,0|2,0,0]=4 85 B17R2.216 IC1=CC=C(C=C1)OCCC2=CC=CC=C2 Z1136967903 [1,1,0,0,0,0|2,0,0]=4 86 B17R2.216 NC1=CC=C(C=C1)NCCC2=CC=CC=C2 Z56783552 [1,1,0,0,0,0|1,0,0]=3 87 B17R2.216 OC1=CC=C(C=C1)NCCC2=CC=CC=C2 Z1250092420 [1,1,0,0,0,0|1,0,0]=3 88 B17R2.216 OC1=CC=C(C=C1)OCCC2=CC=CC=C2 Z381414712 [1,1,0,0,0,0|2,0,0]=4 89 B17R2.3956 BrC1=C(C=CC=C1)/C=N/NC2=NC=CC=C2 Z49660484 [1,1,0,0,0,0|1,0,1]=4 90 B17R2.3956 CC1=C(C=CC=C1)CNCC2=NC=CC=C2 Z234896761 [1,1,0,0,0,0|2,0,0]=4 91 B17R2.3956 NC1=C(C=CC=C1)NCCC2=CC=CC=C2 Z56837104 [1,1,0,0,0,0|1,0,0]=3 92 B17R2.3956 NC1=C(C=CC=C1)OCCC2=CC=CC=C2 Z239127498 [1,1,0,0,0,0|2,0,0]=4 93 B17R2.3956 NC1=C(C=CN=C1)NCCC2=CC=CC=C2 Z3211765479 [1,1,0,0,0,0|2,0,0]=4 94 B17R2.5301 CC1=CC(=CC=C1)CNCC2=NC=CC=C2 Z234896757 [1,1,0,0,0,0|2,0,0]=4 95 B17R2.5301 ClC1=CC(=CC=C1)CCNC2=NC=CC=N2 Z52585050 [1,1,0,0,0,0|1,0,0]=3 96 B17R2.5301 FC1=CC(=CC=C1)/C=N/NC2=NC=CC=C2 Z49660399 [1,1,0,0,0,0|1,0,1]=4 97 B17R2.5301 NC1=CC(=CC=C1)OCCC2=CC=CC=C2 Z600428416 [1,1,0,0,0,0|2,0,0]=4 98 B17R2.5301 OC1=CC(=CC=C1)/C=N/NC2=NC=CC=C2 Z49660400 [1,1,0,0,0,0|1,0,1]=4 99 B17R2.162 NCC(CC1=CC=CC=C1)C2=CC=CC=C2 Z415655026 [0,1,0,0,1,0|2,0,0]=4 100 B17R2.162 OCC(NC1=CC=CC=C1)C2=CC=CC=C2 Z734137514 [0,1,0,0,1,0|1,0,0]=3 101 B17R2.162 OC[C@H](NC1=CC=CC=C1)C2=CC=CC=C2 Z1509259694 [0,1,0,0,1,0|1,0,0]=3 102 B17R2.192 CC(NC1=CC=CC=C1)C2=CC=C(C=C2)Cl Z334878010 [0,1,0,0,1,0|2,0,0]=4 103 B17R2.192 CC1=CC=C(C=C1)C(=O)CC2=NC=CC=C2 Z361879474 [0,1,0,0,1,0|0,0,2]=4 104 B17R2.192 CC1=CC=C(C=C1)C(=O)NC2=NC=CC=C2 Z85525345 [0,1,0,0,1,0|0,0,2]=4 105 B17R2.192 NC(CC1=CC=CC=C1)C2=CC=C(C=C2)Cl Z812517126 [0,1,0,0,1,0|2,0,0]=4 106 B17R2.192 NC(CC1=CC=CC=C1)C2=CC=C(C=C2)F Z4960342904 [0,1,0,0,1,0|2,0,0]=4 107 B17R2.192 O=C(CC1=NC=CC=C1)C2=CC=C(C=C2)Br Z361879504 [0,1,0,0,1,0|0,0,2]=4 108 B17R2.192 O=C(CC1=NC=CC=C1)C2=CC=C(C=C2)Cl Z361879500 [0,1,0,0,1,0|0,0,2]=4 109 B17R2.192 O=C(NC1=NC=CC=C1)C2=CC=C(C=C2)Br Z57070201 [0,1,0,0,1,0|0,0,2]=4 110 B17R2.192 O=C(NC1=NC=CC=C1)C2=CC=C(C=C2)Cl Z85525292 [0,1,0,0,1,0|0,0,2]=4 111 B17R2.192 O=C(NC1=NC=CC=C1)C2=CC=C(C=C2)F Z85525288 [0,1,0,0,1,0|0,0,2]=4 112 B17R2.192 O=C(NC1=NC=CC=C1)C2=CC=C(C=C2)I Z85525309 [0,1,0,0,1,0|0,0,2]=4 113 B17R2.192 O=C(NC1=NC=CC=C1)C2=CC=C(C=C2)O Z85525277 [0,1,0,0,1,0|0,0,2]=4 114 B17R2.192 OC(CC1=CC=CC=C1)C2=CC=C(C=C2)Br Z513748404 [0,1,0,0,1,0|1,0,0]=3 115 B17R2.209 CC(NC1=CC=C(C=C1)N)C2=CC=CC=C2 Z359511624 [0,1,0,0,1,0|2,0,0]=4 116 B17R2.209 CC(NC1=NN=C(C=C1)Cl)C2=CC=CC=C2 Z108584150 [0,1,0,0,1,0|2,0,0]=4 117 B17R2.209 CC1=CN=C(C=C1)NC(=O)C2=CC=CC=C2 Z71579674 [0,1,0,0,1,0|0,0,2]=4 118 B17R2.209 NC(CC1=CC=C(C=C1)Cl)C2=CC=CC=C2 Z744843974 [0,1,0,0,1,0|2,0,0]=4 119 B17R2.209 NC(CC1=CC=C(C=C1)F)C2=CC=CC=C2 Z234897665 [0,1,0,0,1,0|2,0,0]=4 120 B17R2.209 NC1=CN=C(C=C1)NC(=O)C2=CC=CC=C2 Z381427094 [0,1,0,0,1,0|0,0,2]=4 121 B17R2.3417 CC(NC1=CC=CC=C1)C2=C(C=CC=C2)Cl Z266462554 [0,1,0,0,1,0|2,0,0]=4 122 B17R2.3417 CC(NC1=NC=CC=N1)C2=C(C=CC=C2)F Z31046926 [0,1,0,0,1,0|2,0,0]=4 123 B17R2.3417 CC1=C(C=CC=C1)C(C)NC2=NC=CC=N2 Z203927082 [0,1,0,0,1,0|2,0,0]=4 124 B17R2.3417 CC1=C(C=CC=C1)S(=O)CC2=NC=CC=C2 Z1838101683 [0,1,0,0,1,0|1,0,1]=4 125 B17R2.3417 NC(CC1=CC=CC=C1)C2=C(C=CC=C2)F Z734158440 [0,1,0,0,1,0|2,0,0]=4 126 B17R2.3417 O=C(NC1=NC=CC=C1)C2=C(C=CC=C2)Br Z57596242 [0,1,0,0,1,0|0,0,2]=4 127 B17R2.3417 O=C(NC1=NC=CC=C1)C2=C(C=CC=C2)Cl Z85525275 [0,1,0,0,1,0|0,0,2]=4 128 B17R2.3417 O=C(NC1=NC=CC=C1)C2=C(C=CC=C2)O Z56871634 [0,1,0,0,1,0|0,0,2]=4 129 B17R2.3417 OC1=C(C=CC=C1)C(O)CC2=CC=CC=C2 Z1513808202 [0,1,0,0,1,0|1,0,0]=3 130 B17R2.3426 NC(CC1=C(C=CC=C1)Cl)C2=CC=CC=C2 Z1262237165 [0,1,0,0,1,0|2,0,0]=4 131 B17R2.5273 CC1=CC(=CC=C1)C(=O)NC2=NC=CC=C2 Z57070411 [0,1,0,0,1,0|0,0,2]=4 132 B17R2.5273 CC1=CC(=CC=C1)S(=O)CC2=NC=CC=C2 Z1838101868 [0,1,0,0,1,0|1,0,1]=4 133 B17R2.5273 NC1=CC(=CC=C1)C(=O)NC2=NC=CC=C2 Z239124864 [0,1,0,0,1,0|0,0,2]=4 134 B17R2.5273 O=C(NC1=NC=CC=C1)C2=CC=CC(=C2)Cl Z57087578 [0,1,0,0,1,0|0,0,2]=4 135 B17R2.5273 O=C(NC1=NC=CC=C1)C2=CC=CC(=C2)O Z85525289 [0,1,0,0,1,0|0,0,2]=4 136 B17R2.5273 O=S(CC1=NC=CC=C1)C2=CC=CC(=C2)O Z1838110002 [0,1,0,0,1,0|1,0,1]=4 137 B17R2.5293 CC1=CC(=NC=C1)NC(=O)C2=CC=CC=C2 Z71388632 [0,1,0,0,1,0|0,0,2]=4 138 B17R2.5293 CC1=NC(=CC=C1)NC(=O)C2=CC=CC=C2 Z71545277 [0,1,0,0,1,0|0,0,2]=4 139 B17R2.5293 NC(CC1=CC(=CC=C1)O)C2=CC=CC=C2 Z1431002726 [0,1,0,0,1,0|2,0,0]=4 140 B17R2.5293 O=C(NC1=CC=CC(=N1)Br)C2=CC=CC=C2 Z425865044 [0,1,0,0,1,0|0,0,2]=4 141 B17R2.10205 CN(C(=O)C1=CC=CC=C1)C2=NC=CC=C2 Z223364402 [0,1,0,0,1,0|0,0,2]=4 142 B17R2.10205 N[C@@H](C1=CC=CC=C1)[C@@H](N)C2=CC=CC=C2 Z1509382162 [0,1,0,0,1,0|2,0,0]=4 143 B17R2.10205 N[C@@H](C1=CC=CC=C1)[C@H](O)C2=CC=CC=C2 Z1509382274 [0,1,0,0,1,0|1,0,0]=3 144 B17R2.10205 N[C@H](C1=CC=CC=C1)[C@@H](O)C2=CC=CC=C2 Z1272732445 [0,1,0,0,1,0|1,0,0]=3 145 B17R2.10205 N[C@H](C1=CC=CC=C1)[C@H](N)C2=CC=CC=C2 Z1509382122 [0,1,0,0,1,0|2,0,0]=4 146 B17R2.10205 O=C(C1=CC=CC=C1)C(O)C2=CC=CC=C2 Z57160197 [0,1,0,0,1,0|1,0,1]=4 147 B17R2.20249 CC(N)(CC1=CC=CC=C1)C2=CC=CC=C2 Z449373382 [0,1,0,0,1,0|2,0,0]=4 148 B17R2.20249 O=S(=O)(NC1=NC=CC=C1)C2=CC=CC=C2 Z45654193 [0,1,0,0,1,0|1,0,1]=4 149 B17R2.5287 CC1=NC(=CN=C1)NCC(O)C2=CC=CO2 Z1661401428 [0,1,0,0,1,0|2,0,0]=4 150 B17R2.3519 CN1C=CN=C1SCC(O)C2=CC=CC=C2 Z102921812 [0,1,0,0,1,0|2,0,0]=4 151 B19R2.286 OC(CNC1=NC=C(C=C1)F)CC2=CC=CC=C2 Z2034468229 [0,1,0,0,0,1|0,0,0]=2 152 B19R2.8924 CC(NC1=NC=CN=C1)C(O)CC2=CC=CC=C2 Z1481206398 [0,1,0,0,0,1|1,0,0]=3 153 B19R2.8924 CC(OC1=CC=CC=C1)C(=O)NC2=NC=CC=C2 Z85525571 [0,1,0,0,0,1|1,0,1]=4 154 B19R2.11857 O=C(CNC1=NC=CC=C1)NC2=CC=C(C=C2)Br Z646300374 [0,1,0,0,0,1|0,0,2]=4 155 B19R2.4201 OC(CNCC1=CC=CC=C1)C2=CC=C(C=C2)F Z240972902 [0,1,0,0,0,1|1,0,0]=3 156 B19R2.4201 OC(CNCC1=CN=CC=C1)C2=CC=C(C=C2)Cl Z279754226 [0,1,0,0,0,1|2,0,0]=4 157 B19R2.4369 CC1=NC(=CC=C1)NCCC(O)C2=CC=CC=C2 Z1722746520 [0,1,0,0,0,1|0,0,0]=2 158 B19R2.4369 OC(CNCC1=CC(=CC=C1)Br)C2=CC=CC=C2 Z57778356 [0,1,0,0,0,1|1,0,0]=3 159 B19R2.4369 OC1=CC=CC(=C1)CNCC(O)C2=CC=CC=C2 Z86149283 [0,1,0,0,0,1|1,0,0]=3 160 B19R2.4394 CC1=CC(=CC=C1)C(O)CNCC2=CC=CC=C2 Z1020686124 [0,1,0,0,0,1|1,0,0]=3 161 B19R2.4394 OC(CNCC1=CC=CC=C1)C2=CC(=CC=C2)F Z641209084 [0,1,0,0,0,1|1,0,0]=3 162 B19R2.4481 OC(CNCC1=C(C=CC=C1)Cl)C2=CC=CC=C2 Z31378030 [0,1,0,0,0,1|1,0,0]=3 163 B19R2.4481 OC(CNCC1=C(C=CC=C1)I)C2=CC=CC=C2 Z90533177 [0,1,0,0,0,1|1,0,0]=3 164 B19R2.5666 OC(CNCC1=CC=CC=C1)C2=C(C=CC=C2)F Z355415026 [0,1,0,0,0,1|1,0,0]=3 165 B19R2.8898 CC(CNC(=O)C1=NC=CN=C1)C2=CC=CC=C2 Z28952376 [0,1,0,0,0,1|2,0,0]=4 166 B19R2.8898 CC(NCC(O)C1=CC=CC=C1)C2=CC=CC=C2 Z56977545 [0,1,0,0,0,1|1,0,0]=3 167 B19R2.8898 O=C(NCC(O)C1=CC=CC=C1)C2=CC=CC=C2 Z68482365 [0,1,0,0,0,1|1,0,0]=3 168 B19R2.8898 O=C(NCC(O)C1=CC=CC=C1)C2=CC=NC=C2 Z102865594 [0,1,0,0,0,1|2,0,0]=4 169 B19R2.11850 CC1=CC=C(C=C1)CNCC(C)C2=CC=CC=C2 Z89266623 [0,1,0,0,0,1|2,0,0]=4 170 B19R2.11850 CC1=CN=C(C=C1)CNCC(O)C2=NC=CC=C2 Z3006037129 [0,1,0,0,0,1|1,0,0]=3 171 B19R2.11850 OC(CNCC1=CC=C(C=C1)Cl)C2=CC=CC=C2 Z901308720 [0,1,0,0,0,1|1,0,0]=3 172 B19R2.283 CC(C(=O)NC1=NC=CC=C1)C2=CC=C(C=C2)Cl Z3835516862 [0,2,0,0,0,0|1,0,1]=4 173 B19R2.4200 OC(CNC1=NC(=CN=C1)Cl)C2=CC=C(C=C2)F Z805401906 [0,2,0,0,0,0|1,0,0]=3 174 B19R2.12067 OC(CNC1=C(C=CC=N1)F)C2=CC=C(C=C2)Cl Z1373418393 [0,2,0,0,0,0|0,0,0]=2 175 B19R2.12067 O[C@H](CNC1=C(C=NC=C1)Cl)C2=CC=C(C=C2)F Z1883471921 [0,2,0,0,0,0|2,0,0]=4 176 B19R2.12286 CC1=CN=C(N=C1)N(C)CC(O)C2=CN=CC=C2 Z2975220217 [0,2,0,0,0,0|2,0,0]=4 177 B19R2.12286 CN(CC(O)C1=CN=CC=C1)C2=NC=C(C=N2)Br Z2975220503 [0,2,0,0,0,0|2,0,0]=4 178 B19R2.12286 CN(CC(O)C1=CN=CC=C1)C2=NC=C(C=N2)F Z2975220362 [0,2,0,0,0,0|2,0,0]=4 179 B19R2.79 CC(CNC1=NC=C(C=C1)C#N)C2=CC=CC=C2 Z219207292 [0,2,0,0,0,0|1,0,0]=3 180 B19R2.285 OC(CNC1=NC=C(C=C1)Cl)C2=CC(=CC=C2)F Z1272756860 [0,2,0,0,0,0|0,0,0]=2 181 B19R2.4181 CC1=CC=C(C=C1)NC(=O)C(O)C2=CC=CC=C2 Z223867518 [0,2,0,0,0,0|1,0,1]=4 182 B19R2.4181 O=C(NC1=CC=C(C=C1)F)C(O)C2=CC=CC=C2 Z223865550 [0,2,0,0,0,0|1,0,1]=4 183 B19R2.11845 CC(O)(CNC1=NC=C(C=N1)Br)C2=CC=CC=C2 Z1205177967 [0,2,0,0,0,0|1,0,0]=3 184 B19R2.12083 OC(CNC1=NC=C(C=N1)Br)C2=C(C=CC=C2)F Z1165941827 [0,2,0,0,0,0|1,0,0]=3 185 B19R2.201 CCN(CC(O)C1=CC=CC=C1)C2=CC=CC=C2 Z600456428 [0,2,0,0,0,0|1,0,0]=3 186 B19R2.2265 CCC(C(=O)NC1=NC=CC=C1)C2=CC=CC=C2 Z85525457 [0,2,0,0,0,0|1,0,1]=4 187 B19R2.2265 COC(C(=O)NC1=NC=CN=C1)C2=CC=CC=C2 Z1696931957 [0,2,0,0,0,0|1,0,1]=4 188 B19R2.2265 CO[C@@H](C(=O)NC1=NC=CN=C1)C2=CC=CC=C2 Z1696948817 [0,2,0,0,0,0|1,0,1]=4 189 B19R2.2541 CN(C)C(CNC1=NC=CC=N1)C2=CC=CC=C2 Z31092552 [0,2,0,0,0,0|2,0,0]=4 190 B19R2.43272 CC1=NC(=CC=C1)NCC(CO)C2=CC=CC=C2 Z1722755225 [0,2,0,0,0,0|0,0,0]=2 191 B19R2.5647 CN(CC(O)C1=CN=CC=C1)C2=C(C=NC=N2)Cl Z2975220746 [0,2,0,0,0,0|2,0,0]=4 192 B19R2.48175 [O-][N+]1=C(C=CC=C1)SCC(O)C2=CC(=CC=C2)Br Z320992826 [0,2,0,0,0,0|1,0,1]=4 193 B19R2.50154 OC(CNC1=C(C=CC=N1)Cl)C2=C(C=CC=C2)F Z1396557961 [0,2,0,0,0,0|0,0,0]=2 194 B19R2.50154 OC(COC1=C(C=CC=C1)Br)C2=C(C=CC=C2)F Z1516629959 [0,2,0,0,0,0|2,0,0]=4 195 B19R2.3421 COC1=C(C=CC=C1)C(O)CNC2=NC=CC=N2 Z397888374 [0,2,0,0,0,0|1,0,0]=3 196 B19R2.101351 OC(CNC1=NC(=CC=C1)F)C2=C(C=CC=C2)F Z1343224330 [0,2,0,0,0,0|0,0,0]=2 197 B19R2.7669 CC(C(=O)NC1=NC=CC=C1)C2=CC(=CC=C2)F Z1265789830 [0,2,0,0,0,0|1,0,1]=4 198 B19R2.48071 CC(O)(CNC1=NC=CN=C1)C2=CC(=CC=C2)Cl Z1693018313 [0,2,0,0,0,0|1,0,0]=3 199 B19R2.883 CSC1=NC(=CN=C1)NCC(O)C2=CC=NC=C2 Z1716294022 [0,2,0,0,0,0|2,0,0]=4 200 B19R2.4101 CC1=NC(=NC(=C1)NCC(O)C2=CC=CC=C2)C Z318733760 [0,2,0,0,0,0|1,0,0]=3 201 B19R2.4101 NC1=NC(=CC(=N1)Cl)NCC(O)C2=CC=CC=C2 Z328616912 [0,2,0,0,0,0|1,0,0]=3 202 B19R2.4101 NC1=NC(=CC(=N1)Cl)SCC(O)C2=CC=CC=C2 Z646057332 [0,2,0,0,0,0|2,0,0]=4 203 B19R2.4366 O=C(NC1=CC(=CC=C1)F)C(O)C2=CC=CC=C2 Z223868524 [0,2,0,0,0,0|1,0,1]=4 204 B17R2.45544 OC(CNCC1=CC=CO1)C2=CC=CC=C2 Z31367500 [0,0,1,1,0,0|1,0,1]=4 205 B17R2.45544 OC(CNCC1=CC=CS1)C2=CC=CC=C2 Z56172019 [0,0,1,1,0,0|1,0,1]=4 206 B17R3.8 C1=CN=C(N=C1)N2CCC3=C2C=CC=C3 Z54630265 [1,0,0,1,0,0|1,0,0]=3 207 B19R3.288 OC1CC2=C(C1SC3=NC=CC=N3)C=CC=C2 Z2213888600 [0,0,0,1,0,1|2,0,0]=4 208 B19R3.19255 C1=CN=C(N=C1)NCC2=CC3=C(O2)C=CC=C3 Z645383130 [0,0,0,1,0,1|1,0,1]=4 209 B19R3.2382 C1=CC=C(C=C1)CNCC2CC3=C2C=CC=C3 Z594039066 [0,0,0,1,0,1|2,0,0]=4 210 B19R3.3862 BrC1=CC=C(C=C1)C2CNC3=C(O2)C=CC=C3 Z4754675030 [0,1,0,1,0,0|1,0,0]=3 211 B19R3.9171 N[C@@H]1C[C@H](OC2=C1C=CC=C2)C3=CC=CC=C3 Z2887846551 [0,1,0,1,0,0|2,0,0]=4 212 B19R3.9171 O=C1CC(OC2=C1C=CC=C2)C3=CC=CC=C3 Z57085783 [0,1,0,1,0,0|2,0,0]=4 213 B19R3.1799922 OC(C1=CC=CC=C1)C2=NC3=C(N2)C=CC=C3 Z57841692 [0,1,0,1,0,0|1,0,1]=4 214 B19R3.3924 CC1=CC(=NC=C1)NCC2CC3=C2C=CC=C3 Z851792220 [0,1,0,1,0,0|1,0,0]=3 215 B15R2.2195 C1=CC=C(C=C1)/C=C/C2=NC=CC=C2 Z1528723632 [1,0,0,0,1,0|0,0,2]=4 216 B15R2.2195 C1=CC=C(C=C1)CNC2=CC=CC=C2 Z57750267 [1,0,0,0,1,0|1,0,0]=3 217 B15R2.2195 C1=CC=C(C=C1)CNC2=CC=NC=C2 Z359298544 [1,0,0,0,1,0|2,0,0]=4 218 B15R2.2195 C1=CC=C(C=C1)CNC2=NC=CC=C2 Z31196921 [1,0,0,0,1,0|0,0,0]=2 219 B15R2.2195 C1=CC=C(C=C1)CNC2=NC=CC=N2 Z31196922 [1,0,0,0,1,0|1,0,0]=3 220 B15R2.2195 C1=CC=C(C=C1)CNC2=NC=CN=C2 Z31197063 [1,0,0,0,1,0|1,0,0]=3 221 B15R2.2195 C1=CC=C(C=C1)COC2=CC=CC=C2 Z26347916 [1,0,0,0,1,0|2,0,0]=4 222 B15R2.2195 C1=CC=C(C=C1)COC2=NC=CC=C2 Z26331152 [1,0,0,0,1,0|1,0,0]=3 223 B15R2.2195 C1=CC=C(C=C1)CSC2=NC=CC=C2 Z31249467 [1,0,0,0,1,0|1,0,0]=3 224 B15R2.2195 C1=CC=C(C=C1)CSC2=NC=CC=N2 Z18380756 [1,0,0,0,1,0|2,0,0]=4 225 B15R2.2195 C1=CC=C(C=C1)NCC2=CC=NC=C2 Z1263875689 [1,0,0,0,1,0|2,0,0]=4 226 B15R2.2195 C1=CC=C(C=C1)NCC2=NC=CC=C2 Z1263825492 [1,0,0,0,1,0|1,0,0]=3 227 B15R2.2195 C1=CN=C(C=C1)CNC2=CN=CC=C2 Z334882462 [1,0,0,0,1,0|2,0,0]=4 228 B15R2.2195 C1=CN=C(C=C1)CNC2=NC=CC=C2 Z31215999 [1,0,0,0,1,0|1,0,0]=3 229 B15R2.2195 C1=CN=C(C=C1)CSC2=NC=CC=C2 Z291938344 [1,0,0,0,1,0|2,0,0]=4 230 B15R2.2195 C1=CN=C(C=C1)SCC2=CN=CC=C2 Z316276450 [1,0,0,0,1,0|2,0,0]=4 231 B15R2.2196 C1=CC=C(C=C1)CCNC2=CNN=C2 Z431547026 [1,0,0,0,1,0|2,0,0]=4 232 B15R2.2196 C1=CC=C(C=C1)CCNC2=NC=CS2 Z86230047 [1,0,0,0,1,0|1,0,0]=3 233 B15R2.2196 C1=CC=C(C=C1)CCNC2=NN=CS2 Z1201048096 [1,0,0,0,1,0|2,0,0]=4 234 B15R2.64 CC(NC1=NC=CC=C1)C2=CC=CO2 Z90165620 [0,0,0,0,2,0|2,0,0]=4 235 B15R2.1259 NC(CC1=NC=CN1)C2=CC=CC=C2 Z1525520820 [0,0,0,0,2,0|2,0,0]=4 236 B15R2.1259 NC(CN1C=CC=N1)C2=CC=CC=C2 Z271011600 [0,0,0,0,2,0|2,0,0]=4 237 B15R2.1259 OC(CN1C=NC=N1)C2=CC=CC=C2 Z600458316 [0,0,0,0,2,0|2,0,0]=4 238 B15R2.2226 NC(C1=CC=CC=C1)C2=CC=CC=C2 Z56753978 [0,0,0,0,2,0|2,0,0]=4 239 B15R2.2226 NC(C1=CC=CC=C1)C2=NC=CC=C2 Z57033964 [0,0,0,0,2,0|1,0,0]=3 240 B15R2.2226 O=C(C1=CC=CC=C1)C2=NC=CC=C2 Z104474012 [0,0,0,0,2,0|0,0,2]=4 241 B15R2.2226 OC(C1=CC=CC=C1)C2=CC=CC=C2 Z104478280 [0,0,0,0,2,0|1,0,0]=3 242 B15R2.2226 OC(C1=CC=CC=C1)C2=CC=NC=C2 Z228586152 [0,0,0,0,2,0|2,0,0]=4 243 B15R2.2226 OC(C1=CC=CC=C1)C2=CN=CC=C2 Z513749566 [0,0,0,0,2,0|2,0,0]=4 244 B15R2.2226 OC(C1=CC=CC=C1)C2=NC=CC=C2 Z56174562 [0,0,0,0,2,0|0,0,0]=2 245 B17R2.2382 C1=CC=C(C=C1)CCCNC2=CC=CC=C2 Z266463720 [1,0,0,0,0,1|1,0,0]=3 246 B17R2.2382 C1=CC=C(C=C1)CCNCC2=CC=CC=C2 Z57055797 [1,0,0,0,0,1|1,0,0]=3 247 B17R2.2382 C1=CC=C(C=C1)CCNCC2=CC=NC=C2 Z901309154 [1,0,0,0,0,1|2,0,0]=4 248 B17R2.2382 C1=CC=C(C=C1)CCNCC2=CN=CC=C2 Z57326587 [1,0,0,0,0,1|2,0,0]=4 249 B17R2.2382 C1=CC=C(C=C1)NCCNC2=CC=CC=C2 Z57493577 [1,0,0,0,0,1|1,0,0]=3 250 B17R2.2382 C1=CC=C(C=C1)NCCNC2=NC=CC=C2 Z1232674996 [1,0,0,0,0,1|0,0,0]=2 251 B17R2.2382 C1=CC=C(C=C1)OCCNC2=CC=NC=C2 Z838167080 [1,0,0,0,0,1|2,0,0]=4 252 B17R2.5714 OC(CNCC1=CC=CC=C1)C2=CC=CO2 Z369478542 [0,0,0,0,1,1|2,0,0]=4 253 B17R2.5714 OC(CNCC1=CC=CC=C1)C2=CC=CS2 Z355415028 [0,0,0,0,1,1|2,0,0]=4 254 B17R2.5714 OC(CNCC1=CC=CC=C1)C2=CSC=C2 Z1020686128 [0,0,0,0,1,1|2,0,0]=4 255 B19R2.16162 O=C(CNC1=NC=CC=C1)NCC2=CC=CC=C2 Z644802138 [0,0,0,0,0,2|0,0,2]=4 256 B19R2.16162 OC(CCC1=CC=CC=C1)CCC2=CC=CC=C2 Z815261698 [0,0,0,0,0,2|2,0,0]=4 257 B19R2.16162 OC(COC1=CC=CC=C1)COC2=CC=CC=C2 Z87002505 [0,0,0,0,0,2|2,0,0]=4 258 B19R2.8899 OC(CCNCC1=CC=CC=C1)C2=CC=CC=C2 Z2164844420 [0,0,0,0,0,2|1,0,0]=3