0 B15R2.1428 C#CCNC1=CC(=O)c2ccccc12 Amb24375637 [0,0,0,0,0,0|2,0,2]=4 1 B15R2.1428 C=CCNC1OC(=O)c2ccccc21 Amb18929411 [0,0,0,0,0,0|1,0,3]=4 2 B15R2.1428 CCCCC1NC(=O)c2ccccc21 Amb24707204 [0,0,0,0,0,0|1,0,2]=3 3 B15R2.1428 CCCCC1OC(=O)C=2C=CCCC21 Amb20246410 [0,0,0,0,0,0|0,0,4]=4 4 B15R2.1428 CCCCC1OC(=O)c2ccccc21 Amb22002464 [0,0,0,0,0,0|0,0,2]=2 5 B15R2.1428 CCCCC=1NC(=S)N2C=CC=CC21 Amb25695908 [0,0,0,0,0,0|2,1,1]=4 6 B15R2.1428 CCCC[C@@H]1NC(=O)c2ccccc21 Amb24441616 [0,0,0,0,0,0|1,0,2]=3 7 B15R2.1428 CCCC[C@H]1OC(O)c2ccccc21 Amb25057815 [0,0,0,0,0,0|0,0,4]=4 8 B15R2.1428 CCCC[n]1[n]c(Br)c2ccccc12 Amb23568589 [0,0,0,0,0,0|3,0,1]=4 9 B15R2.1428 CCCNC1NC(=O)c2ccc[n]c21 Amb24348158 [0,0,0,0,0,0|3,0,1]=4 10 B15R2.1428 CCCNC1OC(=O)c2ccccc21 Amb18929422 [0,0,0,0,0,0|1,0,1]=2 11 B15R2.1428 CCC\C=C/1\NC(=O)c2ccccc21 Amb24669076 [0,0,0,0,0,0|1,0,0]=1 12 B15R2.1428 CCC\C=C/1\OC(=O)C2=C1CCC=C2 Amb10845273 [0,0,0,0,0,0|0,0,2]=2 13 B15R2.1428 CCC\C=C/1\OC(=O)c2ccccc21 Amb22169952 [0,0,0,0,0,0|0,0,0]=0 14 B15R2.1428 CCC\C=C\1/OC(=O)C=2C=CCCC21 Amb22739651 [0,0,0,0,0,0|0,0,2]=2 15 B15R2.1428 CCC\C=C\1/OC(=O)c2ccccc21 Amb22172905 [0,0,0,0,0,0|0,0,0]=0 16 B15R2.1428 CO\N=C\C1SC(=O)c2c1cccc2 Amb2440310 [0,0,0,0,0,0|2,1,1]=4 17 B15R2.1428 NC1=N\C(=N/CCO)\c2ccccc21 Amb24652334 [0,0,0,0,0,0|4,0,0]=4 18 B15R2.1428 O=C1CC(CCCCl)c2ccccc21 Amb25350468 [0,0,0,0,0,0|2,0,2]=4 19 B15R2.1428 OCCCC1OC(=O)c2ccccc21 Amb24761358 [0,0,0,0,0,0|1,0,2]=3 20 B15R2.1428 OCCNC1OC(=O)c2ccccc21 Amb18266562 [0,0,0,0,0,0|2,0,1]=3 21 B15R2.1428 OCC\N=C/1\OC(=O)c2ccccc21 Amb25725481 [0,0,0,0,0,0|2,0,0]=2 22 B14R2.3 CCCCc1ncc2n1cccc2 Amb17138744 [1,0,0,0,0,0|2,0,1]=4 23 B14R2.3 CCCCn1ccc2c1cccc2 Amb10603405 [1,0,0,0,0,0|2,0,1]=4 24 B14R2.3 CCCNc1[s][n]c2ccccc21 Amb25700673 [1,0,0,0,0,0|2,1,0]=4 25 B14R2.3 CCCNc1c[nH]c2ccccc12 Amb25727240 [1,0,0,0,0,0|3,0,0]=4 26 B14R2.3 CC\C=C/c1c[nH]c2ccccc21 Amb25713938 [1,0,0,0,0,0|2,0,1]=4 27 B14R2.3 ClCC\N=C/1\OCc2ccccc12 Amb24729542 [1,0,0,0,0,0|2,0,1]=4 28 B14R2.3 N#C\C=C/c1occ2ccccc21 Amb25187734 [1,0,0,0,0,0|1,0,2]=4 29 B14R2.3 NCCCc1o[n]c2ccccc21 Amb18196761 [1,0,0,0,0,0|2,0,1]=4 30 B14R2.3 OCCSc1[nH]cc2ccccc21 Amb25242434 [1,0,0,0,0,0|3,0,0]=4 31 B14R2.3 OC\C=C\c1occ2ccccc21 Amb25211857 [1,0,0,0,0,0|1,0,1]=3 32 B14R2.510 C#CCC1OC(=O)c2ccccc21 Amb24115403 [1,0,0,0,0,0|0,0,3]=4 33 B14R2.510 C=C1O\C(=C\C=O)\c2ccccc21 Amb24580388 [1,0,0,0,0,0|2,0,1]=4 34 B14R2.510 C=CCC1OC(=O)c2ccccc21 Amb24115332 [1,0,0,0,0,0|0,0,3]=4 35 B14R2.510 C=C\C=C\1/NC(=O)c2ccccc21 Amb25790567 [1,0,0,0,0,0|1,0,2]=4 36 B14R2.510 CCCC1CC(=O)c2c1cccc2 Amb17233023 [1,0,0,0,0,0|1,0,1]=3 37 B14R2.510 CCCC1NC(=O)c2ccccc21 Amb24611181 [1,0,0,0,0,0|1,0,1]=3 38 B14R2.510 CCCN1NC(=O)c2ccc[n]c12 Amb21963373 [1,0,0,0,0,0|3,0,0]=4 39 B14R2.510 CCC[C@@H]1NC(=O)c2ccccc21 Amb25046207 [1,0,0,0,0,0|1,0,1]=3 40 B14R2.510 CCC[C@H]1NC(=O)c2ccccc21 Amb25041111 [1,0,0,0,0,0|1,0,1]=3 41 B14R2.510 CCC[n]1[n]c(Br)c2ccccc12 Amb23568588 [1,0,0,0,0,0|3,0,0]=4 42 B14R2.510 CCC[n]1cc(I)c2ccccc12 Amb24067582 [1,0,0,0,0,0|3,0,0]=4 43 B14R2.510 CCNC1=NC(=O)c2ccccc21 Amb25309378 [1,0,0,0,0,0|2,0,0]=3 44 B14R2.510 CCNC1OC(=O)c2ccccc21 Amb18929415 [1,0,0,0,0,0|1,0,1]=3 45 B14R2.510 CCOC1OC(=N)c2ccccc21 Amb24572742 [1,0,0,0,0,0|2,0,1]=4 46 B14R2.510 CCOC1OC(=O)c2[n]cccc21 Amb21927572 [1,0,0,0,0,0|2,0,1]=4 47 B14R2.510 CCOC1OC(=O)c2c[n]ccc21 Amb22372211 [1,0,0,0,0,0|2,0,1]=4 48 B14R2.510 CCSC1NC(=O)c2ccccc21 Amb25270863 [1,0,0,0,0,0|2,0,1]=4 49 B14R2.510 CC\C=C/1\CC(=O)c2ccccc21 Amb24575941 [1,0,0,0,0,0|1,0,0]=2 50 B14R2.510 CC\C=C\1/CC(=O)c2ccccc21 Amb24416713 [1,0,0,0,0,0|1,0,0]=2 51 B14R2.510 CC\C=C\1/OC(=O)c2ccccc21 Amb22730297 [1,0,0,0,0,0|0,0,0]=1 52 B14R2.510 CC\N=C\1/NC(=O)c2ccc[n]c12 Amb24743248 [1,0,0,0,0,0|3,0,0]=4 53 B14R2.510 CN\N=C\1/CC(=O)c2ccccc21 Amb22520567 [1,0,0,0,0,0|3,0,0]=4 54 B14R2.510 COCN1OC(=O)c2ccccc12 Amb25202195 [1,0,0,0,0,0|2,0,0]=3 55 B14R2.510 N#C\C=C/1\OC(=O)c2ccccc12 Amb25332007 [1,0,0,0,0,0|1,0,1]=3 56 B14R2.510 N#C\C=C\1/NC(=O)c2ccccc12 Amb25131147 [1,0,0,0,0,0|2,0,1]=4 57 B14R2.510 NCCC1CC(=O)c2ccccc21 Amb18252261 [1,0,0,0,0,0|2,0,1]=4 58 B14R2.510 NCCC1NC(=O)c2ccccc21 Amb18196795 [1,0,0,0,0,0|2,0,1]=4 59 B14R2.510 O=C1N\C(=C/C=O)\c2ccccc12 Amb24490183 [1,0,0,0,0,0|2,0,1]=4 60 B14R2.510 O=C1N\C(=C\C=O)\c2ccccc12 Amb25300430 [1,0,0,0,0,0|2,0,1]=4 61 B14R2.510 OCCC1CC(=O)c2ccccc21 Amb24449008 [1,0,0,0,0,0|2,0,1]=4 62 B14R2.510 OCCC1NC(=O)c2ccccc21 Amb25351414 [1,0,0,0,0,0|2,0,1]=4 63 B14R2.510 OCC[C@@H]1CC(=O)c2ccccc21 Amb24631660 [1,0,0,0,0,0|2,0,1]=4 64 B16R2.33556 CCC(O)\C=C\1/OC(=O)c2ccccc12 Amb22741235 [0,1,0,0,0,0|0,0,0]=1 65 B16R2.154585 CCCC(=O)c1[n][n](C)c2ccccc21 Amb25742722 [0,1,0,0,0,0|3,0,0]=4 66 B16R2.154585 CCOC(=O)C1NC(=O)c2ccccc21 Amb22750000 [0,1,0,0,0,0|2,0,1]=4 67 B16R2.154585 CCOC(=O)N1NC(=O)c2ccccc12 Amb22442180 [0,1,0,0,0,0|3,0,0]=4 68 B16R2.165527 CCCCC1OC(=O)c2ccc(O)cc21 Amb22741236 [0,1,0,0,0,0|0,0,2]=3 69 B16R2.165527 CCC\C=C\1/OC(=O)c2ccc(O)cc21 Amb22741205 [0,1,0,0,0,0|0,0,0]=1 70 B16R2.165528 CCCNC1=NS(=O)(=O)c2c1cccc2 Amb1952989 [0,1,0,0,0,0|3,0,0]=4 71 B14R1.38 CCCCC#CC(=O)c1ccccc1 Amb10572461 [0,0,1,0,0,0|1,0,2]=4 72 B14R1.38 CCC\C=N\NC(=O)c1ccccc1 Amb1625386 [0,0,1,0,0,0|2,0,0]=3 73 B14R1.38 CCOCCOC(=O)c1ccccc1 Amb22732198 [0,0,1,0,0,0|1,0,2]=4 74 B14R1.38 CCO\C=C\NC(=O)c1ccccc1 Amb25733096 [0,0,1,0,0,0|2,0,0]=3 75 B14R1.903 CCCC#Cc1ccccc1C(N)=O Amb24423908 [0,0,1,0,0,0|1,0,2]=4 76 B14R1.903 CCCC#Cc1ccccc1C(O)=O Amb25320884 [0,0,1,0,0,0|0,0,2]=3 77 B14R1.903 CCCCNc1ccccc1C(=O)O Amb1205497 [0,0,1,0,0,0|1,0,1]=3 78 B14R1.903 CCCCNc1ccccc1C(N)=O Amb24065117 [0,0,1,0,0,0|2,0,1]=4 79 B14R1.903 CCCCOc1ccc[n]c1C(O)=O Amb19042930 [0,0,1,0,0,0|2,0,1]=4 80 B14R1.903 CCCCOc1ccccc1C(=O)Cl Amb17477465 [0,0,1,0,0,0|2,0,1]=4 81 B14R1.903 CCCCOc1ccccc1C(=O)O Amb1139953 [0,0,1,0,0,0|1,0,1]=3 82 B14R1.903 CCCCSc1ccccc1C(=O)O Amb1133402 [0,0,1,0,0,0|1,0,1]=3 83 B14R1.903 CCCNCc1ccccc1C(=O)O Amb2119489 [0,0,1,0,0,0|1,0,1]=3 84 B14R1.903 CCCNCc1ccccc1C(O)=O Amb19649731 [0,0,1,0,0,0|1,0,1]=3 85 B14R1.903 CC\C=N\Nc1ccccc1C(O)=O Amb24574995 [0,0,1,0,0,0|2,0,1]=4 86 B14R1.903 COCCOc1ccccc1C(=O)O Amb2189154 [0,0,1,0,0,0|2,0,1]=4 87 B14R1.903 COCCSc1ccccc1C(=O)O Amb1928153 [0,0,1,0,0,0|2,0,1]=4 88 B16R3.18377 CC1COC2c3ccccc3C(=O)N21 Amb24115442 [0,0,0,1,0,0|2,0,1]=4 89 B16R3.20606 O=C1c2ccccc2C3C1CCCC3 Amb16191934 [0,0,0,1,0,0|1,0,2]=4 90 B16R3.20606 O=C1c2ccccc2C3OCCCN13 Amb22000161 [0,0,0,1,0,0|2,0,1]=4 91 B16R3.20606 O=C1c2ccccc2C=3CCCCC31 Amb25353584 [0,0,0,1,0,0|1,0,1]=3 92 B16R3.27203 O=C1CC2CCCCc3cccc1c32 Amb25341722 [0,0,0,1,0,0|1,0,2]=4 93 B16R3.29373 CC1CCC2CC(=O)c3cccc1c32 Amb24747564 [0,0,0,1,0,0|1,0,2]=4 94 B16R3.29373 O=C1Oc2ccc(Br)c3cccc1c32 Amb25165116 [0,0,0,1,0,0|1,0,2]=4 95 B16R3.29373 Oc1ccc2OC(=O)c3cccc1c32 Amb18649224 [0,0,0,1,0,0|1,0,2]=4 96 B16R3.180227 O=C1OC2(CNCC2)c3ccccc31 Amb22395726 [0,0,0,1,0,0|1,0,2]=4 97 B16R2.1054 CCCCC1=Nc2ccccc2C(=O)O1 Amb21973218 [0,0,0,0,0,1|0,0,1]=2 98 B16R2.1054 CCCCC1CC(=O)c2ccccc2O1 Amb25703756 [0,0,0,0,0,1|1,0,2]=4 99 B16R2.1054 CCCCc1cc(Cl)c2ccccc2[n]1 Amb22497152 [0,0,0,0,0,1|2,0,1]=4 100 B16R2.1054 CCCNC=1NC(=O)c2ccccc2N1 Amb18512408 [0,0,0,0,0,1|2,0,0]=3 101 B16R2.1054 CCCNc1[n]c(N)c2ccccc2[n]1 Amb20369919 [0,0,0,0,0,1|3,0,0]=4 102 B16R2.1054 CCCOc1cc(=O)n2c(n1)cccc2 Amb10553468 [0,0,0,0,0,1|3,0,0]=4 103 B16R2.1054 CCCSC=1NC(=O)c2ccccc2N1 Amb18516573 [0,0,0,0,0,1|2,0,0]=3 104 B16R2.1054 CCCSC=1Nc2ccccc2C(=O)N1 Amb20030161 [0,0,0,0,0,1|2,0,0]=3 105 B16R2.1054 CCNCC=1NC(=O)c2ccccc2N1 Amb18288816 [0,0,0,0,0,1|2,0,1]=4 106 B16R2.1054 CCNCC=1NC(=O)c2ccccc2N1 Amb19372327 [0,0,0,0,0,1|2,0,1]=4 107 B16R2.1054 CNCCC=1NC(=O)c2ccccc2N1 Amb18864806 [0,0,0,0,0,1|2,0,1]=4 108 B16R2.1054 NCCCC=1NC(=O)c2ccccc2N1 Amb18864803 [0,0,0,0,0,1|2,0,1]=4 109 B16R2.1054 NCCSC=1NC(=O)c2ccccc2N1 Amb18023347 [0,0,0,0,0,1|3,0,0]=4 110 B16R2.1054 NCCSc1nc2ccccc2c(=O)[nH]1 Amb2582254 [0,0,0,0,0,1|3,0,0]=4 111 B16R2.1054 OCCNC=1NC(=O)c2ccccc2N1 Amb17986949 [0,0,0,0,0,1|3,0,0]=4 112 B16R2.12192 CCCCN1C=NC(=O)c2ccccc12 Amb22752712 [0,0,0,0,0,1|2,0,1]=4 113 B16R2.12192 CCCCN1CCC(=O)c2ccccc12 Amb25323190 [0,0,0,0,0,1|2,0,1]=4 114 B16R2.12192 CCCNc1[n][n]c(Cl)c2ccccc21 Amb19748510 [0,0,0,0,0,1|3,0,0]=4 115 B16R2.12192 CCCOc1ccc(N)c2ccccc21 Amb18055504 [0,0,0,0,0,1|3,0,0]=4 116 B16R2.12202 CCCNC1=CC(=O)Oc2ccccc12 Amb21948601 [0,0,0,0,0,1|2,0,0]=3 117 B16R2.12202 CCCOC1=CC(=O)Nc2ccccc12 Amb23533722 [0,0,0,0,0,1|2,0,0]=3 118 B16R2.12202 OCCNC1=CC(=O)Oc2ccccc12 Amb21996475 [0,0,0,0,0,1|3,0,0]=4 119 B13R1.24 CC#C\C=C\C(=O)c1ccccc1 Amb24553543 [1,0,1,0,0,0|0,0,2]=4 120 B13R1.24 CCCC#CC(=O)c1ccccc1 Amb24491405 [1,0,1,0,0,0|0,0,2]=4 121 B13R1.24 CCCCOC(=O)c1cccnc1 Amb17509605 [1,0,1,0,0,0|1,0,1]=4 122 B13R1.24 CCCCOC(=O)c1ccncc1 Amb10573708 [1,0,1,0,0,0|1,0,1]=4 123 B13R1.24 CCCCSC(=O)c1ccccc1 Amb22231430 [1,0,1,0,0,0|0,1,1]=4 124 B13R1.24 CCC\C=N\C(=O)c1ccccc1 Amb24072851 [1,0,1,0,0,0|1,0,0]=3 125 B13R1.24 CCN=C=CC(=O)c1ccccc1 Amb25334925 [1,0,1,0,0,0|1,0,1]=4 126 B13R1.24 COC\C=N\C(=O)c1ccccc1 Amb24072844 [1,0,1,0,0,0|2,0,0]=4 127 B13R1.24 CO\C=C/NC(=O)c1ccccc1 Amb25233532 [1,0,1,0,0,0|2,0,0]=4 128 B13R1.24 CO\C=C\NC(=O)c1ccccc1 Amb25236507 [1,0,1,0,0,0|2,0,0]=4 129 B13R1.24 C\C=C\C=CC(=O)c1ccccc1 Amb24646500 [1,0,1,0,0,0|0,0,2]=4 130 B13R1.24 O=C(OCCCCl)c1ccccc1 Amb24099970 [1,0,1,0,0,0|1,0,1]=4 131 B13R1.24 OCCCOC(=O)c1ccccc1 Amb22387917 [1,0,1,0,0,0|1,0,1]=4 132 B13R1.28 CCC\C=N\OCc1ccccc1 Amb25355698 [1,0,1,0,0,0|1,0,1]=4 133 B13R1.26 CCCC\C(=C/[Pr])\c1ccccc1 Amb10559340 [1,0,1,0,0,0|1,0,1]=4 134 B13R1.398 CC\C=C(/N=C=O)\c1ccccc1 Amb25799649 [1,0,1,0,0,0|1,0,1]=4 135 B13R1.398 C\C=C\C(=C\C=O)\c1ccccc1 Amb24640215 [1,0,1,0,0,0|1,0,1]=4 136 B13R1.84 CCCC#Cc1ccccc1C=O Amb24441619 [1,0,1,0,0,0|0,0,2]=4 137 B13R1.572 C=C\C=C\c1ccccc1C(O)=O Amb25269472 [1,0,1,0,0,0|0,0,2]=4 138 B13R1.572 CCCNc1cc[n]cc1C(O)=O Amb25131782 [1,0,1,0,0,0|2,0,0]=4 139 B13R1.572 CCCNc1ccc[n]c1C(O)=O Amb25057197 [1,0,1,0,0,0|2,0,0]=4 140 B13R1.572 CCCNc1ccccc1C(=O)O Amb1110239 [1,0,1,0,0,0|1,0,0]=3 141 B13R1.572 CCCNc1ccccc1C(N)=O Amb18796024 [1,0,1,0,0,0|2,0,0]=4 142 B13R1.572 CCCOc1ccccc1C(=O)O Amb1140823 [1,0,1,0,0,0|1,0,0]=3 143 B13R1.572 CCCSc1ccccc1C(=O)O Amb1138545 [1,0,1,0,0,0|1,0,0]=3 144 B13R1.572 CCCSc1ncccc1C(=O)O Amb1133590 [1,0,1,0,0,0|2,0,0]=4 145 B13R1.572 CCNCc1ccccc1C(=O)O Amb10242754 [1,0,1,0,0,0|1,0,1]=4 146 B13R1.572 CCNCc1ccccc1C(=O)O Amb2119471 [1,0,1,0,0,0|1,0,1]=4 147 B13R1.572 CC\C=N\c1ccccc1C(O)=O Amb24711280 [1,0,1,0,0,0|1,0,0]=3 148 B13R1.572 COCOc1ccccc1C(O)=O Amb22055712 [1,0,1,0,0,0|2,0,0]=4 149 B13R1.572 CO\N=C\c1ccccc1C(O)=O Amb24541447 [1,0,1,0,0,0|2,0,0]=4 150 B13R1.572 C\C=C\Cc1ccccc1C(O)=O Amb24426260 [1,0,1,0,0,0|0,0,2]=4 151 B13R1.572 C\C=C\Sc1ccccc1C(O)=O Amb25188029 [1,0,1,0,0,0|1,0,1]=4 152 B13R1.572 N#C\C=C\c1ccccc1C(=O)O Amb17477684 [1,0,1,0,0,0|1,0,1]=4 153 B13R1.572 NC(=O)c1ccccc1\C=C\CO Amb20248381 [1,0,1,0,0,0|2,0,0]=4 154 B13R1.572 NCCNc1ccccc1C(O)=O Amb18186560 [1,0,1,0,0,0|2,0,0]=4 155 B13R1.572 NCCNc1ccccc1C(O)=O Amb22756939 [1,0,1,0,0,0|2,0,0]=4 156 B13R1.572 OC(=O)c1ccccc1NCCCl Amb24652399 [1,0,1,0,0,0|2,0,0]=4 157 B13R1.572 OC(=O)c1ccccc1NCCF Amb24463361 [1,0,1,0,0,0|2,0,0]=4 158 B13R1.572 OC(=O)c1ccccc1\N=C\CO Amb25109239 [1,0,1,0,0,0|2,0,0]=4 159 B13R1.572 OCCNc1ccccc1C(=O)O Amb1102882 [1,0,1,0,0,0|2,0,0]=4 160 B13R1.464 CCNC(=O)c1ccccc1C=O Amb25305984 [1,0,1,0,0,0|1,0,1]=4 161 B13R1.464 C\C=C\C(=O)c1ccccc1C=O Amb25208969 [1,0,1,0,0,0|0,0,2]=4 162 B13R1.565 CC\C=C\1/C=C(C=CCO)C(=O)O1 Amb25788167 [1,0,1,0,0,0|1,0,1]=4 163 B13R2.1 CCCc1[n][nH]c2ccccc21 Amb25707815 [2,0,0,0,0,0|2,0,0]=4 164 B13R2.1 CCCc1coc2ccccc21 Amb24102497 [2,0,0,0,0,0|2,0,0]=4 165 B13R2.1 CCCc1ncc2n1cccc2 Amb17138510 [2,0,0,0,0,0|2,0,0]=4 166 B13R2.1 NCCc1o[n]c2ccccc21 Amb18829745 [2,0,0,0,0,0|2,0,0]=4 167 B13R2.1 NCCc1occ2ccccc21 Amb24469254 [2,0,0,0,0,0|1,0,0]=3 168 B13R2.1 NOCc1occ2ccccc21 Amb25319347 [2,0,0,0,0,0|2,0,0]=4 169 B13R2.1 O=CCc1occ2ccccc21 Amb24061113 [2,0,0,0,0,0|1,0,1]=4 170 B13R2.1 OCCc1occ2ccccc21 Amb25156887 [2,0,0,0,0,0|1,0,0]=3 171 B13R2.1 O\N=C\c1occ2ccccc21 Amb25349634 [2,0,0,0,0,0|2,0,0]=4 172 B13R2.2931 C=CC1OC(=O)c2ccccc21 Amb24115296 [2,0,0,0,0,0|0,0,2]=4 173 B13R2.2931 CCC1=CC(=O)c2ccccc21 Amb24647742 [2,0,0,0,0,0|1,0,0]=3 174 B13R2.2931 CCC1CC(=O)c2c1cccc2 Amb17232326 [2,0,0,0,0,0|1,0,1]=4 175 B13R2.2931 CCC1OC(=O)c2[n]cccc21 Amb25295257 [2,0,0,0,0,0|1,0,1]=4 176 B13R2.2931 CCC1OC(=O)c2cc[n]cc21 Amb24341707 [2,0,0,0,0,0|1,0,1]=4 177 B13R2.2931 CCC1OC(=O)c2ccccc21 Amb24115402 [2,0,0,0,0,0|0,0,1]=3 178 B13R2.2931 CC[C@@H]1NC(=O)c2ccccc21 Amb25733164 [2,0,0,0,0,0|1,0,1]=4 179 B13R2.2931 CC[C@H]1CC(=O)c2ccccc21 Amb25370725 [2,0,0,0,0,0|1,0,1]=4 180 B13R2.2931 CC[n+]1oc(c2c1cccc2)C Amb16759187 [2,0,0,0,0,0|2,0,0]=4 181 B13R2.2931 CNC1=NC(=O)c2ccccc21 Amb25295230 [2,0,0,0,0,0|2,0,0]=4 182 B13R2.2931 CNC1OC(=O)c2ccccc21 Amb18266318 [2,0,0,0,0,0|1,0,1]=4 183 B13R2.2931 COC1=CC(=O)c2ccccc12 Amb25262748 [2,0,0,0,0,0|2,0,0]=4 184 B13R2.2931 C\C=C/1\CC(=O)c2ccccc21 Amb24570409 [2,0,0,0,0,0|1,0,0]=3 185 B13R2.2931 C\C=C\1/OC(=O)c2ccccc21 Amb19895689 [2,0,0,0,0,0|0,0,0]=2 186 B13R2.2931 NCC1OC(=O)c2c1cccc2 Amb17608185 [2,0,0,0,0,0|1,0,1]=4 187 B13R2.2931 N\C=C/1\OC(=O)c2ccccc21 Amb25201645 [2,0,0,0,0,0|1,0,0]=3 188 B13R2.2931 O=C1N\C(=C\Cl)\c2ccccc21 Amb25172948 [2,0,0,0,0,0|2,0,0]=4 189 B13R2.2931 O=C1OC(=CBr)c2ccccc21 Amb22482473 [2,0,0,0,0,0|1,0,0]=3 190 B13R2.2931 O=C1OC(CCl)c2ccccc21 Amb25034744 [2,0,0,0,0,0|1,0,1]=4 191 B13R2.2931 OCC1=CC(=O)c2ccccc21 Amb24721734 [2,0,0,0,0,0|2,0,0]=4 192 B13R2.2931 OC[C@@H]1OC(=O)c2ccccc21 Amb25816368 [2,0,0,0,0,0|1,0,1]=4 193 B13R2.2931 OC[C@H]1OC(=O)c2ccccc21 Amb25346281 [2,0,0,0,0,0|1,0,1]=4 194 B13R2.2931 O\C=C/1\OC(=O)c2ccccc21 Amb24060110 [2,0,0,0,0,0|1,0,0]=3 195 B15R1.30 CCCC=NNC(=O)c1ccc(cc1)F Amb13962027 [0,1,1,0,0,0|2,0,0]=4 196 B15R1.30 CCCCCOC(=O)c1ccc(cc1)N Amb1014020 [0,1,1,0,0,0|0,0,2]=4 197 B15R1.30 CCC\C=N\NC(=O)c1ccc(cc1)Br Amb2465873 [0,1,1,0,0,0|2,0,0]=4 198 B15R1.30 CCC\C=N\NC(=O)c1ccc(cc1)Cl Amb2465867 [0,1,1,0,0,0|2,0,0]=4 199 B15R1.30 CCC\C=N\NC(=O)c1ccc(cc1)O Amb1625390 [0,1,1,0,0,0|2,0,0]=4 200 B15R1.31 CCC/C=N/NC(=O)c1cccc(F)c1 Amb17790584 [0,1,1,0,0,0|2,0,0]=4 201 B15R1.31 CCCCCOC(=O)c1cccc(c1)N Amb17307671 [0,1,1,0,0,0|0,0,2]=4 202 B15R1.31 CCC\C=N\NC(=O)c1cccc(c1)O Amb1263202 [0,1,1,0,0,0|2,0,0]=4 203 B15R1.89 CCCC(C)COC(=O)c1ccccc1 Amb22732416 [0,1,1,0,0,0|0,0,2]=4 204 B15R1.89 CCOC(=O)\C=C\C(=O)c1ccccc1 Amb2435419 [0,1,1,0,0,0|2,0,0]=4 205 B15R1.115 CCCNC(=S)NC(=O)c1ccccc1 Amb1840613 [0,1,1,0,0,0|2,0,0]=4 206 B15R1.497 CC(C\C=N\NC(=O)c1ccccc1)C Amb1625387 [0,1,1,0,0,0|2,0,0]=4 207 B15R1.3965 CCCC=NNC(=O)c1ccccc1C Amb13961934 [0,1,1,0,0,0|2,0,0]=4 208 B15R1.3965 CCCC=NNC(=O)c1ccccc1O Amb13961877 [0,1,1,0,0,0|2,0,0]=4 209 B15R1.3965 CCCCCOC(=O)c1ccccc1N Amb17307688 [0,1,1,0,0,0|0,0,2]=4 210 B15R1.3965 CCCCCOC(=O)c1ccccc1O Amb17307701 [0,1,1,0,0,0|0,0,2]=4 211 B15R1.3965 CCC\C=N\NC(=O)c1ccccc1Br Amb2465868 [0,1,1,0,0,0|2,0,0]=4 212 B15R1.3965 CCC\C=N\NC(=O)c1ccccc1C Amb2473135 [0,1,1,0,0,0|2,0,0]=4 213 B15R1.3965 CCC\C=N\NC(=O)c1ccccc1Cl Amb1263210 [0,1,1,0,0,0|2,0,0]=4 214 B15R1.241 CCOCCOc1ccccc1C(=O)O Amb2081549 [0,1,1,0,0,0|1,0,1]=4 215 B15R1.559 CCCCNc1ccc(N)cc1C(O)=O Amb24070998 [0,1,1,0,0,0|1,0,1]=4 216 B15R1.559 CCCCOc1ccc(cc1C(=O)O)C Amb17201346 [0,1,1,0,0,0|1,0,1]=4 217 B15R1.559 CCCCSc1ccc(Cl)cc1C(O)=O Amb24271723 [0,1,1,0,0,0|1,0,1]=4 218 B15R1.559 CCCNCc1ccc(Br)cc1C(O)=O Amb24123124 [0,1,1,0,0,0|1,0,1]=4 219 B15R1.559 CCCNCc1ccc(Cl)cc1C(O)=O Amb24123119 [0,1,1,0,0,0|1,0,1]=4 220 B15R1.559 CCCNCc1ccc(F)cc1C(O)=O Amb24123129 [0,1,1,0,0,0|1,0,1]=4 221 B15R1.559 CCCNCc1ccc(I)cc1C(O)=O Amb24123114 [0,1,1,0,0,0|1,0,1]=4 222 B15R1.559 CCCOCc1ccc(N)cc1C(O)=O Amb23443150 [0,1,1,0,0,0|1,0,1]=4 223 B15R1.1191 COC(=O)c1ccccc1N=COCC Amb24066619 [0,1,1,0,0,0|2,0,0]=4 224 B15R1.1239 CCCOC(=O)c1ccccc1C(O)=O Amb18656047 [0,1,1,0,0,0|1,0,0]=3 225 B15R1.1239 OC(=O)c1ccccc1C(=O)OCCBr Amb17779720 [0,1,1,0,0,0|2,0,0]=4 226 B15R1.1239 OC(=O)c1ccccc1C(=O)OCCCl Amb17845119 [0,1,1,0,0,0|2,0,0]=4 227 B15R1.1274 CCCC(=O)Nc1c[n]ccc1C(O)=O Amb24351453 [0,1,1,0,0,0|2,0,0]=4 228 B15R1.1274 CCCC(=O)Nc1ccc[n]c1C(O)=O Amb25164585 [0,1,1,0,0,0|2,0,0]=4 229 B15R1.1274 CCCC(=O)Oc1ccccc1C(O)=O Amb20222799 [0,1,1,0,0,0|1,0,0]=3 230 B15R1.1274 CCNC(=O)Cc1ccccc1C(O)=O Amb25391402 [0,1,1,0,0,0|1,0,1]=4 231 B15R1.1274 CCNC(=S)Nc1ccccc1C(O)=O Amb23129357 [0,1,1,0,0,0|2,0,0]=4 232 B15R1.1274 CCOC(=O)Cc1ccccc1C(O)=O Amb18656070 [0,1,1,0,0,0|1,0,1]=4 233 B15R1.1274 CCOC(=O)Nc1ccccc1C(=O)O Amb2550352 [0,1,1,0,0,0|2,0,0]=4 234 B15R1.1274 COCC(=O)Nc1ccccc1C(=O)O Amb1118039 [0,1,1,0,0,0|2,0,0]=4 235 B15R1.1274 C\C(\NCC)=N\c1ccccc1C(O)=O Amb24106945 [0,1,1,0,0,0|2,0,0]=4 236 B15R1.1274 NCCC(=O)Nc1ccccc1C(O)=O Amb18305470 [0,1,1,0,0,0|2,0,0]=4 237 B15R1.3990 Cc1cccc(c1OCCCC)C(O)=O Amb23287269 [0,1,1,0,0,0|1,0,1]=4 238 B15R1.4455 CCC\C=C\c1cccc(F)c1C(N)=O Amb19701344 [0,1,1,0,0,0|1,0,0]=3 239 B15R1.8882 CC(CCOc1ccccc1C(=O)O)C Amb1141182 [0,1,1,0,0,0|1,0,1]=4 240 B15R1.8882 CC(CCSc1ccccc1C(=O)O)C Amb1141638 [0,1,1,0,0,0|1,0,1]=4 241 B15R1.1240 CCCOC(=O)c1ccccc1NC=O Amb24096901 [0,1,1,0,0,0|1,0,1]=4 242 B15R2.73 CCCC(=O)c1coc2ccccc12 Amb25071288 [1,1,0,0,0,0|2,0,0]=4 243 B15R2.73 CCOC(=O)c1o[n]c2ccccc21 Amb25278650 [1,1,0,0,0,0|2,0,0]=4 244 B15R2.10698 CC1C(CCC)c2ccccc2C1=O Amb25784564 [1,1,0,0,0,0|1,0,1]=4 245 B15R2.10698 CCCN1c2ccccc2C(=O)C1=O Amb1349646 [1,1,0,0,0,0|2,0,0]=4 246 B15R2.10698 CCNC1=C(Cl)C(=O)c2ccccc21 Amb24336672 [1,1,0,0,0,0|2,0,0]=4 247 B15R2.10698 OC\C=C\1/c2ccccc2C(=O)N1O Amb24371358 [1,1,0,0,0,0|2,0,0]=4 248 B15R2.11492 CCC[n]1[n]c(C=O)c2ccccc12 Amb23455185 [1,1,0,0,0,0|2,0,0]=4 249 B15R2.11492 CCCc1[n]c(C=O)c2cccc[n]21 Amb25281811 [1,1,0,0,0,0|2,0,0]=4 250 B15R2.11494 CCCC1CC(=O)c2c1ccc(c2)C Amb17234578 [1,1,0,0,0,0|1,0,1]=4 251 B15R2.11494 CCCC1CC(=O)c2c1ccc(c2)Cl Amb17240131 [1,1,0,0,0,0|1,0,1]=4 252 B15R2.11494 CCCC1CC(=O)c2c1ccc(c2)F Amb17235362 [1,1,0,0,0,0|1,0,1]=4 253 B15R2.23388 CNC(=O)N1OC(=O)c2ccccc12 Amb25857472 [1,1,0,0,0,0|2,0,0]=4 254 B15R2.23388 C\C(\CC)=C\1/OC(=O)c2ccccc21 Amb25254906 [1,1,0,0,0,0|0,0,0]=2 255 B15R2.53147 CC(=C)\C=C\1/NC(=O)c2ccccc12 Amb25240010 [1,1,0,0,0,0|1,0,1]=4 256 B15R2.53147 CC(=O)\C=C/1\NC(=O)c2ccccc12 Amb24548268 [1,1,0,0,0,0|1,0,1]=4 257 B15R2.53147 CC(C)CC1NC(=O)c2ccccc21 Amb24469385 [1,1,0,0,0,0|1,0,1]=4 258 B15R2.53147 CC(C)CC1OC(=O)c2ccccc21 Amb24115404 [1,1,0,0,0,0|0,0,1]=3 259 B15R2.53147 CC(C)C[C@@H]1NC(=O)c2ccccc21 Amb25758034 [1,1,0,0,0,0|1,0,1]=4 260 B15R2.53147 CC(C)C[C@H]1NC(=O)c2ccccc21 Amb25709689 [1,1,0,0,0,0|1,0,1]=4 261 B15R2.53147 CC(C)NC1OC(=O)c2ccccc21 Amb18929417 [1,1,0,0,0,0|1,0,1]=4 262 B15R2.53147 CC(C)\C=C/1\NC(=O)c2ccccc12 Amb24513104 [1,1,0,0,0,0|1,0,0]=3 263 B15R2.53147 CC(C)\C=C\1/NC(=O)c2ccccc12 Amb25790552 [1,1,0,0,0,0|1,0,0]=3 264 B15R2.53147 CC(CC1CC(=O)c2c1cccc2)C Amb17234577 [1,1,0,0,0,0|1,0,1]=4 265 B15R2.53147 CC(N)CC1NC(=O)c2ccccc21 Amb18650611 [1,1,0,0,0,0|1,0,1]=4 266 B15R2.53147 CC(O)CC1NC(=O)c2ccccc21 Amb25758088 [1,1,0,0,0,0|1,0,1]=4 267 B15R2.53147 CC(O)\C=C/1\OC(=O)c2ccccc12 Amb25145328 [1,1,0,0,0,0|0,0,0]=2 268 B15R2.53147 CN(C)CC1OC(=O)c2ccccc21 Amb25852783 [1,1,0,0,0,0|1,0,1]=4 269 B15R2.53147 CN(C)\C=C/1\OC(=O)c2ccccc12 Amb25258166 [1,1,0,0,0,0|1,0,0]=3 270 B15R2.53147 CN(C)\C=C/1\SC(=O)c2ccccc12 Amb24561287 [1,1,0,0,0,0|1,1,0]=4 271 B15R2.53147 CN(C)\C=C\1/OC(=O)c2ccccc12 Amb21933405 [1,1,0,0,0,0|1,0,0]=3 272 B15R2.53147 CN(C)\C=C\1/SC(=O)c2ccccc12 Amb21927034 [1,1,0,0,0,0|1,1,0]=4 273 B15R2.53147 NC(=O)\C=C/1\OC(=O)c2ccccc12 Amb24563501 [1,1,0,0,0,0|1,0,1]=4 274 B15R2.53147 NC(=O)\C=C\1/OC(=O)c2ccccc12 Amb19750821 [1,1,0,0,0,0|1,0,1]=4 275 B15R2.53147 OC(=O)C=C1OC(=O)c2c1cccc2 Amb15740491 [1,1,0,0,0,0|1,0,1]=4 276 B15R2.53147 OC(=O)\C=C\1/OC(=O)c2c1cccc2 Amb1150341 [1,1,0,0,0,0|1,0,1]=4 277 B15R2.53147 OC(=O)\C=C\1/OC(=O)c2ccccc12 Amb22733359 [1,1,0,0,0,0|1,0,1]=4 278 B15R2.56230 Cc1cccc2C(=O)O\C(=C\C#N)\c21 Amb25762228 [1,1,0,0,0,0|1,0,1]=4 279 B15R2.56233 CCCC1OC(=O)c2ccc(O)cc21 Amb24633351 [1,1,0,0,0,0|0,0,1]=3 280 B15R2.56233 C\C=C\C1OC(=O)c2ccc(N)cc21 Amb25096335 [1,1,0,0,0,0|0,0,2]=4 281 B15R2.72532 CCCC1(O)NC(=O)c2ccccc12 Amb24469363 [1,1,0,0,0,0|1,0,1]=4 282 B15R2.72532 CCCC1(O)OC(=O)c2ccccc12 Amb22450386 [1,1,0,0,0,0|0,0,1]=3 283 B17R2.12072 CCCCNC=1NC(=O)c2ccccc2N1 Amb18512468 [0,1,0,0,0,1|1,0,1]=4 284 B17R2.12072 CCCCSC=1NC(=O)c2ccccc2N1 Amb21867766 [0,1,0,0,0,1|1,0,1]=4 285 B17R2.12072 CCCOCC=1NC(=O)c2ccccc2N1 Amb19450643 [0,1,0,0,0,1|1,0,1]=4 286 B17R2.12072 COCCNC=1NC(=O)c2ccccc2N1 Amb17986842 [0,1,0,0,0,1|2,0,0]=4 287 B17R2.12072 CSCCNC=1NC(=O)c2ccccc2N1 Amb23616513 [0,1,0,0,0,1|2,0,0]=4 288 B17R2.12072 C\C=C\C=C\C1=Nc2ccccc2C(=O)O1 Amb19518369 [0,1,0,0,0,1|0,0,2]=4 289 B17R2.12072 OCCCNC=1NC(=O)c2ccccc2N1 Amb17986850 [0,1,0,0,0,1|2,0,0]=4 290 B17R2.40403 CC(C)CNC=1NC(=O)c2ccccc2N1 Amb17986783 [0,1,0,0,0,1|2,0,0]=4 291 B17R2.40403 CC(C)COC1=Nc2ccccc2C(=O)O1 Amb21923948 [0,1,0,0,0,1|1,0,0]=3 292 B17R2.40403 CC(C)COC1=[NH+]c2ccccc2C(=O)O1 Amb22554646 [0,1,0,0,0,1|1,0,0]=3 293 B17R2.40403 CC(C)CSC=1NC(=O)c2ccccc2N1 Amb17987841 [0,1,0,0,0,1|2,0,0]=4 294 B17R2.40403 CC(O)CNC=1NC(=O)c2ccccc2N1 Amb17986806 [0,1,0,0,0,1|2,0,0]=4 295 B17R2.49938 CCCN(C)C=1NC(=O)c2ccccc2N1 Amb23616985 [0,1,0,0,0,1|2,0,0]=4 296 B17R2.49938 CCNC(=O)C1=Cc2ccccc2C(=O)N1 Amb21140568 [0,1,0,0,0,1|2,0,0]=4 297 B17R2.49938 CCNC(=O)C=1NC(=O)c2ccccc2N1 Amb19270912 [0,1,0,0,0,1|2,0,0]=4 298 B17R2.49938 CCOC(=O)C1=CC(=O)c2ccccc2N1 Amb20259623 [0,1,0,0,0,1|2,0,0]=4 299 B17R2.49938 CCOC(=O)C1=CC(=O)c2ccccc2O1 Amb19665772 [0,1,0,0,0,1|2,0,0]=4 300 B17R2.49938 CCOC(=O)C1=Cc2cc[n]cc2C(=O)O1 Amb19930094 [0,1,0,0,0,1|2,0,0]=4 301 B17R2.49938 CCOC(=O)C1=Cc2ccccc2C(=O)N1 Amb22498018 [0,1,0,0,0,1|2,0,0]=4 302 B17R2.49938 CCOC(=O)C1=Cc2ccccc2C(=O)O1 Amb22750237 [0,1,0,0,0,1|1,0,0]=3 303 B17R2.49938 CCOC(=O)C1=Cc2ccccc2C(=O)S1 Amb18003606 [0,1,0,0,0,1|1,1,0]=4 304 B17R2.49938 CCOC(=O)C1=Nc2[n]cccc2C(=O)O1 Amb22496093 [0,1,0,0,0,1|2,0,0]=4 305 B17R2.49938 CCOC(=O)C1=Nc2c[n]ccc2C(=O)O1 Amb22496092 [0,1,0,0,0,1|2,0,0]=4 306 B17R2.49938 CCOC(=O)C1OC(=O)c2c(C1)cccc2 Amb2481364 [0,1,0,0,0,1|1,0,1]=4 307 B17R2.49938 CCOC(=O)C=1NC(=O)c2ccccc2N1 Amb18000379 [0,1,0,0,0,1|2,0,0]=4 308 B17R2.49938 CCOC(=O)C=1Nc2ccccc2C(=O)N1 Amb22733828 [0,1,0,0,0,1|2,0,0]=4 309 B17R2.49938 CCOC(=O)c1cc2ccccc2c(=O)s1 Amb2480195 [0,1,0,0,0,1|1,1,0]=4 310 B17R2.49938 CCOC(=O)c1nc2ccccc2c(=O)[nH]1 Amb1395750 [0,1,0,0,0,1|2,0,0]=4 311 B17R2.49938 CCSC(=O)C1=CC(=O)c2ccccc2O1 Amb21997843 [0,1,0,0,0,1|2,0,0]=4 312 B17R2.56354 CCCCC1=Nc2ccccc2C(=O)N1N Amb18658132 [0,1,0,0,0,1|1,0,1]=4 313 B17R2.56354 CCCSC1=Nc2ccccc2C(=O)N1C Amb19523445 [0,1,0,0,0,1|2,0,0]=4 314 B17R2.57534 CCC(C)NC=1NC(=O)c2ccccc2N1 Amb17986741 [0,1,0,0,0,1|2,0,0]=4 315 B17R2.57534 CCC(C)SC=1Nc2ccccc2C(=O)N1 Amb19522441 [0,1,0,0,0,1|2,0,0]=4 316 B17R2.12118 CCCCOc1[n][nH]c(=O)c2ccccc21 Amb24065899 [0,1,0,0,0,1|1,0,1]=4 317 B17R2.12118 CCO\C=C\C1=CNC(=O)c2ccccc12 Amb20247042 [0,1,0,0,0,1|1,0,1]=4 318 B17R2.50010 CCNC(=O)C1=NNC(=O)c2ccccc21 Amb19803244 [0,1,0,0,0,1|2,0,0]=4 319 B17R2.50010 CCNC(=S)C1=NNC(=O)c2ccccc21 Amb22343918 [0,1,0,0,0,1|2,0,0]=4 320 B17R2.50010 CCOC(=O)C1=CNC(=O)c2ccccc12 Amb22495361 [0,1,0,0,0,1|2,0,0]=4 321 B17R2.50010 CCOC(=O)C1=COC(=O)c2ccccc21 Amb22750232 [0,1,0,0,0,1|1,0,0]=3 322 B17R2.50010 CCOC(=O)C1=NNC(=O)c2ccccc21 Amb19654310 [0,1,0,0,0,1|2,0,0]=4 323 B17R2.138581 CCO\C=C/1\C(=O)NC(=O)c2c1cccc2 Amb2364557 [0,1,0,0,0,1|2,0,0]=4 324 B17R2.138581 CCO\C=C/1\C(=O)OC(=O)c2c1cccc2 Amb1104749 [0,1,0,0,0,1|1,0,0]=3 325 B17R2.138581 CCO\C=C/1\c2ccccc2C(=O)OC1=O Amb24119223 [0,1,0,0,0,1|1,0,0]=3 326 B17R2.138581 CCO\C=C\1/C(=O)NC(=O)c2c1cccc2 Amb2371410 [0,1,0,0,0,1|2,0,0]=4 327 B17R2.138581 CCO\C=C\1/c2ccccc2C(=O)OC1=O Amb19372254 [0,1,0,0,0,1|1,0,0]=3 328 B17R2.345886 CCCOc1ccc(C=O)c2ccccc12 Amb17734058 [0,1,0,0,0,1|2,0,0]=4 329 B17R2.5014 CC(CNc1cc(=O)oc2c1cccc2)O Amb1887751 [0,1,0,0,0,1|2,0,0]=4 330 B17R2.5014 CC(O)CNC1=CC(=O)Oc2ccccc12 Amb19763054 [0,1,0,0,0,1|2,0,0]=4 331 B17R2.12128 CCCCNC1=CC(=O)Oc2ccccc12 Amb19545953 [0,1,0,0,0,1|1,0,1]=4 332 B17R2.12128 CCCCNc1cc(=O)oc2c1cccc2 Amb1893641 [0,1,0,0,0,1|1,0,1]=4 333 B17R2.12128 OCCCNC1=CC(=O)Oc2ccccc12 Amb19538191 [0,1,0,0,0,1|2,0,0]=4 334 B17R2.50020 CCCC(=O)N1CC(=O)Nc2c1cccc2 Amb1381721 [0,1,0,0,0,1|2,0,0]=4 335 B17R2.50020 CCOC(=O)C1=CC(=O)Nc2ccccc12 Amb21995281 [0,1,0,0,0,1|2,0,0]=4 336 B17R2.50020 CCOC(=O)C1=CC(=O)Oc2ccccc12 Amb22750233 [0,1,0,0,0,1|2,0,0]=4 337 B17R2.50020 CCOC(=O)C1=NC(=O)Nc2ccccc21 Amb23401155 [0,1,0,0,0,1|2,0,0]=4 338 B17R2.138659 CCCNC1=C(N)C(=O)Oc2ccccc21 Amb20031875 [0,1,0,0,0,1|2,0,0]=4 339 B17R2.339149 CCCCC1=CC(=O)Oc2cc(O)ccc21 Amb19517155 [0,1,0,0,0,1|1,0,1]=4 340 B17R2.49523 CCOC(=O)NC1OC(=O)c2ccccc21 Amb22454305 [0,2,0,0,0,0|1,0,1]=4 341 B17R2.85802 CCCC\C=C\1/c2ccccc2C(=O)C1=O Amb21934245 [0,2,0,0,0,0|1,0,0]=3 342 B17R2.1050843 CCCC(=O)[n]1cc(C=O)c2ccccc12 Amb18225325 [0,2,0,0,0,0|2,0,0]=4 343 B15R2.66 CCCc1[n]oc([n]1)-c2ccccc2 Amb25129777 [0,0,1,1,0,0|2,0,0]=4 344 B15R2.66 CNCc1coc([n]1)-c2ccccc2 Amb25044677 [0,0,1,1,0,0|2,0,0]=4 345 B15R2.66 NCCc1coc(c1)-c2ccccc2 Amb18821590 [0,0,1,1,0,0|2,0,0]=4 346 B15R2.66 OCCc1coc([n]1)-c2ccccc2 Amb25120003 [0,0,1,1,0,0|2,0,0]=4 347 B15R2.66 OCCc1coc(c1)-c2ccccc2 Amb25813913 [0,0,1,1,0,0|2,0,0]=4 348 B15R2.395 CC1CC=NN1C(=O)c2ccccc2 Amb1875864 [0,0,1,1,0,0|2,0,0]=4 349 B15R2.1259 O=C(CC=1CCCC1)c2c[n]ccc2 Amb24630661 [0,0,1,1,0,0|2,0,0]=4 350 B15R2.1259 O=C(OC1CCCS1)c2ccccc2 Amb25068923 [0,0,1,1,0,0|1,0,1]=4 351 B15R2.1259 O=C(\C=C/1\CCCN1)c2ccccc2 Amb24400445 [0,0,1,1,0,0|2,0,0]=4 352 B15R2.1259 O=C(\C=C/1\CCCO1)c2ccccc2 Amb25823730 [0,0,1,1,0,0|2,0,0]=4 353 B15R2.2226 O=C(c1ccccc1)C2=CNCCC2 Amb2371800 [0,0,1,1,0,0|2,0,0]=4 354 B15R2.2226 O=C(c1ccccc1)C=2CCCCC2 Amb19075776 [0,0,1,1,0,0|1,0,1]=4 355 B15R2.2226 O=C(c1ccccc1)N2CCCN=C2 Amb24070849 [0,0,1,1,0,0|2,0,0]=4 356 B15R2.4382 CCCC1=NNC(=O)c2ccccc21 Amb22480117 [0,0,1,1,0,0|2,0,0]=4 357 B15R2.4382 CCCN1C=NC(=O)c2ccccc12 Amb22752706 [0,0,1,1,0,0|2,0,0]=4 358 B15R2.4382 CCCc1ccc(N)c2ccccc21 Amb23537837 [0,0,1,1,0,0|2,0,0]=4 359 B15R2.94 CC1CC=C(NC1=O)c2ccccc2 Amb24702071 [0,0,1,1,0,0|1,0,0]=3 360 B15R2.94 NC1CN=C(OC1=O)c2ccccc2 Amb25233629 [0,0,1,1,0,0|2,0,0]=4 361 B15R2.2248 CCC1N=C(NC1=O)c2ccccc2 Amb24405563 [0,0,1,1,0,0|2,0,0]=4 362 B15R2.24 CCC1COc2c(cccc21)C(O)=O Amb24381869 [0,0,1,1,0,0|1,0,1]=4 363 B15R2.24 CCc1c[nH]c2c(cccc21)C(O)=O Amb24090459 [0,0,1,1,0,0|1,0,1]=4 364 B15R2.529 CC1CC1Nc2ccccc2C(O)=O Amb18994644 [0,0,1,1,0,0|1,0,1]=4 365 B15R2.886 CCCC1=CC(=O)c2ccccc2N1 Amb19046468 [0,0,1,1,0,0|2,0,0]=4 366 B15R2.886 CCCC1=Cc2ccccc2C(=O)N1 Amb25366151 [0,0,1,1,0,0|1,0,0]=3 367 B15R2.886 CCCC1=Nc2ccccc2C(=O)O1 Amb21912814 [0,0,1,1,0,0|1,0,0]=3 368 B15R2.886 CCCC=1NC(=O)c2ccccc2N1 Amb20036216 [0,0,1,1,0,0|2,0,0]=4 369 B15R2.886 CCCc1[n]c2ccccc2c(O)[n]1 Amb18649928 [0,0,1,1,0,0|2,0,0]=4 370 B15R2.886 CCCc1cc2ccccc2c(N)c1 Amb25374124 [0,0,1,1,0,0|2,0,0]=4 371 B15R2.886 CCNC1=Cc2ccccc2C(=O)N1 Amb18950429 [0,0,1,1,0,0|2,0,0]=4 372 B15R2.886 CCOC1=Nc2ccccc2C(=O)O1 Amb21927635 [0,0,1,1,0,0|2,0,0]=4 373 B15R2.886 CCSC1=Nc2ccccc2C(=O)O1 Amb25381329 [0,0,1,1,0,0|2,0,0]=4 374 B15R2.886 OCCC1=Nc2ccccc2C(=O)O1 Amb25214583 [0,0,1,1,0,0|2,0,0]=4 375 B15R2.1221 CC(=O)c1ccccc1C=2CCCC2 Amb24356493 [0,0,1,1,0,0|1,0,0]=3 376 B15R2.1221 OC(=O)c1cc[n]cc1C=2CCCC2 Amb25095577 [0,0,1,1,0,0|1,0,0]=3 377 B15R2.1221 OC(=O)c1ccccc1C2=NCCO2 Amb18650722 [0,0,1,1,0,0|2,0,0]=4 378 B15R2.1221 OC(=O)c1ccccc1C2CCCN2 Amb25814336 [0,0,1,1,0,0|1,0,1]=4 379 B15R2.1221 OC(=O)c1ccccc1C2CCCO2 Amb23598819 [0,0,1,1,0,0|1,0,1]=4 380 B15R2.1221 OC(=O)c1ccccc1N2CCN=C2 Amb24756927 [0,0,1,1,0,0|2,0,0]=4 381 B15R2.1221 OC(=O)c1ccccc1[C@H]2CCCN2 Amb25082162 [0,0,1,1,0,0|1,0,1]=4 382 B15R2.13611 CC1CCCc2c1cccc2C(O)=O Amb24726295 [0,0,1,1,0,0|0,0,2]=4 383 B15R2.13611 CC1CCNc2c1cccc2C(O)=O Amb21943638 [0,0,1,1,0,0|1,0,1]=4 384 B15R2.13611 Cc1[n]ccc2c1cccc2C(O)=O Amb25061224 [0,0,1,1,0,0|1,0,1]=4 385 B15R2.13611 Cc1cccc2c1cccc2C(O)=O Amb18649282 [0,0,1,1,0,0|0,0,2]=4 386 B15R2.16319 OC(=O)c1ccccc1CNC2CC2 Amb24123137 [0,0,1,1,0,0|1,0,1]=4 387 B15R2.16320 OC(=O)c1ccccc1NC2CCC2 Amb18296811 [0,0,1,1,0,0|1,0,1]=4 388 B15R2.16320 OC(=O)c1ccccc1OC2CCC2 Amb18987377 [0,0,1,1,0,0|1,0,1]=4 389 B15R2.16320 OC(=O)c1ccccc1SC2CCC2 Amb25674990 [0,0,1,1,0,0|1,0,1]=4 390 B15R2.69020 OC(=O)c1cccc2CCCCCc21 Amb18819321 [0,0,1,1,0,0|0,0,2]=4 391 B15R2.2220 CCCc1ccc2c[n]ccc2c1O Amb24062954 [0,0,1,1,0,0|2,0,0]=4 392 B15R2.2220 CCOc1ccc2c(c1O)cccc2 Amb17200242 [0,0,1,1,0,0|2,0,0]=4 393 B15R2.2220 CSCc1ccc2ccccc2c1O Amb24467019 [0,0,1,1,0,0|2,0,0]=4 394 B15R2.2220 Cc1c2ccccc2c[n]c1CCC Amb25107719 [0,0,1,1,0,0|2,0,0]=4 395 B15R2.2220 NCCc1ccc2ccccc2c1O Amb18191126 [0,0,1,1,0,0|2,0,0]=4 396 B15R2.2220 Oc1c2ccccc2ccc1CCO Amb24731720 [0,0,1,1,0,0|2,0,0]=4 397 B15R2.4943 O[C@@]1(CCCN1)c2ccccc2C=O Amb24413886 [0,0,1,1,0,0|1,0,1]=4 398 B15R2.7340 CC1CNC(=O)c2ccccc2C1=O Amb24452179 [0,0,1,1,0,0|1,0,1]=4 399 B15R2.9978 CCCC1C(=O)c2ccccc2C1=O Amb25288819 [0,0,1,1,0,0|0,0,2]=4 400 B15R2.9978 CCCN1C(O)c2c(C1=O)cccc2 Amb1789719 [0,0,1,1,0,0|1,0,1]=4 401 B15R2.19973 CCc1cc(O)c2ccccc2c1O Amb18129766 [0,0,1,1,0,0|0,0,2]=4 402 B15R2.19973 Cc1c2ccccc2c(O)cc1CC Amb25066283 [0,0,1,1,0,0|1,0,1]=4 403 B15R2.32052 C=C(C1CCC1)c2ccccc2C=O Amb25815555 [0,0,1,1,0,0|1,0,1]=4 404 B15R2.11939 CCCc1cccc2C(=O)C(=O)Nc21 Amb19060340 [0,0,1,1,0,0|2,0,0]=4 405 B15R3.1736 C1NCC1c2occ3ccccc32 Amb25737107 [1,0,0,1,0,0|1,0,1]=4 406 B15R3.173 O=C1C2CCCC2c3ccccc31 Amb25370761 [1,0,0,1,0,0|1,0,1]=4 407 B15R3.173 O=C1c2ccccc2C3=CCCN31 Amb25770713 [1,0,0,1,0,0|1,0,0]=3 408 B15R3.173 O=C1c2ccccc2C=3CCCC31 Amb24492724 [1,0,0,1,0,0|1,0,0]=3 409 B15R3.14759 O=C1CC2CCCc3cccc1c32 Amb22059329 [1,0,0,1,0,0|1,0,1]=4 410 B17R3.35227 O=C1c2ccccc2N=C3CCCCN31 Amb19757029 [0,0,0,1,0,1|1,0,1]=4 411 B17R3.35227 O=C1c2ccccc2N=C3NCCCN31 Amb19524711 [0,0,0,1,0,1|2,0,0]=4 412 B17R3.35227 O=C1c2ccccc2N=C3OCCCN31 Amb20670077 [0,0,0,1,0,1|2,0,0]=4 413 B17R3.35227 O=C1c2ccccc2N=C3SCCCN31 Amb19667502 [0,0,0,1,0,1|2,0,0]=4 414 B17R3.35227 O=C1c2ccccc2NC=3CCCCC31 Amb19088951 [0,0,0,1,0,1|1,0,1]=4 415 B17R3.35227 O=C1c2ccccc2OC=3CCCCC31 Amb22364658 [0,0,0,1,0,1|1,0,1]=4 416 B17R3.31564 CC1CN=C2c3ccccc3NC(=O)N21 Amb24102375 [0,0,0,1,0,1|2,0,0]=4 417 B17R3.1109591 O=C1OC2(CNCCC2)c3ccccc31 Amb22395727 [0,1,0,1,0,0|0,0,2]=4 418 B17R3.1109591 O=C1OC2(CNCCC2)c3ccccc31 Amb22756629 [0,1,0,1,0,0|0,0,2]=4 419 B17R3.1109591 O=C1OC2(c3c1cccc3)CCNCC2 Amb13883017 [0,1,0,1,0,0|0,0,2]=4 420 B17R3.1109591 O=C1OC2(c3c1cccc3)CCNCC2 Amb13888627 [0,1,0,1,0,0|0,0,2]=4 421 B15R1.1188 CCCCOc1ccccc1CC(=O)O Amb2235653 [0,0,1,0,0,1|1,0,1]=4 422 B15R1.5925 CCCCC(=O)Oc1ccccc1C=O Amb17129214 [0,0,1,0,0,1|0,0,2]=4 423 B15R2.352 CCCCC1=Cc2ccccc2CO1 Amb24350496 [1,0,0,0,0,1|0,0,2]=4 424 B15R2.352 CCCNc1[n]c2ccccc2c[n]1 Amb25779187 [1,0,0,0,0,1|2,0,0]=4 425 B15R2.352 CCCOc1ccc2ccccc2[n]1 Amb20171237 [1,0,0,0,0,1|2,0,0]=4 426 B15R2.4392 CCCC1=CC(=O)Nc2ccccc21 Amb25727820 [1,0,0,0,0,1|1,0,0]=3 427 B15R2.4392 CCCC1=CC(=O)Oc2ccccc21 Amb22482594 [1,0,0,0,0,1|1,0,0]=3 428 B15R2.4392 CCCC1NC(=O)Cc2ccccc21 Amb25752823 [1,0,0,0,0,1|1,0,1]=4 429 B15R2.4392 CCCN1CC(=O)Nc2ccccc12 Amb24070635 [1,0,0,0,0,1|2,0,0]=4 430 B15R2.4392 CCCc1[n]c(Br)[n]c2ccccc21 Amb20618712 [1,0,0,0,0,1|2,0,0]=4 431 B15R2.4392 CCCc1[n]c(N)[n]c2ccccc21 Amb20618713 [1,0,0,0,0,1|2,0,0]=4 432 B15R2.4392 CCCc1cc(O)cc2ccccc21 Amb24612675 [1,0,0,0,0,1|1,0,1]=4 433 B15R2.4392 CCNC1=CC(=O)Oc2ccccc12 Amb21948595 [1,0,0,0,0,1|2,0,0]=4 434 B15R2.4392 CCOC1=CC(=O)Nc2ccccc12 Amb23533732 [1,0,0,0,0,1|2,0,0]=4 435 B15R2.4392 CCOC1=CC(=O)Oc2ccccc12 Amb18511489 [1,0,0,0,0,1|2,0,0]=4 436 B15R2.4392 CCOC1=CC(=O)Sc2ccccc12 Amb25699268 [1,0,0,0,0,1|2,0,0]=4 437 B15R2.4392 CCOc1cc(=O)oc2c1cccc2 Amb1967453 [1,0,0,0,0,1|2,0,0]=4 438 B15R2.4392 CCSC1=CC(=O)Oc2ccccc12 Amb24742601 [1,0,0,0,0,1|2,0,0]=4 439 B15R2.4392 CC\N=C/1\NC(=O)Oc2ccccc21 Amb25828424 [1,0,0,0,0,1|2,0,0]=4 440 B15R2.4392 CNCC1=CC(=O)Nc2ccccc12 Amb19904243 [1,0,0,0,0,1|2,0,0]=4 441 B15R2.4392 COCC=1NC(=O)C=C2C=CC=CC21 Amb25253332 [1,0,0,0,0,1|2,0,0]=4 442 B15R2.4392 CSCC1=CC(=O)Nc2ccccc21 Amb25840363 [1,0,0,0,0,1|2,0,0]=4 443 B15R2.4392 NCCC1=CC(=O)Nc2ccccc21 Amb18560584 [1,0,0,0,0,1|2,0,0]=4 444 B15R2.4392 NCCC1=CC(=O)Oc2ccccc21 Amb18560586 [1,0,0,0,0,1|2,0,0]=4 445 B15R2.4392 O=C1C=C(CCCl)c2ccccc2N1 Amb24719031 [1,0,0,0,0,1|2,0,0]=4 446 B15R2.4392 OCCC1=CC(=O)Nc2ccccc21 Amb23448566 [1,0,0,0,0,1|2,0,0]=4