0 B14R2.9440 CC(C)CC1CNCc2cc[nH]c21 Amb25721245 [0,0,0,0,0,0|4,0,0]=4 1 B14R2.9440 CC(C)CC1NCC[n]2cccc21 Amb19652083 [0,0,0,0,0,0|4,0,0]=4 2 B14R2.9440 CC(C)CC1NCCc2[nH]c[n]c21 Amb18062100 [0,0,0,0,0,0|4,0,0]=4 3 B14R2.9440 CC(CC1NCCc2c1ccs2)C Amb17236302 [0,0,0,0,0,0|4,0,0]=4 4 B14R2.9440 OC(=O)CC1NCCc2cc[s]c21 Amb18188475 [0,0,0,0,0,0|4,0,0]=4 5 B14R2.9440 OC(=O)CC1OCCc2cc[s]c21 Amb19319458 [0,0,0,0,0,0|3,0,0]=3 6 B13R2.292 CCCC1CNCc2cc[s]c21 Amb25045450 [1,0,0,0,0,0|3,0,0]=4 7 B13R2.292 CCCC1NCCc2cc[s]c21 Amb25699946 [1,0,0,0,0,0|2,0,0]=3 8 B13R2.292 CNCC1CCCc2[s]c[n]c21 Amb18648683 [1,0,0,0,0,0|3,0,0]=4 9 B13R2.292 CNCC1CCCc2c[n]oc21 Amb25377352 [1,0,0,0,0,0|2,1,0]=4 10 B13R2.292 CNCC1OCCc2[s]ccc21 Amb25773556 [1,0,0,0,0,0|2,0,0]=3 11 B13R2.292 CNC[C@@H]1OCCc2cc[s]c21 Amb25379049 [1,0,0,0,0,0|0,0,0]=1 12 B13R2.292 CNC[C@H]1CCCc2[s]ccc21 Amb24699296 [1,0,0,0,0,0|3,0,0]=4 13 B13R2.292 COCC1NCCc2cc[s]c21 Amb25707376 [1,0,0,0,0,0|2,0,0]=3 14 B13R2.292 OCCC1OCCc2cc[s]c21 Amb25127857 [1,0,0,0,0,0|2,0,0]=3 15 B15R2.1106 CN(C)CC1CCCC=2SC(=O)NC21 Amb24342914 [0,1,0,0,0,0|3,0,0]=4 16 B13R1.392 CN(C)CCc1[n]cc[n]1CCN Amb18335921 [0,0,1,0,0,0|3,0,0]=4 17 B13R1.1119 CC(C)=CC(NC)c1[s]ccc1C Amb25851663 [0,0,1,0,0,0|2,0,1]=4 18 B13R1.2800 CCc1cc[s]c1C(=O)NN(C)C Amb24510210 [0,0,1,0,0,0|1,0,2]=4 19 B15R3.909 CN1CC2C(C1)NCc3cc[s]c32 Amb18189678 [0,0,0,1,0,0|2,0,0]=3 20 B13R2.687 CC(C)NC1CCc2cc[s]c21 Amb25182910 [0,0,0,0,1,0|2,0,0]=3 21 B13R2.687 CN(C)Cc1c[nH]c2cc[s]c21 Amb24399946 [0,0,0,0,1,0|1,0,2]=4 22 B13R2.687 CN(C)NC1CC[n]2cc[n]c21 Amb25707412 [0,0,0,0,1,0|3,0,0]=4 23 B13R2.5569 CC(C)C1CNCc2cc[s]c21 Amb25042724 [0,0,0,0,1,0|3,0,0]=4 24 B13R2.5569 CC(C)C1NCCc2cc[s]c21 Amb24710325 [0,0,0,0,1,0|2,0,0]=3 25 B13R2.5569 CC(C)C1OCCc2co[n]c21 Amb24092135 [0,0,0,0,1,0|3,0,0]=4 26 B13R2.5569 CC(N)C1OCCc2cc[s]c21 Amb25075230 [0,0,0,0,1,0|2,0,0]=3 27 B15R2.19753 CC(C)NCC1OCCc2[s]ccc21 Amb25771729 [0,0,0,0,0,1|3,0,0]=4 28 B15R2.68122 CC(=O)CC1OCCc2ccccc21 Amb22284624 [0,0,0,0,0,1|3,0,0]=4 29 B15R2.68122 CC(C)C[C@@H]1NCCc2ccccc21 Amb25324890 [0,0,0,0,0,1|3,0,0]=4 30 B15R2.68122 CN(C)CC1CCNc2ccccc21 Amb25330618 [0,0,0,0,0,1|3,0,0]=4 31 B15R2.68122 CN(C)CC1NCCc2ccccc21 Amb18956500 [0,0,0,0,0,1|2,0,0]=3 32 B15R2.68122 CN(C)CC1OCCc2ccccc21 Amb24731748 [0,0,0,0,0,1|1,0,0]=2 33 B12R1.293 CCOC(c1cccs1)OCC Amb10067514 [1,0,1,0,0,0|2,0,0]=4 34 B12R1.476 BrCC(c1cccs1)CC(C)C Amb17258971 [1,0,1,0,0,0|2,0,0]=4 35 B12R1.476 CC\C(=N\N(C)C)\c1ccc[s]1 Amb25283966 [1,0,1,0,0,0|1,0,1]=4 36 B12R1.476 ClCC(c1cccs1)CC(C)C Amb17237594 [1,0,1,0,0,0|2,0,0]=4 37 B12R1.476 N#CC(c1cccs1)CN(C)C Amb17233762 [1,0,1,0,0,0|1,0,1]=4 38 B12R1.476 NCC(c1cccs1)CC(C)C Amb17234036 [1,0,1,0,0,0|2,0,0]=4 39 B12R1.476 NCC(c1cccs1)CN(C)C Amb17234114 [1,0,1,0,0,0|1,0,0]=3 40 B12R1.476 OCC(c1cccs1)CC(C)C Amb17234110 [1,0,1,0,0,0|2,0,0]=4 41 B12R1.144 CC(C)=CC(O)c1[s]ccc1C Amb25065673 [1,0,1,0,0,0|1,0,1]=4 42 B12R1.144 CC(C)CC(O)c1[s]ccc1Br Amb25677786 [1,0,1,0,0,0|2,0,0]=4 43 B12R1.144 CC(C)CC(O)c1[s]ccc1I Amb25378546 [1,0,1,0,0,0|2,0,0]=4 44 B12R1.144 CN(C)CC(N)c1[s]ccc1Cl Amb25112502 [1,0,1,0,0,0|2,0,0]=4 45 B12R1.144 CN(C)NC(C)c1[s]ccc1Br Amb25736034 [1,0,1,0,0,0|2,0,0]=4 46 B12R1.144 Cc1[n]c[s]c1C(C)NN(C)C Amb25817080 [1,0,1,0,0,0|2,0,0]=4 47 B12R1.144 Cc1[n]c[s]c1C(O)CC(C)C Amb25737422 [1,0,1,0,0,0|2,0,0]=4 48 B12R1.144 Cc1cc[s]c1C(C)CC(C)Cl Amb25375371 [1,0,1,0,0,0|2,0,0]=4 49 B12R1.144 Cc1cc[s]c1C(C)NC(C)C Amb24398341 [1,0,1,0,0,0|2,0,0]=4 50 B12R1.144 Cc1cc[s]c1C(C)NN(C)C Amb25321595 [1,0,1,0,0,0|1,0,0]=3 51 B12R1.144 Cc1cc[s]c1C(Cl)CC(C)C Amb25761466 [1,0,1,0,0,0|2,0,0]=4 52 B12R1.144 Cc1cc[s]c1C(N)CC(C)C Amb18979876 [1,0,1,0,0,0|2,0,0]=4 53 B12R1.144 Cc1cc[s]c1C(O)CC(C)C Amb19057656 [1,0,1,0,0,0|1,0,0]=3 54 B12R1.144 Cc1cc[s]c1C(O)CN(C)C Amb24437422 [1,0,1,0,0,0|0,0,0]=2 55 B12R2.315 CCC1NCCc2cc[s]c21 Amb25281361 [2,0,0,0,0,0|1,0,0]=3 56 B12R2.315 CNC1CCCc2[n]c[s]c21 Amb18946605 [2,0,0,0,0,0|2,0,0]=4 57 B12R2.315 CNC1CCCc2cc[nH]c21 Amb18201879 [2,0,0,0,0,0|2,0,0]=4 58 B12R2.315 NCC1CCCc2c[n][s]c21 Amb18199189 [2,0,0,0,0,0|2,0,0]=4 59 B12R2.315 NCC1OCCc2[nH]c[n]c21 Amb18125567 [2,0,0,0,0,0|2,0,0]=4 60 B12R2.315 NCC1OCCc2c[s]cc21 Amb22713445 [2,0,0,0,0,0|2,0,0]=4 61 B12R2.315 NCC1OCCc2cc[s]c21 Amb20667880 [2,0,0,0,0,0|0,0,0]=2 62 B12R2.315 NCC1OCCc2occc21 Amb25321514 [2,0,0,0,0,0|2,0,0]=4 63 B12R2.315 NC[C@@H]1OCCc2[s]ccc21 Amb24694448 [2,0,0,0,0,0|2,0,0]=4 64 B12R2.315 OCC1CCCc2cc[s]c21 Amb24523180 [2,0,0,0,0,0|2,0,0]=4 65 B12R2.315 OC[C@@H]1CCCc2cc[s]c21 Amb25226439 [2,0,0,0,0,0|2,0,0]=4 66 B14R1.418 CC(NCCCN(C)C)c1c[s]cc1 Amb19664382 [0,1,1,0,0,0|2,0,0]=4 67 B14R2.535 CNCC1OCCc2cc(Br)[s]c21 Amb25220226 [1,1,0,0,0,0|0,0,0]=2 68 B14R2.892 CCNCC1OCCc2[s]ccc21 Amb25075138 [1,1,0,0,0,0|2,0,0]=4 69 B14R2.5061 Cc1[n]c2C(CN(C)C)CCc2[s]1 Amb25711988 [0,1,0,0,1,0|2,0,0]=4 70 B14R2.10893 CC(CC)NC1CCc2cc[s]c21 Amb25345745 [0,1,0,0,1,0|2,0,0]=4 71 B14R2.10893 C[C@@H](CO)NC1CCc2cc[s]c21 Amb25728762 [0,1,0,0,1,0|2,0,0]=4 72 B14R2.10893 C[C@H](CO)NC1CCc2cc[s]c21 Amb25297091 [0,1,0,0,1,0|2,0,0]=4 73 B14R2.712 CC(C)C1NCCc2cc(Br)[s]c21 Amb24623414 [0,1,0,0,1,0|2,0,0]=4 74 B16R2.333 CN(C)CC1N(C)CCc2ccccc12 Amb17777917 [0,1,0,0,0,1|2,0,0]=4 75 B16R2.2986 CN(C)CC1CCCc2cc(O)ccc21 Amb22464463 [0,1,0,0,0,1|2,0,0]=4 76 B16R2.29551 CCOC(=O)CC1OCCc2cc[s]c21 Amb24066406 [0,2,0,0,0,0|2,0,0]=4 77 B14R2.252 CC1CN(CC1)CCc2c[s]cc2 Amb25167501 [0,0,1,1,0,0|2,0,0]=4 78 B14R2.252 CN1CC(CC1)NCc2c[s]cc2 Amb18978185 [0,0,1,1,0,0|2,0,0]=4 79 B14R2.716 CC1CC(Cc2cc[s]c2)NCC1 Amb25328635 [0,0,1,1,0,0|2,0,0]=4 80 B14R2.716 CN1CC(CCC1)Nc2c[s]cc2 Amb25704485 [0,0,1,1,0,0|2,0,0]=4 81 B14R2.716 CN1CC(C[n]2cc[n]c2)OCC1 Amb25366908 [0,0,1,1,0,0|2,0,0]=4 82 B14R2.716 CN1CC(C[n]2cccc2)OCC1 Amb25128582 [0,0,1,1,0,0|2,0,0]=4 83 B14R2.5549 CC1(C)CCN1CCc2c[s]cc2 Amb24576776 [0,0,1,1,0,0|2,0,0]=4 84 B14R2.124 CN1CC(C(CN)C1)c2ccc[s]2 Amb23590031 [0,0,1,1,0,0|2,0,0]=4 85 B14R2.269 Cc1c[nH][n]c1C2CN(C)CCO2 Amb20136377 [0,0,1,1,0,0|2,0,0]=4 86 B14R2.269 Cc1cc[s]c1C2CC(C)CCN2 Amb25130881 [0,0,1,1,0,0|2,0,0]=4 87 B14R2.370 Cc1cc[s]c1C2CN(C)CC2N Amb25212527 [0,0,1,1,0,0|2,0,0]=4 88 B14R2.2863 Cc1cc[s]c1C(NC)C2CC2C Amb18321391 [0,0,1,1,0,0|2,0,0]=4 89 B14R3.2484 C1C2CNCC(C2)c3[s]c[n]c31 Amb25349683 [1,0,0,1,0,0|2,0,0]=4 90 B16R3.5314 CN1CC2C(C1)NCCc3cc[s]c32 Amb18776488 [0,0,0,1,0,1|1,0,0]=3 91 B16R3.27088 CN1CC2NCCc3c2c(C1)ccc3 Amb17506016 [0,0,0,1,0,1|2,0,0]=4 92 B16R3.11020 CN1CC2C(CC1)NCc3cc[s]c32 Amb18776486 [0,1,0,1,0,0|2,0,0]=4 93 B12R1.255 CN(CCNCc1cscc1)C Amb1139755 [0,0,1,0,1,0|1,0,0]=3 94 B12R1.480 Cc1cc[s]c1C(C#N)N(C)C Amb18791180 [0,0,1,0,1,0|2,0,0]=4 95 B12R1.480 Cc1cc[s]c1C(NC)C(C)C Amb19057344 [0,0,1,0,1,0|2,0,0]=4 96 B12R1.480 Cc1cc[s]c1C(OC)C(C)N Amb18980304 [0,0,1,0,1,0|2,0,0]=4 97 B12R1.480 NCC(c1sccc1C)N(C)C Amb1141420 [0,0,1,0,1,0|2,0,0]=4 98 B12R1.480 NCC(c1sccc1C)N(C)C Amb13949224 [0,0,1,0,1,0|2,0,0]=4 99 B12R1.80 CC(=C)C(O)c1[s]ccc1CC Amb24389750 [0,0,1,0,1,0|1,0,1]=4 100 B12R2.144 CNCC1CCc2[n][n][s]c21 Amb25312588 [1,0,0,0,1,0|2,0,0]=4 101 B12R2.144 CNCC1CCc2[s]ccc21 Amb24595618 [1,0,0,0,1,0|2,0,0]=4 102 B12R2.144 CNCC1CCc2c[n]oc21 Amb25234191 [1,0,0,0,1,0|1,1,0]=4 103 B12R2.144 CNCC1CCc2cc[s]c21 Amb25312402 [1,0,0,0,1,0|0,0,0]=2 104 B12R2.144 CNCC1CCc2co[n]c21 Amb25208453 [1,0,0,0,1,0|2,0,0]=4 105 B12R2.144 CNCC1CCc2cocc21 Amb24656826 [1,0,0,0,1,0|2,0,0]=4 106 B12R2.1362 CC(N)C1CCc2cc[s]c21 Amb25174347 [0,0,0,0,2,0|2,0,0]=4 107 B14R1.422 CC(C)CCOCCc1ccccc1 Amb22732326 [0,0,1,0,0,1|2,0,0]=4 108 B14R1.422 CN(CCNCCc1ccccc1)C Amb1136705 [0,0,1,0,0,1|2,0,0]=4 109 B14R1.74 COc1cccc(c1)C(CN(C)C)O Amb17104289 [0,0,1,0,0,1|2,0,0]=4 110 B14R1.840 CNc1ccccc1C(O)CN(C)C Amb25818693 [0,0,1,0,0,1|2,0,0]=4 111 B14R1.840 COc1ccccc1C(CN(C)C)O Amb17104288 [0,0,1,0,0,1|2,0,0]=4 112 B14R2.7150 CNCC1NCCc2ccccc21 Amb18956501 [1,0,0,0,0,1|2,0,0]=4 113 B14R2.7150 CNCC1OCCc2c1cccc2 Amb1995204 [1,0,0,0,0,1|1,0,0]=3 114 B14R2.7150 CSCC1OCCc2ccccc21 Amb24525366 [1,0,0,0,0,1|2,0,0]=4 115 B16R2.179941 CN(CCC1NCCc2c1cccc2)C Amb17193934 [0,0,0,0,0,2|2,0,0]=4