0 B16R3.1795 C1=CC=C(C=C1)C2=NNC3=C2CCC3 Z2574928612 [0,0,0,0,0,0|1,0,3]=4 1 B16R3.1795 C1=CC=C(C=C1)C2CN=C3N2CCN3 Z1198155423 [0,0,0,0,0,0|2,0,2]=4 2 B16R3.1795 C1=CC=C(C=C1)C2CNC3C2CCC3 Z1198183948 [0,0,0,0,0,0|0,0,0]=0 3 B16R3.1795 C1=CC=C(C=C1)N2CC[C@@H]3[C@H]2CNC3 Z2309898839 [0,0,0,0,0,0|3,0,0]=3 4 B17R3.108 CN1CC2CNCC2C1C3=CC=CC=C3 Z1259341148 [0,1,0,0,0,0|3,0,0]=4 5 B15R2.118 FCC1CCCN1CC2=CC=CC=C2 Z2219754770 [0,0,1,0,0,0|3,0,0]=4 6 B15R2.118 N#CC1CCCN1CC2=CC=CC=C2 Z1227729368 [0,0,1,0,0,0|3,0,0]=4 7 B15R2.118 NCC1CCCN1CC2=CC=CC=C2 Z326202540 [0,0,1,0,0,0|3,0,0]=4 8 B15R2.118 NC[C@H]1CCCN1CC2=CC=CC=C2 Z2863514519 [0,0,1,0,0,0|3,0,0]=4 9 B15R2.118 OCC1CCCN1CC2=CC=CC=C2 Z905473380 [0,0,1,0,0,0|3,0,0]=4 10 B15R2.131 CCC(C1=CC=CC=C1)C2CCCN2 Z1262246222 [0,0,1,0,0,0|2,0,0]=3 11 B15R2.131 N#CC(C1=CC=CC=C1)C2CCCN2 Z1318147507 [0,0,1,0,0,0|1,0,2]=4 12 B15R2.131 NCC(C1=CC=CC=C1)C2CCCC2 Z4919336657 [0,0,1,0,0,0|0,0,0]=1 13 B15R2.131 NCC(C1=CN=CC=C1)N2CCCC2 Z270833556 [0,0,1,0,0,0|2,0,0]=3 14 B15R2.131 O=CC(C1=CC=CC=C1)C2CCCC2 Z1255391904 [0,0,1,0,0,0|1,0,1]=3 15 B15R2.2169 C1=CC=C(C=C1)C2CCCCCCN2 Z3158829931 [0,0,1,0,0,0|2,0,0]=3 16 B15R2.2196 C1=CC=C(C=C1)CCCC2CCCN2 Z361890872 [0,0,1,0,0,0|2,0,0]=3 17 B15R2.2196 C1=CC=C(C=C1)CCNC2=NCCS2 Z56896214 [0,0,1,0,0,0|2,0,1]=4 18 B15R2.2196 C1=CC=C(C=C1)CCNC2CCCC2 Z90668408 [0,0,1,0,0,0|0,0,0]=1 19 B15R2.2196 C1=CC=C(C=C1)CCNC2CCOC2 Z1359881855 [0,0,1,0,0,0|1,0,0]=2 20 B15R2.2196 C1=CC=C(C=C1)CCNC2CCSC2 Z90661350 [0,0,1,0,0,0|1,0,0]=2 21 B15R2.2196 C1=CC=C(C=C1)CNCC2CCCC2 Z823603144 [0,0,1,0,0,0|2,0,0]=3 22 B15R2.2196 C1=CC=C(C=C1)CNCC2CCCO2 Z57326938 [0,0,1,0,0,0|3,0,0]=4 23 B15R2.2196 C1=CC=C(C=C1)COCC2CCNC2 Z976732876 [0,0,1,0,0,0|3,0,0]=4 24 B15R2.2196 C1=CC=C(C=C1)NCCN2CCCC2 Z594267412 [0,0,1,0,0,0|3,0,0]=4 25 B15R3.1722 C1=CC=C(C=C1)[C@H]2C[C@H]3[C@@H]2CNC3 Z2685356822 [0,0,0,0,1,0|1,0,0]=2 26 B17R3.8 C1=CC=C(C=C1)C2CNC3C2CCCC3 Z1510172353 [0,0,0,0,0,1|0,0,0]=1 27 B17R3.8 C1=CN=C(C=C1)N2CCC3C2CCCC3 Z1359502913 [0,0,0,0,0,1|3,0,0]=4 28 B17R3.8759 C1=CC=C(C=C1)CN2CC[C@@H]3[C@H]2CNC3 Z291279246 [0,0,0,0,0,1|3,0,0]=4 29 B14R2.8 NCC1CCC(C1)C2=CC=CC=C2 Z2216314446 [1,0,1,0,0,0|2,0,0]=4 30 B14R2.8 OC[C@@H]1CC[C@H](C1)C2=CC=CC=C2 Z2262019790 [1,0,1,0,0,0|2,0,0]=4 31 B14R2.14 CNC1CCCC1C2=CC=CC=C2 Z993062846 [1,0,1,0,0,0|2,0,0]=4 32 B14R2.14 N#C[C@@H]1CNC[C@H]1C2=CC=CC=C2 Z2193456749 [1,0,1,0,0,0|1,0,1]=4 33 B14R2.14 NCC1CCCC1C2=CC=CC=C2 Z2235409216 [1,0,1,0,0,0|2,0,0]=4 34 B14R2.14 OC[C@@H]1CNC[C@H]1C2=CC=CC=C2 Z3626609917 [1,0,1,0,0,0|1,0,0]=3 35 B14R2.30 CC1NCCC1CC2=CC=CC=C2 Z979422196 [1,0,1,0,0,0|1,0,0]=3 36 B14R2.30 NC1CCCC1CC2=CC=CC=C2 Z813018506 [1,0,1,0,0,0|0,0,0]=2 37 B14R2.30 NC1CCCC1CC2=NC=CC=C2 Z1266872121 [1,0,1,0,0,0|1,0,0]=3 38 B14R2.30 NC1CCCC1OC2=CC=CC=C2 Z1267773743 [1,0,1,0,0,0|1,0,0]=3 39 B14R2.30 N[C@@H]1CCC[C@@H]1OC2=CC=CC=C2 Z4745339387 [1,0,1,0,0,0|1,0,0]=3 40 B14R2.30 N[C@@H]1COC[C@@H]1OC2=CC=CC=C2 Z4021078344 [1,0,1,0,0,0|2,0,0]=4 41 B14R2.30 O=C1CCCC1CC2=CC=CC=C2 Z813018324 [1,0,1,0,0,0|1,0,1]=4 42 B14R2.30 OC1CCCC1CC2=CC=CC=C2 Z854048260 [1,0,1,0,0,0|1,0,0]=3 43 B14R2.30 O[C@@H]1CCN[C@@H]1CC2=CC=CC=C2 Z4966451600 [1,0,1,0,0,0|2,0,0]=4 44 B14R2.30 O[C@@H]1CNC[C@H]1CC2=CC=CC=C2 Z2568680766 [1,0,1,0,0,0|2,0,0]=4 45 B14R2.114 NC(C1=CC=CC=C1)C2CCCC2 Z451452470 [1,0,1,0,0,0|0,0,0]=2 46 B14R2.114 NC(C1=CN=CC=C1)C2CCCO2 Z4990165979 [1,0,1,0,0,0|2,0,0]=4 47 B14R2.114 NC(C1=NC=CC=C1)C2CCCC2 Z513795930 [1,0,1,0,0,0|1,0,0]=3 48 B14R2.114 NC(C1=NC=CC=N1)C2CCCC2 Z513798398 [1,0,1,0,0,0|2,0,0]=4 49 B14R2.114 O=C(C1=CC=CC=C1)C2CCCC2 Z385417086 [1,0,1,0,0,0|1,0,1]=4 50 B14R2.114 OC(C1=CC=CC=C1)C2CCCC2 Z513750534 [1,0,1,0,0,0|1,0,0]=3 51 B14R2.114 OC(C1=CC=CC=C1)C2CCCN2 Z1192039732 [1,0,1,0,0,0|2,0,0]=4 52 B16R2.150 COCCN1CCC(C1)C2=CC=CC=C2 Z940689684 [0,1,1,0,0,0|2,0,0]=4 53 B16R2.150 OCCCN1CCC(C1)C2=CC=CC=C2 Z940690206 [0,1,1,0,0,0|2,0,0]=4 54 B16R2.148 COC(=O)[C@@H]1CNC[C@H]1C2=CC=CC=C2 Z2306853827 [0,1,1,0,0,0|1,0,1]=4 55 B16R2.161 CC(=O)N[C@@H]1CNC[C@H]1C2=CC=CC=C2 Z2826732571 [0,1,1,0,0,0|1,0,1]=4 56 B16R2.464 CC(=O)N1CCCC1CC2=CC=CC=C2 Z254699572 [0,1,1,0,0,0|2,0,0]=4 57 B16R2.464 O=C(O)C1CCCC1CC2=CC=CC=C2 Z1434224338 [0,1,1,0,0,0|2,0,0]=4 58 B16R2.100 CCNC(C1=CC=CC=C1)C2CCOC2 Z802554322 [0,1,1,0,0,0|2,0,0]=4 59 B16R2.100 N#CCN(C1=CC=CC=C1)C2CCCC2 Z1159295926 [0,1,1,0,0,0|1,0,1]=4 60 B16R2.519 CC(N)C(C1=CC=CC=C1)N2CCCC2 Z237731692 [0,1,1,0,0,0|1,0,0]=3 61 B16R2.519 NC(=O)C(C1=CC=CC=C1)N2CCCC2 Z224202980 [0,1,1,0,0,0|1,0,1]=4 62 B16R2.2222 NCC(C1=CC(=CC=C1)Cl)N2CCCC2 Z228570974 [0,1,1,0,0,0|1,0,0]=3 63 B16R2.2222 NCC(C1=CC(=CC=C1)O)N2CCCC2 Z247613684 [0,1,1,0,0,0|1,0,0]=3 64 B16R2.5483 NCC(C1=C(C=CC=C1)Cl)N2CCCC2 Z57039604 [0,1,1,0,0,0|1,0,0]=3 65 B16R2.135 FC1=CC=C(C=C1)CCNC2CCCC2 Z1695709447 [0,1,1,0,0,0|0,0,0]=2 66 B16R2.255 FC1=CC(=CC=C1)CCNC2CCCC2 Z1695729003 [0,1,1,0,0,0|0,0,0]=2 67 B16R2.524 O=C(NC1=CC=CC=C1)NC2CCCC2 Z44603921 [0,1,1,0,0,0|1,0,1]=4 68 B16R2.2238 CC(NCC1=CC=CC=C1)C2CCCC2 Z993953816 [0,1,1,0,0,0|2,0,0]=4 69 B16R2.2238 O=C(CCC1=CC=CC=C1)N2CCCC2 Z31480282 [0,1,1,0,0,0|2,0,0]=4 70 B16R2.2959 FC1=C(C=CC=C1)CCNC2CCCC2 Z90624295 [0,1,1,0,0,0|0,0,0]=2 71 B16R2.2959 FC1=C(C=CC=C1)CCNC2CCOC2 Z1124552896 [0,1,1,0,0,0|1,0,0]=3 72 B16R2.5767 NC(CCC1CCCC1)C2=CN=CC=C2 Z5098612873 [0,1,1,0,0,0|2,0,0]=4 73 B16R2.5767 O=C(CSC1CCCC1)C2=CC=CC=C2 Z54623519 [0,1,1,0,0,0|1,0,1]=4 74 B16R2.5767 OC(CNC1CCCC1)C2=CC=CC=C2 Z56966209 [0,1,1,0,0,0|0,0,0]=2 75 B16R2.14780 OC1(CCCC1)CNCC2=CC=CC=C2 Z1020686188 [0,1,1,0,0,0|2,0,0]=4 76 B18R3.4213 N[C@@H]1CC[C@@H]2[C@H]1N(CC2)CC3=CC=CC=C3 Z3305160872 [0,1,0,0,0,1|2,0,0]=4 77 B14R1.121 CCCCNC(CC)C1=CC=CC=C1 Z334909176 [0,0,2,0,0,0|2,0,0]=4 78 B14R1.520 CCCC(=O)NCCC1=CC=CC=C1 Z27761591 [0,0,2,0,0,0|1,0,1]=4 79 B14R1.123 CCCCCCCCC1=CC=CC=C1 Z199507044 [0,0,2,0,0,0|1,0,0]=3 80 B14R1.123 COCCCCNCC1=CC=CC=C1 Z815275494 [0,0,2,0,0,0|2,0,0]=4 81 B14R1.123 COCCNCCCC1=CC=CC=C1 Z90501904 [0,0,2,0,0,0|2,0,0]=4 82 B14R1.123 NCCCCOCCC1=CC=CC=C1 Z362798806 [0,0,2,0,0,0|2,0,0]=4 83 B14R1.494 CCNC(COC)CC1=CC=CC=C1 Z825742464 [0,0,2,0,0,0|2,0,0]=4 84 B14R1.391 CCN(CC)C(CN)C1=CC=CC=C1 Z56347584 [0,0,2,0,0,0|1,0,0]=3 85 B16R3.1786 C1=CC=C(C=C1)C2CNCC23CCC3 Z2301534484 [0,0,1,1,0,0|0,0,0]=2 86 B16R3.5981 C1=CC=C(C=C1)C2NCC23CCCC3 Z1999526334 [0,0,1,1,0,0|2,0,0]=4 87 B16R3.1783 C1=CC=C(C=C1)[C@H]2C[C@H]3[C@@H]2CNCC3 Z3018294185 [0,0,1,1,0,0|2,0,0]=4 88 B16R3.5983 C1=CC=C(C=C1)C23CCCCC2CN3 Z1407619616 [0,0,1,1,0,0|2,0,0]=4 89 B16R3.1811 C1=CC2=C(C=C1)C3(CCC2)CCNC3 Z3241266755 [0,0,1,1,0,0|2,0,0]=4 90 B16R3.1811 C1=CC2=C(C=C1)C3(CCCC3)CNC2 Z2188171678 [0,0,1,1,0,0|2,0,0]=4 91 B14R2.2850 NCC(C1=CC=CC=C1)C2CCC2 Z4868599254 [0,0,1,0,1,0|0,0,0]=2 92 B14R2.2850 O=CC(C1=CC=CC=C1)C2CCC2 Z1255403723 [0,0,1,0,1,0|1,0,1]=4 93 B14R2.1253 C1=CC(=CC=N1)C2CCCCCN2 Z409355870 [0,0,1,0,1,0|1,0,0]=3 94 B14R2.1253 C1=CC(=CC=N1)C2CCCNCC2 Z2824348675 [0,0,1,0,1,0|2,0,0]=4 95 B14R2.1253 C1=CC=C(C=C1)C2CCCCCN2 Z1258578207 [0,0,1,0,1,0|0,0,0]=2 96 B14R2.1253 C1=CC=C(C=C1)C2CCCCNC2 Z2310707785 [0,0,1,0,1,0|0,0,0]=2 97 B14R2.1253 C1=CC=C(C=C1)C2CCCNCC2 Z425362306 [0,0,1,0,1,0|1,0,0]=3 98 B14R2.1253 C1=CC=C(C=C1)C2CCNCCO2 Z3038387390 [0,0,1,0,1,0|2,0,0]=4 99 B14R2.1253 C1=CC=C(C=C1)C2CNCCCO2 Z425722882 [0,0,1,0,1,0|1,0,0]=3 100 B14R2.1253 C1=CC=C(C=C1)N2CCCNCC2 Z276113542 [0,0,1,0,1,0|2,0,0]=4 101 B14R2.101 C1=CC(=CC=N1)CCN2CCCC2 Z53116267 [0,0,1,0,1,0|2,0,0]=4 102 B14R2.101 C1=CC(=CN=C1)CNC2CCCC2 Z927583008 [0,0,1,0,1,0|1,0,0]=3 103 B14R2.101 C1=CC=C(C=C1)CCC2CCCN2 Z281773822 [0,0,1,0,1,0|1,0,0]=3 104 B14R2.101 C1=CC=C(C=C1)CCC2CCNC2 Z1201621459 [0,0,1,0,1,0|1,0,0]=3 105 B14R2.101 C1=CC=C(C=C1)CNC2CCCC2 Z90661352 [0,0,1,0,1,0|0,0,0]=2 106 B14R2.101 C1=CC=C(C=C1)CNC2CCNC2 Z1255502479 [0,0,1,0,1,0|1,0,0]=3 107 B14R2.101 C1=CC=C(C=C1)CNC2CCOC2 Z1124552713 [0,0,1,0,1,0|1,0,0]=3 108 B14R2.101 C1=CC=C(C=C1)OCC2CCCN2 Z285198378 [0,0,1,0,1,0|2,0,0]=4 109 B14R2.101 C1=CC=C(C=C1)OCC2CCNC2 Z1626921344 [0,0,1,0,1,0|2,0,0]=4 110 B14R2.101 C1=CC=C(C=C1)OC[C@@H]2CCCN2 Z2235330295 [0,0,1,0,1,0|2,0,0]=4 111 B14R2.322 C1=CSC(=C1)CCNC2CCOC2 Z1124553016 [0,0,1,0,1,0|2,0,0]=4 112 B14R2.3019 C1=CC=C(C=C1)CNCC2CCC2 Z57205555 [0,0,1,0,1,0|2,0,0]=4 113 B14R3.44 C1=CC=C(C=C1)[C@H]2NC[C@@H]3[C@H]2C3 Z3869460248 [0,0,0,0,2,0|2,0,0]=4 114 B16R2.94 CCCN1CCOC(C1)C2=CC=CC=C2 Z432852174 [0,0,1,0,0,1|2,0,0]=4 115 B16R2.23 CNC1CCCN(C1)CC2=CC=CC=C2 Z381431756 [0,0,1,0,0,1|1,0,0]=3 116 B16R2.172 CCC1CNCCN1CC2=CC=CC=C2 Z1142613561 [0,0,1,0,0,1|2,0,0]=4 117 B16R2.101 CCN(CC1=CC=CC=C1)C2CCCC2 Z433791362 [0,0,1,0,0,1|2,0,0]=4 118 B16R2.101 NCC(NC1=NC=CN=C1)C2CCCC2 Z1872600856 [0,0,1,0,0,1|2,0,0]=4 119 B16R2.187 CCC(C1=CC=CC=C1)N2CCNCC2 Z733976096 [0,0,1,0,0,1|2,0,0]=4 120 B16R2.187 CCC(C1=CC=CC=C1)N2CCSCC2 Z954567826 [0,0,1,0,0,1|2,0,0]=4 121 B16R2.187 N#CC(C1=CC=CC=C1)C2CCCCN2 Z1258924637 [0,0,1,0,0,1|0,0,2]=4 122 B16R2.187 N#CC(C1=CC=CC=C1)C2CCNCC2 Z3301412418 [0,0,1,0,0,1|0,0,2]=4 123 B16R2.187 NCC(C1=CC=CC=C1)N2CCOCC2 Z285151724 [0,0,1,0,0,1|1,0,0]=3 124 B16R2.187 NCC(C1=CN=CC=C1)N2CCOCC2 Z119989394 [0,0,1,0,0,1|2,0,0]=4 125 B16R2.236 CC(C1=CC=CC=C1)N2CCCC(C2)O Z103738554 [0,0,1,0,0,1|2,0,0]=4 126 B16R2.2256 C1=CC(=CC=N1)CCSC2CCOCC2 Z1517567652 [0,0,1,0,0,1|2,0,0]=4 127 B16R2.2256 C1=CC=C(C=C1)CCCC2CCCCN2 Z1495385227 [0,0,1,0,0,1|1,0,0]=3 128 B16R2.2256 C1=CC=C(C=C1)CCCC2CCCNC2 Z969111020 [0,0,1,0,0,1|1,0,0]=3 129 B16R2.2256 C1=CC=C(C=C1)CCCN2CCOCC2 Z137787200 [0,0,1,0,0,1|2,0,0]=4 130 B16R2.2256 C1=CC=C(C=C1)CCNC2=NCCCS2 Z56844961 [0,0,1,0,0,1|1,0,1]=4 131 B16R2.2256 C1=CC=C(C=C1)CCNC2CCCCC2 Z90503481 [0,0,1,0,0,1|0,0,0]=2 132 B16R2.2256 C1=CC=C(C=C1)CCOC2CCNCC2 Z362803146 [0,0,1,0,0,1|1,0,0]=3 133 B16R2.2256 C1=CC=C(C=C1)CNCC2CCCCC2 Z57396936 [0,0,1,0,0,1|2,0,0]=4 134 B16R2.2256 C1=CC=C(C=C1)CNCC2CCOCC2 Z800333610 [0,0,1,0,0,1|2,0,0]=4 135 B16R2.2257 C1=CC=C(C=C1)CCCOC2CCNC2 Z1374884582 [0,0,1,0,0,1|2,0,0]=4 136 B16R2.2257 C1=CC=C(C=C1)CNCCC2CCCC2 Z323387900 [0,0,1,0,0,1|1,0,0]=3 137 B16R2.2257 C1=CC=C(C=C1)CNCCN2CCCC2 Z86205465 [0,0,1,0,0,1|2,0,0]=4 138 B16R2.2257 C1=CC=C(C=C1)OCCNC2CCOC2 Z1124554614 [0,0,1,0,0,1|1,0,0]=3 139 B16R2.2257 C1=CC=C(C=C1)SCCNC2CCCC2 Z90638706 [0,0,1,0,0,1|0,0,0]=2