0 B16R2.35365 CC1=CC(=CC=C1)N2CC(OC2=O)CO Z1509617301 [0,0,0,0,0,0|0,0,0]=0 1 B15R2.334 CC1=CC=CC(=C1)N2N=C(CC2=O)C Z50146245 [1,0,0,0,0,0|2,0,1]=4 2 B15R2.1682 N#CC1CC(=O)N(C1)C2=CC=CC=C2 Z1198273045 [1,0,0,0,0,0|2,0,1]=4 3 B15R2.1682 NCC1CC(=O)N(C1)C2=CC=CC=C2 Z1198336443 [1,0,0,0,0,0|2,0,0]=3 4 B15R2.1682 O=C1CC(CN1C2=CC=CC=C2)CO Z1198184731 [1,0,0,0,0,0|1,0,0]=2 5 B15R2.1682 O=C1OC(CN1C2=CC=CC=C2)CCl Z1184908020 [1,0,0,0,0,0|1,0,0]=2 6 B15R2.1682 O=C1OC(CN1C2=CC=CC=C2)CO Z1255416042 [1,0,0,0,0,0|0,0,0]=1 7 B17R2.3374 CC1=CC(=CC=C1)N2CC(CC2=O)C(=O)O Z57472827 [0,1,0,0,0,0|1,0,1]=3 8 B17R2.3374 O=C(O)C1CC(=O)N(C1)C2=CC(=CC=C2)Br Z228589240 [0,1,0,0,0,0|2,0,1]=4 9 B17R2.3374 O=C(O)C1CC(=O)N(C1)C2=CC(=CC=C2)Cl Z57480192 [0,1,0,0,0,0|2,0,1]=4 10 B17R2.3374 O=C(O)C1CC(=O)N(C1)C2=CC(=CC=C2)F Z228588796 [0,1,0,0,0,0|2,0,1]=4 11 B15R1.982 C#CC(C)OC(=O)NC1=CC(=CC=C1)Cl Z1509740415 [0,0,1,0,0,0|2,0,1]=4 12 B15R1.982 CC(CO)NC(=O)NC1=CC(=CC=C1)Cl Z332430514 [0,0,1,0,0,0|2,0,0]=3 13 B15R1.982 CC(CO)NC(=O)NC1=CC(=CC=C1)I Z410003512 [0,0,1,0,0,0|2,0,0]=3 14 B15R1.982 CCC(C)NC(=O)NC1=CC(=CC=C1)Br Z409541820 [0,0,1,0,0,0|3,0,0]=4 15 B15R1.982 CCC(C)NC(=O)NC1=CC(=CC=C1)C Z44585043 [0,0,1,0,0,0|2,0,0]=3 16 B15R1.982 CCC(C)NC(=O)NC1=CC(=CC=C1)I Z410005854 [0,0,1,0,0,0|3,0,0]=4 17 B15R1.982 C[C@@H](CO)NC(=O)NC1=CC(=CN=C1)Cl Z2953014219 [0,0,1,0,0,0|3,0,0]=4 18 B14R1.34 CCCNC(=O)NC1=CC(=CC=C1)C Z44586517 [1,0,1,0,0,0|2,0,0]=4 19 B14R1.518 CCCC(C(=O)O)C1=CC(=CC=C1)Cl Z1269222848 [1,0,1,0,0,0|2,0,0]=4 20 B14R1.743 CC(CO)NC(=O)NC1=CC=CC=C1 Z332430536 [1,0,1,0,0,0|1,0,0]=3 21 B14R1.743 CCC(C)NC(=O)NC1=CC=CC=C1 Z44585021 [1,0,1,0,0,0|2,0,0]=4 22 B14R1.5978 CC(C)CC(=O)NC1=CC(=CC=C1)Br Z27789011 [1,0,1,0,0,0|2,0,0]=4 23 B14R1.5978 CC(C)NC(=O)NC1=CC(=CC=C1)Br Z335788296 [1,0,1,0,0,0|2,0,0]=4 24 B14R1.5978 CC(C)NC(=O)NC1=CC(=CC=C1)N Z335787350 [1,0,1,0,0,0|2,0,0]=4 25 B14R1.5978 CC1=CC(=NC=C1)NC(=O)CC(C)C Z71388635 [1,0,1,0,0,0|2,0,0]=4 26 B14R1.5978 CC1=CC=CC(=C1)NC(=O)NC(C)C Z44580903 [1,0,1,0,0,0|1,0,0]=3 27 B14R2.8 OCC1CCN(C1)C2=CC=CC=C2 Z1198175602 [2,0,0,0,0,0|1,0,1]=4 28 B14R2.269 NC1=CC(=CC=C1)N2CCCC2=O Z96092030 [2,0,0,0,0,0|2,0,0]=4 29 B14R2.269 NC1=CC(=CC=C1)N2CCNC2=O Z316122358 [2,0,0,0,0,0|2,0,0]=4 30 B14R2.269 NC1=CC(=CC=C1)N2CCOC2=O Z336028114 [2,0,0,0,0,0|1,0,0]=3 31 B14R2.269 O=C1CCCN1C2=CC=CC(=C2)Br Z55670892 [2,0,0,0,0,0|2,0,0]=4 32 B14R2.269 O=C1CCCN1C2=CC=CC(=C2)O Z104341508 [2,0,0,0,0,0|2,0,0]=4 33 B14R2.269 O=C1NCCN1C2=CC=CC(=C2)Br Z1269140071 [2,0,0,0,0,0|2,0,0]=4 34 B14R2.598 NC1CC(=O)N(C1)C2=CC=CC=C2 Z425867776 [2,0,0,0,0,0|2,0,0]=4 35 B16R1.62 COCCCC(=O)N(C)C1=NC(=CC=C1)C Z1229731059 [0,1,1,0,0,0|2,0,0]=4 36 B16R1.374 CC1=NC(=CC=C1)NC(=O)NC(C)(C)CO Z1665419786 [0,1,1,0,0,0|2,0,0]=4 37 B16R1.578 CCC(CO)NC(=O)NC1=CC(=CC=C1)C Z123852302 [0,1,1,0,0,0|1,0,0]=3 38 B16R1.578 CCC(CO)NC(=S)NC1=CC(=CC=C1)C Z45809713 [0,1,1,0,0,0|1,1,0]=4 39 B16R1.578 CC[C@H](CO)NC(=O)NC1=NC(=CC=C1)C Z1693415156 [0,1,1,0,0,0|2,0,0]=4 40 B16R1.956 COCC(C)NC(=O)NC1=CC(=CC=C1)Br Z409541564 [0,1,1,0,0,0|2,0,0]=4 41 B16R1.956 COCC(C)NC(=O)NC1=CC(=CC=C1)Cl Z44610109 [0,1,1,0,0,0|2,0,0]=4 42 B16R1.956 COCC(C)NC(=O)NC1=CC(=CC=C1)I Z410005598 [0,1,1,0,0,0|2,0,0]=4 43 B16R1.956 COCC(C)NC(=O)NC1=CC(=NC=C1)C Z1560489639 [0,1,1,0,0,0|2,0,0]=4 44 B16R1.956 COCC(C)NC(=O)NC1=NC(=CC=C1)C Z1665419658 [0,1,1,0,0,0|2,0,0]=4 45 B16R1.1173 CC(CO)NC(=O)NC1=C(C(=CC=C1)Cl)F Z410996576 [0,1,1,0,0,0|2,0,0]=4 46 B16R1.1173 CC1=NC=CC(=C1Cl)NC(=O)N[C@@H](C)CO Z1722903251 [0,1,1,0,0,0|2,0,0]=4 47 B16R1.1173 C[C@@H](CO)NC(=O)NC1=C(C(=CC=C1)Cl)Br Z1846850319 [0,1,1,0,0,0|2,0,0]=4 48 B16R1.17221 CC(CO)NC(=O)NC1=C(C=CC(=C1)Cl)Cl Z409614428 [0,1,1,0,0,0|2,0,0]=4 49 B16R1.17221 CC1=C(C=C(C=C1)F)NC(=O)NC(C)CO Z409945618 [0,1,1,0,0,0|2,0,0]=4 50 B16R1.17229 CC(CO)NC(=O)NC1=CC(=C(C=C1)Cl)F Z435795584 [0,1,1,0,0,0|2,0,0]=4 51 B16R1.17229 CC(CO)NC(=O)NC1=CC(=C(C=C1)F)Br Z1278490252 [0,1,1,0,0,0|2,0,0]=4 52 B16R1.17229 CC(CO)NC(=O)NC1=CC(=C(C=C1)F)Cl Z409928978 [0,1,1,0,0,0|2,0,0]=4 53 B16R1.17229 CC1=C(C=C(C=C1)NC(=O)NC(C)CO)Cl Z332430530 [0,1,1,0,0,0|2,0,0]=4 54 B16R1.17229 CC1=C(C=C(C=C1)NC(=O)NC(C)CO)F Z409974522 [0,1,1,0,0,0|2,0,0]=4 55 B16R1.17229 CC1=C(C=C(C=C1)NC(=O)NC(C)CO)I Z410737450 [0,1,1,0,0,0|2,0,0]=4 56 B16R1.17229 CC1=C(C=CC(=C1)NC(=O)N[C@H](C)CN)F Z2354985844 [0,1,1,0,0,0|2,0,0]=4 57 B16R1.17229 CC1=C(C=CC(=N1)NC(=O)N[C@@H](C)CO)Br Z1732375264 [0,1,1,0,0,0|2,0,0]=4 58 B16R1.19802 C#CC1=CC=CC(=C1)NC(=O)NC(C)CO Z412798430 [0,1,1,0,0,0|1,0,1]=4 59 B16R1.19802 CCC(C)NC(=O)NC1=CC(=CC=C1)OC Z236578766 [0,1,1,0,0,0|2,0,0]=4 60 B16R1.19802 CCC(C)NC(=O)NC1=CC(=CC=C1)SC Z409637630 [0,1,1,0,0,0|2,0,0]=4 61 B16R1.19802 COC1=CC(=CC=C1)NC(=O)NC(C)CO Z332430570 [0,1,1,0,0,0|1,0,0]=3 62 B16R1.19802 COC1=CC(=CC=C1)NC(=O)N[C@@H](C)CO Z1268431435 [0,1,1,0,0,0|1,0,0]=3 63 B16R1.19802 CSC1=CC(=CC=C1)NC(=O)NC(C)CO Z409635248 [0,1,1,0,0,0|1,0,0]=3 64 B16R2.2418 COC1=CC(=CC=C1)N2CC(CC2=O)N Z425867820 [1,1,0,0,0,0|2,0,0]=4 65 B16R2.80682 CC1=CC=CC(=C1)N2C(=O)SC(C2=O)C Z56777561 [1,1,0,0,0,0|0,1,1]=4 66 B16R2.2404 O=C1CC(CN1C2=CC=C(C=C2)Br)CO Z1209404008 [1,1,0,0,0,0|1,0,0]=3 67 B16R2.2404 O=C1OC(CN1C2=CC=C(C=C2)Br)CO Z1509526565 [1,1,0,0,0,0|0,0,0]=2 68 B16R2.2880 O=C(O)C1CC(=O)N(C1)C2=CC=CC=C2 Z57472940 [1,1,0,0,0,0|1,0,1]=4 69 B16R2.3806 CNCC1CN(C(=O)O1)C2=CC=CC=C2 Z2753802001 [1,1,0,0,0,0|1,0,0]=3 70 B18R2.65832 CC1=CC(=CC=C1)CN2CC(CC2=O)C(=O)O Z274780532 [0,1,0,0,0,1|1,0,1]=4 71 B18R2.2970 CCC1=CC(=CC=C1)N2CC(CC2=O)C(=O)O Z228588658 [0,2,0,0,0,0|1,0,1]=4 72 B18R2.2970 COC1=CC(=CC=C1)N2CC(CC2=O)C(=O)O Z57699751 [0,2,0,0,0,0|1,0,1]=4 73 B18R2.2970 CSC1=CC(=CC=C1)N2CC(CC2=O)C(=O)O Z56921457 [0,2,0,0,0,0|1,0,1]=4 74 B18R2.9102 CC1=C(C=C(C=C1)N2CC(CC2=O)C(=O)O)C Z56822182 [0,2,0,0,0,0|1,0,1]=4 75 B18R2.9102 CC1=C(C=CC(=C1)N2CC(CC2=O)C(=O)O)Br Z57464650 [0,2,0,0,0,0|1,0,1]=4 76 B18R2.9102 CC1=C(C=CC(=C1)N2CC(CC2=O)C(=O)O)F Z1021296414 [0,2,0,0,0,0|1,0,1]=4 77 B16R2.31971 O=C1SC2=C(N1CCCO)C=CC=C2F Z2442391806 [0,0,1,1,0,0|1,1,0]=4 78 B16R2.80695 CC1=CC(=CC=C1)C2(CCCC2)C(=O)O Z364000160 [0,0,1,1,0,0|2,0,0]=4 79 B16R2.80695 O=C(O)C1(CCCO1)C2=CC(=CC=C2)Br Z3581603656 [0,0,1,1,0,0|2,0,0]=4 80 B16R2.258 CC1=CC(=CC=C1)SCC2CNC(=O)O2 Z1172438165 [0,0,1,1,0,0|2,0,0]=4 81 B14R1.135 CCC(C)C(=O)NC1=CC(=CC=C1)F Z237762792 [0,0,1,0,1,0|2,0,0]=4 82 B14R1.135 CCC(C)C(=O)NC1=NC(=CC=C1)C Z237925568 [0,0,1,0,1,0|2,0,0]=4 83 B14R1.135 CCC(C)C(=O)NC1=NC=CC(=C1)C Z237924206 [0,0,1,0,1,0|2,0,0]=4 84 B16R1.1148 CC1=CC=CC(=N1)NC(=O)NCC(C)CO Z1693409611 [0,0,1,0,0,1|2,0,0]=4 85 B16R1.1148 CCC(C)NCC(=O)NC1=CC(=CC=C1)C Z56867142 [0,0,1,0,0,1|2,0,0]=4