0 B18R3.11 C(c1c[s][n][n]1)N2CCOc3ccccc23 Amb24256096 [0,0,0,0,0,0|3,0,0]=3 1 B18R3.11 C(c1cc[nH][n]1)N2CCOc3ccccc23 Amb24272214 [0,0,0,0,0,0|3,0,0]=3 2 B18R3.11 C(c1ccc[s]1)N2CCNc3ccccc23 Amb22585682 [0,0,0,0,0,0|3,0,0]=3 3 B18R3.11 C(c1ccco1)N2CCNc3ccccc23 Amb22585644 [0,0,0,0,0,0|3,0,0]=3 4 B18R3.11 C1CC[C@@H](Nc2c[nH][n]c2)c3ccccc31 Amb24182137 [0,0,0,0,0,0|4,0,0]=4 5 B18R3.11 C1NCCC1CN2CCCc3ccccc23 Amb21958059 [0,0,0,0,0,0|1,0,3]=4 6 B18R3.11 c1ccc2c(c1)C(NCC2)Cc3nccs3 Amb17193965 [0,0,0,0,0,0|4,0,0]=4 7 B19R3.83 C[n]1cc(CN2CCNc3ccccc23)c[n]1 Amb23944833 [0,1,0,0,0,0|3,0,0]=4 8 B19R3.83 Cc1[n]c(CN2CCNc3ccccc23)c[s]1 Amb24790594 [0,1,0,0,0,0|2,0,0]=3 9 B19R3.83 Cc1cc(CN2CCCc3ccccc23)[n]o1 Amb20750294 [0,1,0,0,0,0|2,0,0]=3 10 B19R3.83 Cc1noc(n1)CN2CCOc3c2cccc3 Amb10720732 [0,1,0,0,0,0|2,0,1]=4 11 B19R3.83 Clc1ncc(s1)CN2CCCc3c2cccc3 Amb2438500 [0,1,0,0,0,0|1,0,1]=3 12 B19R3.83 Nc1nnc(s1)CN2CCCc3c2cccc3 Amb17209824 [0,1,0,0,0,0|2,0,1]=4 13 B19R3.163 Brc1cc[s]c1CN2CCNc3ccccc23 Amb23937728 [0,1,0,0,0,0|3,0,0]=4 14 B19R3.163 C[n]1[n]c[n]c1CN2CCNc3ccccc23 Amb24790001 [0,1,0,0,0,0|2,0,1]=4 15 B19R3.4206 Fc1cc2OCCN(Cc3c[n]c[s]3)c2cc1 Amb24293491 [0,1,0,0,0,0|2,0,1]=4 16 B19R3.10080 CC1COc2ccccc2N1Cc3[n]cc[s]3 Amb24295241 [0,1,0,0,0,0|3,0,0]=4 17 B19R3.10080 O=C1CSc2ccccc2N1Cc3c[s]c[n]3 Amb22311488 [0,1,0,0,0,0|2,0,1]=4 18 B19R3.22126 O=C(N1CCCc2ccccc12)C3=CN=S=N3 Amb17950857 [0,1,0,0,0,0|1,0,2]=4 19 B19R3.150358 Clc1cccc2c1OCCN2Cc3[nH]cc[n]3 Amb22164051 [0,1,0,0,0,0|3,0,0]=4 20 B19R3.150358 Nc1cccc2c1CCCN2Cc3c[s]c[n]3 Amb24787519 [0,1,0,0,0,0|1,0,0]=2 21 B19R3.150358 Nc1cccc2c1CCCN2Cc3c[s]cc3 Amb24787520 [0,1,0,0,0,0|2,0,0]=3 22 B19R3.150358 Nc1cccc2c1CCCN2Cc3ccc[s]3 Amb24787521 [0,1,0,0,0,0|2,0,0]=3 23 B19R3.150358 Nc1cccc2c1CCCN2Cc3cco[n]3 Amb25493033 [0,1,0,0,0,0|2,0,0]=3 24 B19R3.167539 CN1CCN(Cc2c[n]c[s]2)c3ccccc13 Amb24250201 [0,1,0,0,0,0|2,0,1]=4 25 B19R3.167539 CN1CCN(Cc2c[s][n][n]2)c3ccccc13 Amb24187835 [0,1,0,0,0,0|3,0,0]=4 26 B19R3.2199323 OC1(Cc2ccc[s]2)CCCc3ccccc13 Amb23997519 [0,1,0,0,0,0|3,0,0]=4 27 B17R2.2192 OCCN(Cc1c[s][n][n]1)c2ccccc2 Amb24216314 [0,0,1,0,0,0|3,0,0]=4 28 B17R2.2192 OCCN(Cc1cc[nH][n]1)c2ccccc2 Amb24232094 [0,0,1,0,0,0|3,0,0]=4 29 B17R2.2383 C(NCCCc1ccccc1)c2[nH]cc[n]2 Amb25393495 [0,0,1,0,0,0|2,0,0]=3 30 B17R2.2383 C(NCCCc1ccccc1)c2c[n]c[s]2 Amb24778828 [0,0,1,0,0,0|1,0,1]=3 31 B17R2.2383 C(NCCNc1ccccc1)c2ccc[s]2 Amb20139123 [0,0,1,0,0,0|3,0,0]=4 32 B17R2.2383 C(NCCNc1ccccc1)c2ccco2 Amb20139114 [0,0,1,0,0,0|3,0,0]=4 33 B17R2.2383 C(NCCOc1ccccc1)c2[nH]cc[n]2 Amb25393797 [0,0,1,0,0,0|3,0,0]=4 34 B17R2.2383 C(NCCOc1ccccc1)c2c[n]c[s]2 Amb24778829 [0,0,1,0,0,0|2,0,1]=4 35 B17R2.2383 C(NCCOc1ccccc1)c2c[s]c[n]2 Amb25393795 [0,0,1,0,0,0|2,0,0]=3 36 B17R2.2383 C(NCCOc1ccccc1)c2cc[nH][n]2 Amb25393805 [0,0,1,0,0,0|3,0,0]=4 37 B17R2.2383 C(NCCSc1ccccc1)c2[nH]cc[n]2 Amb25393491 [0,0,1,0,0,0|3,0,0]=4 38 B17R2.2383 C(NCCSc1ccccc1)c2c[n]c[s]2 Amb24778821 [0,0,1,0,0,0|2,0,1]=4 39 B17R2.2383 C(NCc1ccco1)COc2ccccc2 Amb17141014 [0,0,1,0,0,0|3,0,0]=4 40 B17R2.2383 C(NCc1cccs1)COc2ccccc2 Amb17157582 [0,0,1,0,0,0|3,0,0]=4 41 B17R2.2383 C(NCc1cccs1)COc2ccccc2 Amb17619247 [0,0,1,0,0,0|3,0,0]=4 42 B17R2.2383 C(OCCCc1c[nH]c[n]1)c2ccccc2 Amb25857393 [0,0,1,0,0,0|2,0,0]=3 43 B19R3.28 C(C1CCNc2ccccc21)c3c[n]cc[n]3 Amb23976527 [0,0,0,0,0,1|2,0,1]=4 44 B19R3.28 C(c1cc[n]cc1)N2CCNc3ccccc23 Amb22585680 [0,0,0,0,0,1|2,0,1]=4 45 B19R3.28 C(c1ccc[n]c1)N2CCNc3ccccc23 Amb22585678 [0,0,0,0,0,1|2,0,0]=3 46 B19R3.28 C(c1cccc[n]1)N2CCNc3ccccc23 Amb22585676 [0,0,0,0,0,1|2,0,0]=3 47 B19R3.28 C(c1ccccc1)N2CCNc3ccccc23 Amb24064488 [0,0,0,0,0,1|3,0,0]=4 48 B19R3.28 C1CCC(Nc2cccc[n]2)c3ccccc31 Amb24077930 [0,0,0,0,0,1|3,0,0]=4 49 B19R3.28 c1ccc(cc1)CC2CCCc3c2cccc3 Amb10559824 [0,0,0,0,0,1|3,0,0]=4 50 B19R3.28 c1ccc(cc1)CN2CCNc3c2cccc3 Amb2383684 [0,0,0,0,0,1|3,0,0]=4 51 B19R3.28 c1ccc(cc1)CN2CCOc3c2cccc3 Amb10845505 [0,0,0,0,0,1|3,0,0]=4 52 B19R3.4444 C(NC1CCCc2ccccc21)c3c[n]c[s]3 Amb25403491 [0,0,0,0,0,1|2,0,1]=4 53 B19R3.4444 C(NC1CCCc2ccccc21)c3cco[n]3 Amb24033739 [0,0,0,0,0,1|3,0,0]=4 54 B19R3.4444 C(NC1CCOc2ccccc21)c3c[s]c[n]3 Amb24788938 [0,0,0,0,0,1|3,0,0]=4 55 B19R3.4444 C(NC1CCOc2ccccc21)c3cc[nH]c3 Amb24024459 [0,0,0,0,0,1|3,0,0]=4 56 B19R3.4444 C(NC1CCSc2ccccc21)c3c[s]c[n]3 Amb24788941 [0,0,0,0,0,1|3,0,0]=4 57 B19R3.19198 C(c1c[s]cc1)N2CCNCc3ccccc23 Amb25404450 [0,0,0,0,0,1|2,0,0]=3 58 B19R3.19198 C1NCCN(Cc2c[s]c[n]2)c3ccccc31 Amb25404449 [0,0,0,0,0,1|1,0,0]=2 59 B19R3.19198 C1NCCN(Cc2ccc[s]2)c3ccccc31 Amb25404447 [0,0,0,0,0,1|2,0,0]=3 60 B16R2.685 CCN(Cc1cc[nH][n]1)c2ccccc2 Amb24217105 [1,0,1,0,0,0|2,0,0]=4 61 B16R2.1480 COc1ccccc1NCc2c[s]c[n]2 Amb19422431 [1,0,1,0,0,0|2,0,0]=4 62 B16R2.50359 ClC\C=C\CN1CCCc2ccccc12 Amb24444923 [1,0,1,0,0,0|1,0,1]=4 63 B16R2.170412 C=C(CCl)CN1CCCc2ccccc12 Amb25839041 [1,0,1,0,0,0|1,0,1]=4 64 B16R2.170412 CNC(=O)CN1CCCc2ccccc12 Amb19969576 [1,0,1,0,0,0|1,0,1]=4 65 B16R2.170412 NNC(=O)CN1CCCc2c1cccc2 Amb1104572 [1,0,1,0,0,0|1,0,1]=4 66 B18R2.360 OCCN(Cc1c[s]c[n]1)c2ccc(Br)cc2 Amb24227469 [0,1,1,0,0,0|2,0,0]=4 67 B18R2.2106 CCCN(Cc1c[s]cc1)c2cccc(N)c2 Amb23963620 [0,1,1,0,0,0|2,0,0]=4 68 B18R2.2106 CCCN(Cc1ccc[s]1)c2cccc(N)c2 Amb23963626 [0,1,1,0,0,0|2,0,0]=4 69 B18R2.14623 OCCCN(Cc1ccco1)c2ccccc2 Amb19359470 [0,1,1,0,0,0|2,0,0]=4 70 B18R2.125434 CCCN(Cc1c[s]cc1)c2ccccc2N Amb23963656 [0,1,1,0,0,0|2,0,0]=4 71 B18R2.3701 Cc1csc(n1)CNCCCc2ccccc2 Amb17350710 [0,1,1,0,0,0|2,0,0]=4 72 B18R2.3899 Clc1cc(CCCNCc2ccco2)ccc1 Amb25515226 [0,1,1,0,0,0|2,0,0]=4 73 B18R2.3995 Clc1ccccc1CCCNCc2ccc[s]2 Amb19963093 [0,1,1,0,0,0|2,0,0]=4 74 B18R2.3995 Clc1ccccc1CCCNCc2ccco2 Amb20172651 [0,1,1,0,0,0|2,0,0]=4 75 B18R2.4091 Brc1cc[s]c1CNCCCc2ccccc2 Amb23937671 [0,1,1,0,0,0|2,0,0]=4 76 B18R2.4091 Brc1ccoc1CNCCCc2ccccc2 Amb23984960 [0,1,1,0,0,0|2,0,0]=4 77 B18R2.4091 C[n]1cccc1CNCCCc2ccccc2 Amb24113700 [0,1,1,0,0,0|1,0,1]=4 78 B18R2.4091 Cc1n[nH]cc1CNCCCc2ccccc2 Amb10646276 [0,1,1,0,0,0|2,0,0]=4 79 B18R2.7188 CC(NCCCc1ccccc1)c2[n][nH][n][n]2 Amb23940212 [0,1,1,0,0,0|2,0,0]=4 80 B18R2.7188 O=C(NCCCc1ccccc1)c2c[nH]cc2 Amb19502812 [0,1,1,0,0,0|1,0,1]=4 81 B18R2.8990 Brc1ccc(cc1)COCCCc2c[nH]cn2 Amb10605388 [0,1,1,0,0,0|2,0,0]=4 82 B18R2.8990 Brc1ccc(cc1)OCCNCc2c[s]c[n]2 Amb25514987 [0,1,1,0,0,0|2,0,0]=4 83 B18R2.8990 Cc1ccc(CCCNCc2ccc[s]2)cc1 Amb23950701 [0,1,1,0,0,0|2,0,0]=4 84 B18R2.8990 Cc1ccc(CCCNCc2ccco2)cc1 Amb23950700 [0,1,1,0,0,0|2,0,0]=4 85 B18R2.8990 Clc1ccc(CCCNCc2ccco2)cc1 Amb25515441 [0,1,1,0,0,0|2,0,0]=4 86 B18R2.11744 CC(CCc1ccccc1)NCc2c[n]c[s]2 Amb25403492 [0,1,1,0,0,0|1,0,1]=4 87 B18R2.11744 CC(CCc1ccccc1)NCc2c[s]c[n]2 Amb24788955 [0,1,1,0,0,0|1,0,0]=3 88 B18R2.11744 CC(CCc1ccccc1)NCc2ccco2 Amb22289808 [0,1,1,0,0,0|2,0,0]=4 89 B18R2.11744 CC(NCc1ccco1)CCc2ccccc2 Amb1138925 [0,1,1,0,0,0|2,0,0]=4 90 B18R2.11744 N=C(NCc1c[nH]c[n]1)NCc2ccccc2 Amb24501106 [0,1,1,0,0,0|1,0,1]=4 91 B18R2.11744 O=C(NCc1c[nH]c[n]1)NCc2ccccc2 Amb25810016 [0,1,1,0,0,0|1,0,1]=4 92 B18R2.11744 O=C(NCc1c[nH]c[n]1)OCc2ccccc2 Amb24751706 [0,1,1,0,0,0|1,0,1]=4 93 B18R2.72600 NC(CCNCc1ccc[s]1)c2ccccc2 Amb23927049 [0,1,1,0,0,0|2,0,0]=4 94 B18R2.72600 NC(CCNCc1ccco1)c2ccccc2 Amb23927066 [0,1,1,0,0,0|2,0,0]=4 95 B18R2.72602 NC(CNCc1c[s]cc1)Cc2ccccc2 Amb23965289 [0,1,1,0,0,0|2,0,0]=4 96 B18R2.72602 NC(Cc1ccccc1)CNCc2ccc[s]2 Amb23927048 [0,1,1,0,0,0|2,0,0]=4 97 B18R2.72602 NC(Cc1ccccc1)CNCc2ccco2 Amb23927065 [0,1,1,0,0,0|2,0,0]=4 98 B18R2.72604 CN(Cc1c[s]c[n]1)CCOc2ccccc2 Amb21395802 [0,1,1,0,0,0|2,0,0]=4 99 B18R2.7562 CCOc1ccccc1N(C)Cc2c[n]c[s]2 Amb24285861 [0,1,1,0,0,0|1,0,1]=4 100 B18R2.7562 CCOc1ccccc1N(C)Cc2c[s][n][n]2 Amb24308006 [0,1,1,0,0,0|2,0,0]=4 101 B18R2.7562 CCOc1ccccc1N(C)Cc2cc[nH][n]2 Amb24300233 [0,1,1,0,0,0|2,0,0]=4 102 B18R2.7549 CCCc1ccccc1NC(=O)c2c[nH]nn2 Amb11487603 [0,1,1,0,0,0|1,0,1]=4 103 B18R2.9915 CN(C)Cc1ccccc1NCc2c[s]c[n]2 Amb23916488 [0,1,1,0,0,0|2,0,0]=4 104 B18R2.73372 CCOc1cc(F)ccc1NCc2c[nH]cc2 Amb24024468 [0,1,1,0,0,0|2,0,0]=4 105 B18R3.2910 Nc1c[s]c([n]1)N2CCCc3ccccc23 Amb23580124 [0,1,0,0,1,0|2,0,0]=4 106 B18R3.2910 O=C1CSC(=N1)N2CCCc3c2cccc3 Amb1094759 [0,1,0,0,1,0|2,0,0]=4 107 B18R3.184 Brc1ccsc1CN2CCc3c2cccc3 Amb11193074 [0,1,0,0,1,0|2,0,0]=4 108 B18R3.3190 Nc1cc2CCN(Cc3c[nH]c[n]3)c2cc1 Amb18174127 [0,1,0,0,1,0|0,0,0]=2 109 B18R3.54382 Nc1cc2c(CCN2Cc3c[nH]c[n]3)cc1 Amb18771202 [0,1,0,0,1,0|0,0,0]=2 110 B18R3.54382 Oc1cc2C(Cc3c[nH]c[n]3)CCc2cc1 Amb24073792 [0,1,0,0,1,0|1,0,0]=3 111 B18R3.89767 Cc1cccc2CCN(Cc3cc[nH][n]3)c21 Amb24265743 [0,1,0,0,1,0|2,0,0]=4 112 B20R3.153 Brc1ccc(CN2CCCc3ccccc23)cc1 Amb17730465 [0,1,0,0,0,1|2,0,0]=4 113 B20R3.153 Clc1ccc(CN2CCCc3ccccc23)cc1 Amb17669868 [0,1,0,0,0,1|2,0,0]=4 114 B20R3.153 Fc1ccc(CN2CCCc3ccccc23)cc1 Amb17730464 [0,1,0,0,0,1|2,0,0]=4 115 B20R3.153 Nc1ccc(cc1)CN2CCCc3c2cccc3 Amb1126787 [0,1,0,0,0,1|2,0,0]=4 116 B20R3.173 Nc1ccc2c(c1)CCCN2Cc3ccccc3 Amb13951546 [0,1,0,0,0,1|2,0,0]=4 117 B20R3.173 Oc1cc2CCCN(Cc3ccccc3)c2cc1 Amb25675501 [0,1,0,0,0,1|2,0,0]=4 118 B20R3.265 Cc1[n]cccc1CN2CCNc3ccccc23 Amb24808499 [0,1,0,0,0,1|2,0,0]=4 119 B20R3.265 Cc1ccc[n]c1CN2CCNc3ccccc23 Amb24803981 [0,1,0,0,0,1|2,0,0]=4 120 B20R3.413 NC1Cc2ccccc2N(C1)Cc3cccc[n]3 Amb24800124 [0,1,0,0,0,1|1,0,0]=3 121 B20R3.413 NC1Cc2ccccc2N(Cc3c[n]ccc3)C1 Amb24800117 [0,1,0,0,0,1|1,0,0]=3 122 B20R3.413 NC1Cc2ccccc2N(Cc3cc[n]cc3)C1 Amb24800131 [0,1,0,0,0,1|1,0,1]=4 123 B20R3.413 NC1Cc2ccccc2N(Cc3ccccc3)C1 Amb25242306 [0,1,0,0,0,1|2,0,0]=4 124 B20R3.451 O=C1CCc2ccccc2N1Cc3[n]ccc[n]3 Amb22415300 [0,1,0,0,0,1|1,0,1]=4 125 B20R3.5620 Cc1cc2c(CCCN2Cc3c[n]c[n]c3)cc1 Amb24250171 [0,1,0,0,0,1|0,0,1]=3 126 B20R3.5620 Nc1ccc2c(c1)N(CCC2)Cc3ccccc3 Amb17101290 [0,1,0,0,0,1|2,0,0]=4 127 B20R3.12173 Clc1cccc2c1OCCN2Cc3c[n]c[n]c3 Amb24293509 [0,1,0,0,0,1|1,0,1]=4 128 B20R3.12173 Nc1cccc2c1CCCN2Cc3c[n]ccc3 Amb24798870 [0,1,0,0,0,1|1,0,0]=3 129 B20R3.12173 Nc1cccc2c1CCCN2Cc3cc[n]cc3 Amb24798878 [0,1,0,0,0,1|1,0,1]=4 130 B20R3.12173 Nc1cccc2c1CCCN2Cc3cccc[n]3 Amb24798869 [0,1,0,0,0,1|1,0,0]=3 131 B20R3.12173 Nc1cccc2c1CCCN2Cc3ccccc3 Amb25401104 [0,1,0,0,0,1|2,0,0]=4 132 B20R3.12173 Oc1cccc2c1CCCN2Cc3ccccc3 Amb22750992 [0,1,0,0,0,1|2,0,0]=4 133 B20R3.13189 CC1CCN(Cc2ccccc2)c3ccccc31 Amb22499772 [0,1,0,0,0,1|2,0,0]=4 134 B20R3.13189 OC1CCN(Cc2ccccc2)c3ccccc31 Amb25120355 [0,1,0,0,0,1|2,0,0]=4 135 B20R3.34883 NC(C1CCCc2ccccc21)c3c[n]cc[n]3 Amb23976523 [0,1,0,0,0,1|1,0,1]=4 136 B20R3.3314371 Clc1cc2CN(Cc3c[s]c[n]3)CCOc2cc1 Amb22614275 [0,1,0,0,0,1|2,0,0]=4 137 B20R3.12887 NC1CN(CC[n]2c[n]c[n]2)c3ccccc3C1 Amb24807869 [0,1,0,0,0,1|1,0,1]=4 138 B20R3.12887 NC1CN(CC[n]2ccc[n]2)c3ccccc3C1 Amb24800113 [0,1,0,0,0,1|2,0,0]=4 139 B20R3.251258 Nc1cccc2c1CCCN2CC[n]3c[n]c[n]3 Amb24807864 [0,1,0,0,0,1|1,0,1]=4 140 B20R3.331575 OC(c1ccco1)CN2CCCc3c2cccc3 Amb17159491 [0,1,0,0,0,1|2,0,0]=4 141 B20R3.331575 OC(c1cccs1)CN2CCCc3c2cccc3 Amb17163311 [0,1,0,0,0,1|2,0,0]=4 142 B20R3.14852 CC1CN(Cc2c[n]c[s]2)c3ccccc3CN1 Amb24803980 [0,1,0,0,0,1|1,0,1]=4 143 B20R3.14852 CC1CN(Cc2c[s][n][n]2)c3ccccc3CN1 Amb24807614 [0,1,0,0,0,1|2,0,0]=4 144 B20R3.14852 CC1CN(Cc2c[s]c[n]2)c3ccccc3CN1 Amb25416566 [0,1,0,0,0,1|1,0,0]=3 145 B20R3.87402 Brc1c[s]c(CN2CCNCc3ccccc23)c1 Amb25410851 [0,1,0,0,0,1|2,0,0]=4 146 B20R3.87402 Brc1cc(CN2CCNCc3ccccc23)c[s]1 Amb25410850 [0,1,0,0,0,1|2,0,0]=4 147 B20R3.87402 Brc1ccc(CN2CCNCc3ccccc23)[s]1 Amb25410863 [0,1,0,0,0,1|2,0,0]=4 148 B20R3.87402 C[n]1cc(CN2CCNCc3ccccc23)c[n]1 Amb25410853 [0,1,0,0,0,1|2,0,0]=4 149 B20R3.87402 Cc1[n]c(CN2CCCSc3ccccc23)o[n]1 Amb19341604 [0,1,0,0,0,1|1,0,1]=4 150 B20R3.87402 Cc1[n]c(CN2CCNCc3ccc[n]c23)c[s]1 Amb22188215 [0,1,0,0,0,1|2,0,0]=4 151 B20R3.87402 Cc1[n]c(CN2CCNCc3ccccc23)[n]o1 Amb25410859 [0,1,0,0,0,1|2,0,0]=4 152 B20R3.87402 Cc1[n]c(CN2CCNCc3ccccc23)c[s]1 Amb25410841 [0,1,0,0,0,1|1,0,0]=3 153 B20R3.87402 Cc1[n]cc(CN2CCNCc3ccccc23)[s]1 Amb25410865 [0,1,0,0,0,1|1,0,1]=4 154 B20R3.87402 Cc1[n]oc(CN2CCNCc3ccccc23)[n]1 Amb25410858 [0,1,0,0,0,1|1,0,1]=4 155 B20R3.87402 Cc1cc(CN2CCNCc3ccccc23)[n]o1 Amb25410857 [0,1,0,0,0,1|2,0,0]=4 156 B20R3.87402 Cc1ccc(CN2CCNCc3ccccc23)[s]1 Amb25410852 [0,1,0,0,0,1|2,0,0]=4 157 B20R3.87402 Clc1ccc(CN2CCNCc3ccccc23)[s]1 Amb25410848 [0,1,0,0,0,1|2,0,0]=4 158 B20R3.261304 Brc1cc[s]c1CN2CCNCc3ccccc23 Amb25410868 [0,1,0,0,0,1|2,0,0]=4 159 B20R3.261304 C[n]1cc[n]c1CN2CCNCc3ccccc23 Amb25410849 [0,1,0,0,0,1|2,0,0]=4 160 B20R3.261304 Cc1[n]c[s]c1CN2CCNCc3ccccc23 Amb24010310 [0,1,0,0,0,1|1,0,1]=4 161 B20R3.261304 Cc1cc[s]c1CN2CCNCc3ccccc23 Amb25410862 [0,1,0,0,0,1|2,0,0]=4 162 B20R3.261304 Clc1cc[s]c1CN2CCNCc3ccccc23 Amb24807187 [0,1,0,0,0,1|2,0,0]=4 163 B20R3.64 CCc1[n]c(CN2CCNc3ccccc23)c[s]1 Amb24808604 [0,2,0,0,0,0|2,0,0]=4 164 B20R3.64 CCc1[n]oc(CN2CCCc3ccccc23)[n]1 Amb20897822 [0,2,0,0,0,0|1,0,1]=4 165 B20R3.64 NCc1scc(n1)CN2CCCc3c2cccc3 Amb17163314 [0,2,0,0,0,0|1,0,0]=3 166 B20R3.64 OCc1ccc(CN2CCCc3ccccc23)o1 Amb24188303 [0,2,0,0,0,0|2,0,0]=4 167 B20R3.5239 C[n]1cc(CN2CCCc3c2cccc3N)c[n]1 Amb24798876 [0,2,0,0,0,0|2,0,0]=4 168 B20R3.5239 Cc1[n]c(CN2CCCc3c(N)cccc23)[n]o1 Amb24798874 [0,2,0,0,0,0|2,0,0]=4 169 B20R3.5239 Cc1[n]c(CN2CCCc3c(N)cccc23)c[s]1 Amb24798871 [0,2,0,0,0,0|1,0,0]=3 170 B20R3.5239 Cc1[n]c(CN2CCCc3c(N)cccc23)o[n]1 Amb24798873 [0,2,0,0,0,0|1,0,1]=4 171 B20R3.5239 Cc1[n]cc(CN2CCCc3c(N)cccc23)[s]1 Amb25410525 [0,2,0,0,0,0|1,0,1]=4 172 B20R3.5239 Cc1cc(CN2CCCc3c(N)cccc23)[n]o1 Amb24798872 [0,2,0,0,0,0|2,0,0]=4 173 B20R3.5239 Nc1cccc2c1CCCN2Cc3ccc(Cl)[s]3 Amb24798880 [0,2,0,0,0,0|2,0,0]=4 174 B20R3.27706 Cn1c(ncc1Cl)CN2CCCc3c2cccc3 Amb10188525 [0,2,0,0,0,0|2,0,0]=4 175 B20R3.86379 C[n]1cc(CN2CC(N)Cc3ccccc23)c[n]1 Amb24800125 [0,2,0,0,0,0|2,0,0]=4 176 B20R3.86379 Cc1[n]c(CN2CC(N)Cc3ccccc23)[n]o1 Amb24800104 [0,2,0,0,0,0|2,0,0]=4 177 B20R3.86379 Cc1[n]c(CN2CC(N)Cc3ccccc23)c[s]1 Amb24800120 [0,2,0,0,0,0|1,0,0]=3 178 B20R3.86379 Cc1[n]cc(CN2CC(N)Cc3ccccc23)[s]1 Amb24800127 [0,2,0,0,0,0|1,0,1]=4 179 B20R3.86379 Cc1[n]oc(CN2CC(N)Cc3ccccc23)[n]1 Amb24800109 [0,2,0,0,0,0|1,0,1]=4 180 B20R3.86379 Cc1cc(CN2CC(N)Cc3ccccc23)[n]o1 Amb24800108 [0,2,0,0,0,0|2,0,0]=4 181 B20R3.86379 NC1Cc2ccccc2N(C1)Cc3ccc(Cl)[s]3 Amb24800114 [0,2,0,0,0,0|2,0,0]=4 182 B20R3.242118 S=C1NC(=O)\C(=C\N2CCCc3c2cccc3)\S1 Amb1145406 [0,2,0,0,0,0|1,0,1]=4 183 B20R3.2750478 C[n]1cc(CN2CCCc3cc(N)ccc23)c[n]1 Amb23944831 [0,2,0,0,0,0|2,0,0]=4 184 B20R3.2750478 Cc1ccc2c(c1)CCCN2Cc3cnc(s3)C Amb10765895 [0,2,0,0,0,0|1,0,1]=4 185 B20R3.2750478 Fc1ccc2c(c1)CCCN2Cc3onc(n3)C Amb10640736 [0,2,0,0,0,0|1,0,1]=4 186 B20R3.2750478 Nc1[n]cc(CN2CCCc3cc(Cl)ccc23)[s]1 Amb25463151 [0,2,0,0,0,0|1,0,1]=4 187 B20R3.2750585 CC1CCN(Cc2c[n]c(N)[s]2)c3ccccc31 Amb24807091 [0,2,0,0,0,0|1,0,1]=4 188 B20R3.7785 C[n]1[n]c[n]c1CN2CCCc3c2cccc3N Amb24800725 [0,2,0,0,0,0|1,0,1]=4 189 B20R3.7785 C[n]1cc[n]c1CN2CCCc3c2cccc3N Amb24798881 [0,2,0,0,0,0|2,0,0]=4 190 B20R3.7785 Nc1cccc2c1CCCN2Cc3[s]ccc3Br Amb23937810 [0,2,0,0,0,0|2,0,0]=4 191 B20R3.7785 Nc1cccc2c1CCCN2Cc3[s]ccc3Cl Amb24807183 [0,2,0,0,0,0|2,0,0]=4 192 B20R3.100277 Fc1ccc2c(c1)CCCN2Cc3nnsc3Cl Amb10726824 [0,2,0,0,0,0|2,0,0]=4 193 B20R3.100277 Nc1cc2CCCN(Cc3[s]ccc3Br)c2cc1 Amb23937732 [0,2,0,0,0,0|2,0,0]=4 194 B20R3.125501 C[n]1cc[n]c1CN2CC(N)Cc3ccccc23 Amb24800115 [0,2,0,0,0,0|2,0,0]=4 195 B20R3.125501 NC1Cc2ccccc2N(C1)Cc3[s]ccc3Cl Amb24807189 [0,2,0,0,0,0|2,0,0]=4 196 B20R3.2422 NCC(N1CCCc2c1cccc2)c3[nH]ccc3 Amb17144953 [0,2,0,0,0,0|1,0,1]=4 197 B20R3.95857 O=S(=O)(c1c[nH]c[n]1)N2CCSc3ccccc23 Amb23980680 [0,2,0,0,0,0|2,0,0]=4 198 B20R3.4389297 Cc1cccc2CCCN(C(=O)c3c[s]c[n]3)c21 Amb23962295 [0,2,0,0,0,0|1,0,1]=4 199 B20R3.4389297 O=C(c1c[s]c[n]1)N2CCCc3cccc(Cl)c23 Amb24230521 [0,2,0,0,0,0|1,0,1]=4 200 B18R3.3347 C(NC1CCc2ccccc21)c3[nH]cc[n]3 Amb25393502 [0,0,1,1,0,0|2,0,0]=4 201 B18R4.114802 C1Cc2cccc3c4[nH]c[n]c4cc1c23 Amb23556392 [0,0,0,1,1,0|1,0,1]=4 202 B16R2.2257 C(NCCc1c[nH]c[n]1)c2ccccc2 Amb21979915 [0,0,1,0,1,0|1,0,0]=3 203 B16R2.2257 C(NCCc1cccc[n]1)c2c[s]c[n]2 Amb24770229 [0,0,1,0,1,0|2,0,0]=4 204 B16R2.2257 C(NCCc1ccccc1)c2[nH]cc[n]2 Amb19049618 [0,0,1,0,1,0|2,0,0]=4 205 B16R2.2257 C(NCCc1ccccc1)c2ccc[s]2 Amb21955474 [0,0,1,0,1,0|2,0,0]=4 206 B16R2.2257 C(NCCc1ccccc1)c2ccco2 Amb21972188 [0,0,1,0,1,0|2,0,0]=4 207 B16R2.2257 C(NCCc1ccccc1)c2ccco2 Amb22291652 [0,0,1,0,1,0|2,0,0]=4 208 B16R2.2257 c1ccc(cc1)CCNCc2ccco2 Amb1130095 [0,0,1,0,1,0|2,0,0]=4 209 B16R2.2257 c1ccc(cc1)CCNCc2nccs2 Amb17341156 [0,0,1,0,1,0|2,0,0]=4 210 B16R3.8 C1C=C(c2c[nH]c[n]2)c3ccccc31 Amb25232009 [0,0,0,0,2,0|1,0,1]=4 211 B16R3.8 C1CC(c2ccccc21)c3c[nH]c[n]3 Amb24453260 [0,0,0,0,2,0|1,0,0]=3 212 B16R3.8 C1CN(c2ccccc21)c3[n]cc[s]3 Amb17967692 [0,0,0,0,2,0|2,0,0]=4 213 B18R2.2114 CCCN(Cc1ccccc1)Cc2c[s]c[n]2 Amb20790154 [0,0,1,0,0,1|1,0,0]=3 214 B18R2.2114 NCCN(Cc1ccccc1)Cc2coc[n]2 Amb25474093 [0,0,1,0,0,1|2,0,0]=4 215 B18R2.2114 OCCN(Cc1ccccc1)Cc2c[nH]c[n]2 Amb22494777 [0,0,1,0,0,1|1,0,0]=3 216 B18R2.2114 OCCN(Cc1ccccc1)Cc2c[nH]c[n]2 Amb22495288 [0,0,1,0,0,1|1,0,0]=3 217 B18R2.2114 OCCN(Cc1ccccc1)Cc2c[s]c[n]2 Amb25717202 [0,0,1,0,0,1|2,0,0]=4 218 B18R2.2525 C(COc1ccccc1)NCc2cccnc2 Amb17142419 [0,0,1,0,0,1|2,0,0]=4 219 B18R2.2525 C(NCCCc1ccccc1)c2[n]ccc[n]2 Amb23955321 [0,0,1,0,0,1|1,0,0]=3 220 B18R2.2525 C(NCCSc1ccccc1)c2ccc[n]c2 Amb23912453 [0,0,1,0,0,1|2,0,0]=4 221 B18R2.2525 c1ccc(cc1)CCCNCc2ccccc2 Amb2221082 [0,0,1,0,0,1|2,0,0]=4 222 B18R2.2525 c1ccc(cc1)OCCNCc2ccccn2 Amb17142418 [0,0,1,0,0,1|2,0,0]=4 223 B18R2.2526 C(CCc1ccccc1)NCC[n]2ccc[n]2 Amb19445828 [0,0,1,0,0,1|2,0,0]=4 224 B18R2.2526 C(CNCCNc1ccccc1)c2c[s]c[n]2 Amb23976151 [0,0,1,0,0,1|2,0,0]=4 225 B18R2.2526 C(NCCCOc1ccccc1)c2c[n]c[s]2 Amb25403496 [0,0,1,0,0,1|1,0,1]=4 226 B18R2.2526 C(NCCCOc1ccccc1)c2cc[nH]c2 Amb24024531 [0,0,1,0,0,1|1,0,0]=3 227 B18R2.2526 C(NCCCOc1ccccc1)c2ccc[s]2 Amb24787563 [0,0,1,0,0,1|2,0,0]=4 228 B18R2.2526 C(NCCNCc1c[nH][n][n]1)c2ccccc2 Amb25026123 [0,0,1,0,0,1|1,0,0]=3 229 B18R2.2526 C(NCCNCc1c[nH][n]c1)c2ccccc2 Amb25024793 [0,0,1,0,0,1|2,0,0]=4 230 B18R2.2526 C(NCCNCc1c[n][s][n]1)c2ccccc2 Amb24724340 [0,0,1,0,0,1|1,0,1]=4 231 B18R2.2526 C(NCCNCc1c[n]c[nH]1)c2ccccc2 Amb24528647 [0,0,1,0,0,1|0,0,2]=4 232 B18R2.2526 C(NCCNCc1c[n]co1)c2ccccc2 Amb24545962 [0,0,1,0,0,1|1,0,1]=4 233 B18R2.2526 C(NCCNCc1c[s]cc1)c2ccccc2 Amb24526316 [0,0,1,0,0,1|2,0,0]=4 234 B18R2.2526 C(NCCNCc1ccc[s]1)c2ccccc2 Amb20140263 [0,0,1,0,0,1|2,0,0]=4 235 B18R2.2526 C(NCCNCc1ccco1)c2ccccc2 Amb20140253 [0,0,1,0,0,1|2,0,0]=4 236 B18R2.2526 C(NCCOCc1ccccc1)c2[nH]cc[n]2 Amb24651528 [0,0,1,0,0,1|2,0,0]=4 237 B18R2.2526 C(NCCOCc1ccccc1)c2c[n]c[nH]2 Amb25264236 [0,0,1,0,0,1|0,0,2]=4 238 B18R2.2526 C(NCCOCc1ccccc1)c2c[s]cc2 Amb25747354 [0,0,1,0,0,1|2,0,0]=4 239 B18R2.2526 C(NCCOCc1ccccc1)c2ccc[nH]2 Amb24606369 [0,0,1,0,0,1|1,0,1]=4 240 B18R2.2526 C(NCc1ccco1)CCOc2ccccc2 Amb17308681 [0,0,1,0,0,1|2,0,0]=4 241 B18R2.2526 C(OCCNCc1[n]cc[s]1)c2ccccc2 Amb25138302 [0,0,1,0,0,1|2,0,0]=4 242 B18R2.2526 C(OCCNCc1[n]oc[n]1)c2ccccc2 Amb25744838 [0,0,1,0,0,1|2,0,0]=4 243 B18R2.2526 C(OCCNCc1c[s]c[n]1)c2ccccc2 Amb25257533 [0,0,1,0,0,1|1,0,0]=3 244 B18R2.2526 C(OCCNCc1ccc[s]1)c2ccccc2 Amb24543827 [0,0,1,0,0,1|2,0,0]=4 245 B18R2.2526 C(OCCNCc1ccco1)c2ccccc2 Amb24333807 [0,0,1,0,0,1|2,0,0]=4 246 B18R2.2526 C(OCCNCc1coc[n]1)c2ccccc2 Amb24738720 [0,0,1,0,0,1|1,0,0]=3 247 B18R2.2526 C(SCCNCc1ccco1)c2ccccc2 Amb23912437 [0,0,1,0,0,1|2,0,0]=4 248 B18R2.2526 C(\C=C\c1ccccc1)NCCc2c[nH]c[n]2 Amb21979927 [0,0,1,0,0,1|0,0,2]=4 249 B18R2.7551 CCOc1ccccc1CNCc2coc[n]2 Amb25518486 [0,0,1,0,0,1|2,0,0]=4 250 B18R2.7551 COCc1ccccc1CNCc2c[s]c[n]2 Amb23927921 [0,0,1,0,0,1|2,0,0]=4 251 B18R2.7792 CCN(Cc1cccc[n]1)c2ccccc2N Amb23942985 [0,0,1,0,0,1|2,0,0]=4 252 B18R2.7792 Cc1ccccc1N(Cc2c[n]c[n]c2)CC Amb24293474 [0,0,1,0,0,1|0,0,1]=3 253 B18R2.7792 Cc1ccccc1N(Cc2ccccc2)CC Amb24073630 [0,0,1,0,0,1|2,0,0]=4 254 B18R3.2098 C(C1CCc2ccccc21)c3cccc[n]3 Amb24089496 [0,0,0,0,1,1|2,0,0]=4 255 B18R3.2098 C(c1cccc[n]1)N2CCc3ccccc23 Amb24080245 [0,0,0,0,1,1|1,0,0]=3 256 B18R3.2098 c1ccc(cc1)CN2CCc3c2cccc3 Amb10610016 [0,0,0,0,1,1|2,0,0]=4 257 B20R3.2720 C(CN1CCNc2ccccc12)c3ccc[n]c3 Amb24808612 [0,0,0,0,0,2|2,0,0]=4 258 B20R3.2720 C(NC1CCCc2ccccc21)c3c[n]ccc3 Amb21953944 [0,0,0,0,0,2|2,0,0]=4 259 B20R3.2720 c1ccc(nc1)CNC2CCCc3c2cccc3 Amb11012691 [0,0,0,0,0,2|2,0,0]=4 260 B20R3.30269 C(c1c[n]ccc1)N2CCNCc3ccc[n]c23 Amb22218788 [0,0,0,0,0,2|2,0,0]=4 261 B20R3.30269 C(c1c[n]ccc1)N2CCNCc3ccccc23 Amb25410840 [0,0,0,0,0,2|1,0,0]=3 262 B20R3.30269 C(c1cc[n]cc1)N2CCNCc3ccccc23 Amb25410855 [0,0,0,0,0,2|1,0,1]=4 263 B20R3.30269 C(c1ccccc1)N2CCCNc3ccccc23 Amb19337049 [0,0,0,0,0,2|2,0,0]=4 264 B20R3.30269 C1NCCN(Cc2cccc[n]2)c3ccccc31 Amb25410839 [0,0,0,0,0,2|1,0,0]=3 265 B20R3.30269 c1ccc(cc1)CN2CCNCc3c2cccc3 Amb17581846 [0,0,0,0,0,2|2,0,0]=4 266 B20R3.30044 C(C[n]1c[n]c[n]1)N2CCCNc3ccccc23 Amb24807862 [0,0,0,0,0,2|1,0,1]=4 267 B20R3.30044 C1CCCc2ccccc2N1CC[n]3c[n]c[n]3 Amb22136537 [0,0,0,0,0,2|1,0,1]=4 268 B20R3.30044 C1CCNc2ccccc2N1CC[n]3ccc[n]3 Amb25413029 [0,0,0,0,0,2|2,0,0]=4 269 B20R3.30044 C1NCCN(CC[n]2c[n]c[n]2)c3ccccc31 Amb24807867 [0,0,0,0,0,2|1,0,1]=4