0 B13R2.3 C1=NCC(CN1)c2ccccc2 Amb16210072 [0,0,0,0,0,0|4,0,0]=4 1 B13R2.3 C1C=CCC(N1)c2c[n]ccc2 Amb19130519 [0,0,0,0,0,0|0,0,0]=0 2 B13R2.3 C1C=CCC(N1)c2cc[n]cc2 Amb24742394 [0,0,0,0,0,0|2,0,0]=2 3 B13R2.3 C1C=CCC(N1)c2ccccc2 Amb25827021 [0,0,0,0,0,0|1,0,0]=1 4 B13R2.3 C1C=CCC(O1)c2ccccc2 Amb25276707 [0,0,0,0,0,0|2,0,0]=2 5 B13R2.3 C1C=CCCC1c2ccccc2 Amb22731850 [0,0,0,0,0,0|2,0,0]=2 6 B13R2.3 C1C=CCCN1c2c[n]cc[n]2 Amb24346523 [0,0,0,0,0,0|3,0,0]=3 7 B13R2.3 C1C=CCCN1c2ccc[n][n]2 Amb24675241 [0,0,0,0,0,0|3,0,0]=3 8 B13R2.3 C1C=CC[C@@H](N1)c2c[n]ccc2 Amb22801091 [0,0,0,0,0,0|0,0,0]=0 9 B13R2.3 C1C=CC[C@H](N1)c2ccccc2 Amb25047356 [0,0,0,0,0,0|1,0,0]=1 10 B13R2.3 C1C=CN=C(N1)c2ccccc2 Amb24399304 [0,0,0,0,0,0|2,0,1]=3 11 B13R2.3 C1CC(C=CN1)c2ccccc2 Amb25374926 [0,0,0,0,0,0|3,0,1]=4 12 B13R2.3 C1CC(C=C[NH2+]1)c2ccccc2 Amb24080270 [0,0,0,0,0,0|3,0,1]=4 13 B13R2.3 C1CC(CCN1)c2c[n]c[n]c2 Amb18280659 [0,0,0,0,0,0|3,0,1]=4 14 B13R2.3 C1CC(CCN1)c2c[n]cc[n]2 Amb18829168 [0,0,0,0,0,0|3,0,1]=4 15 B13R2.3 C1CC(CCN1)c2c[n]cc[n]2 Amb24323188 [0,0,0,0,0,0|3,0,1]=4 16 B13R2.3 C1CC(CCN1)c2c[n]ccc2 Amb22756469 [0,0,0,0,0,0|2,0,1]=3 17 B13R2.3 C1CC(CCN1)c2c[n]ccc2 Amb22756575 [0,0,0,0,0,0|2,0,1]=3 18 B13R2.3 C1CC(CCN1)c2c[n]ccc2 Amb24323180 [0,0,0,0,0,0|2,0,1]=3 19 B13R2.3 C1CC(CCN1)c2ccc[n][n]2 Amb23598540 [0,0,0,0,0,0|3,0,1]=4 20 B13R2.3 C1CC(CCN1)c2ccccc2 Amb22491685 [0,0,0,0,0,0|3,0,1]=4 21 B13R2.3 C1CC(CCO1)c2c[n]ccc2 Amb24320765 [0,0,0,0,0,0|2,0,1]=3 22 B13R2.3 C1CC(CCO1)c2ccccc2 Amb21856446 [0,0,0,0,0,0|3,0,1]=4 23 B13R2.3 C1CC=CC(C1)c2cncnc2 Amb13890749 [0,0,0,0,0,0|2,0,2]=4 24 B13R2.3 C1CCC(C=C1)c2cccnc2 Amb13890748 [0,0,0,0,0,0|1,0,2]=3 25 B13R2.3 C1CCC(CN1)c2ccccc2 Amb1995213 [0,0,0,0,0,0|3,0,1]=4 26 B13R2.3 C1CCC(CN1)c2ccccc2 Amb2236473 [0,0,0,0,0,0|3,0,1]=4 27 B13R2.3 C1CCC(CS1)c2ccccc2 Amb16764110 [0,0,0,0,0,0|3,0,1]=4 28 B13R2.3 C1CCC(NC1)c2ccccc2 Amb10068914 [0,0,0,0,0,0|1,0,2]=3 29 B13R2.3 C1CCC(NC1)c2ccccc2 Amb1945350 [0,0,0,0,0,0|1,0,2]=3 30 B13R2.3 C1CCC(NC1)c2ccccn2 Amb10576617 [0,0,0,0,0,0|2,0,2]=4 31 B13R2.3 C1CCC(NC1)c2ccccn2 Amb2234698 [0,0,0,0,0,0|2,0,2]=4 32 B13R2.3 C1CCC(NC1)c2ccccn2 Amb2237208 [0,0,0,0,0,0|2,0,2]=4 33 B13R2.3 C1CCC(NC1)c2cccnc2 Amb1007730 [0,0,0,0,0,0|0,0,2]=2 34 B13R2.3 C1CCC(NC1)c2cccnc2 Amb2234656 [0,0,0,0,0,0|0,0,2]=2 35 B13R2.3 C1CCC(NC1)c2ccncc2 Amb1837043 [0,0,0,0,0,0|2,0,2]=4 36 B13R2.3 C1CCC(NC1)c2cnccn2 Amb17756919 [0,0,0,0,0,0|1,0,2]=3 37 B13R2.3 C1CCC(OC1)c2ccccc2 Amb10558590 [0,0,0,0,0,0|2,0,2]=4 38 B13R2.3 C1CCC(SC1)c2ccccc2 Amb16755477 [0,0,0,0,0,0|2,0,2]=4 39 B13R2.3 C1CCCC(N1)c2c[n]c[n]c2 Amb18280973 [0,0,0,0,0,0|1,0,2]=3 40 B13R2.3 C1CCCC(N1)c2c[n]cc[n]2 Amb21960177 [0,0,0,0,0,0|1,0,2]=3 41 B13R2.3 C1CCCC(N1)c2c[n]ccc2 Amb17659186 [0,0,0,0,0,0|0,0,2]=2 42 B13R2.3 C1CCCC(N1)c2c[n]ccc2 Amb22741090 [0,0,0,0,0,0|0,0,2]=2 43 B13R2.3 C1CCCC(N1)c2cc[n]cc2 Amb17659185 [0,0,0,0,0,0|2,0,2]=4 44 B13R2.3 C1CCCC(N1)c2cc[n]cc2 Amb22751945 [0,0,0,0,0,0|2,0,2]=4 45 B13R2.3 C1CCCCC1c2c[n]c[n]c2 Amb24439529 [0,0,0,0,0,0|2,0,2]=4 46 B13R2.3 C1CCCCN1c2c[n]ccc2 Amb18268276 [0,0,0,0,0,0|2,0,2]=4 47 B13R2.3 C1CCCN(N1)c2c[n]cc[n]2 Amb24630496 [0,0,0,0,0,0|2,0,2]=4 48 B13R2.3 C1CCCNC1c2c[n]c[n][n]2 Amb25071485 [0,0,0,0,0,0|2,0,2]=4 49 B13R2.3 C1CCC[C@@H](N1)c2c[n]c[n]c2 Amb25824677 [0,0,0,0,0,0|1,0,2]=3 50 B13R2.3 C1CCC[C@@H](N1)c2c[n]cc[n]2 Amb24643071 [0,0,0,0,0,0|1,0,2]=3 51 B13R2.3 C1CCC[C@@H](N1)c2cccc[n]2 Amb22751938 [0,0,0,0,0,0|2,0,2]=4 52 B13R2.3 C1CCC[C@@H](N1)c2ccccc2 Amb24181809 [0,0,0,0,0,0|1,0,2]=3 53 B13R2.3 C1CCC[C@H](N1)c2c[n][n]cc2 Amb24364783 [0,0,0,0,0,0|1,0,2]=3 54 B13R2.3 C1CCC[C@H](N1)c2c[n]c[n]c2 Amb25061988 [0,0,0,0,0,0|1,0,2]=3 55 B13R2.3 C1CCC[C@H](N1)c2c[n]cc[n]2 Amb25843317 [0,0,0,0,0,0|1,0,2]=3 56 B13R2.3 C1CCC[C@H](N1)c2cc[n]cc2 Amb24688654 [0,0,0,0,0,0|2,0,2]=4 57 B13R2.3 C1CCC[C@H](N1)c2ccccc2 Amb24471915 [0,0,0,0,0,0|1,0,2]=3 58 B13R2.3 C1CCOC(N1)c2ccccc2 Amb22901047 [0,0,0,0,0,0|2,0,2]=4 59 B13R2.3 C1CCSC(O1)c2c[n]ccc2 Amb25341455 [0,0,0,0,0,0|2,0,2]=4 60 B13R2.3 C1CC[C@@H](NC1)c2ccccc2 Amb10567815 [0,0,0,0,0,0|1,0,2]=3 61 B13R2.3 C1CC[C@@H](NC1)c2cccnc2 Amb16229320 [0,0,0,0,0,0|0,0,2]=2 62 B13R2.3 C1CC[C@H](NC1)c2cccnc2 Amb1043454 [0,0,0,0,0,0|0,0,2]=2 63 B13R2.3 C1CC[C@H](NC1)c2cccnc2 Amb10549378 [0,0,0,0,0,0|0,0,2]=2 64 B13R2.3 C1CC[C@H](NC1)c2cccnc2 Amb1980982 [0,0,0,0,0,0|0,0,2]=2 65 B13R2.3 C1CN(CCN1)c2c[n]ccc2 Amb19958646 [0,0,0,0,0,0|3,0,1]=4 66 B13R2.3 C1CN(CCO1)c2c[n]ccc2 Amb18930098 [0,0,0,0,0,0|3,0,1]=4 67 B13R2.3 C1CNC(CN1)c2cccnc2 Amb10068869 [0,0,0,0,0,0|1,0,1]=2 68 B13R2.3 C1CNC(CS1)c2cccnc2 Amb10068814 [0,0,0,0,0,0|1,0,1]=2 69 B13R2.3 C1CNC(OC1)c2ccccc2 Amb17334580 [0,0,0,0,0,0|2,0,2]=4 70 B13R2.3 C1CNC(OC1)c2cccnc2 Amb17334612 [0,0,0,0,0,0|1,0,2]=3 71 B13R2.3 C1COC(CN1)c2cccnc2 Amb10068842 [0,0,0,0,0,0|2,0,1]=3 72 B13R2.3 C1COC(OC1)c2cccnc2 Amb17334629 [0,0,0,0,0,0|2,0,2]=4 73 B13R2.3 C1CSC(CN1)c2cccnc2 Amb10068811 [0,0,0,0,0,0|2,0,1]=3 74 B13R2.3 C1CSC(CN1)c2cccnc2 Amb10808442 [0,0,0,0,0,0|2,0,1]=3 75 B13R2.3 C1NC=NCC1c2ccccc2 Amb22536298 [0,0,0,0,0,0|4,0,0]=4 76 B13R2.3 C1NCCC=C1c2c[n]ccc2 Amb25680273 [0,0,0,0,0,0|2,0,2]=4 77 B13R2.3 C1NCCCC1c2c[n]c[n]c2 Amb18829147 [0,0,0,0,0,0|3,0,1]=4 78 B13R2.3 C1NCCCC1c2c[n]cc[n]2 Amb18829158 [0,0,0,0,0,0|3,0,1]=4 79 B13R2.3 C1NCCCC1c2ccc[n][n]2 Amb24322580 [0,0,0,0,0,0|3,0,1]=4 80 B13R2.3 C1NCCC[C@@H]1c2c[n]ccc2 Amb25269640 [0,0,0,0,0,0|2,0,1]=3 81 B13R2.3 C1NCCC[C@@H]1c2ccccc2 Amb19888168 [0,0,0,0,0,0|3,0,1]=4 82 B13R2.3 C1NCCC[C@@H]1c2ccccc2 Amb22755507 [0,0,0,0,0,0|3,0,1]=4 83 B13R2.3 C1NCCC[C@H]1c2ccccc2 Amb19888364 [0,0,0,0,0,0|3,0,1]=4 84 B13R2.3 C1NCCNC1c2cc[n]cc2 Amb24319003 [0,0,0,0,0,0|3,0,1]=4 85 B13R2.3 C1NCCNC1c2cccc[n]2 Amb24319001 [0,0,0,0,0,0|3,0,1]=4 86 B13R2.3 C1NCCN[C@@H]1c2cccc[n]2 Amb25367203 [0,0,0,0,0,0|3,0,1]=4 87 B13R2.3 C1NCCN[C@H]1c2cccc[n]2 Amb24578772 [0,0,0,0,0,0|3,0,1]=4 88 B13R2.3 C1NCCN[C@H]1c2ccccc2 Amb25149925 [0,0,0,0,0,0|2,0,1]=3 89 B13R2.3 C1NCCOC1c2c[n]ccc2 Amb22034686 [0,0,0,0,0,0|2,0,1]=3 90 B13R2.3 C1NCCOC1c2c[n]ccc2 Amb22756462 [0,0,0,0,0,0|2,0,1]=3 91 B13R2.3 C1NCCO[C@@H]1c2ccccc2 Amb19889425 [0,0,0,0,0,0|3,0,1]=4 92 B13R2.3 C1NCCO[C@@H]1c2ccccc2 Amb22899094 [0,0,0,0,0,0|3,0,1]=4 93 B13R2.3 C1OCCCC1c2c[n]ccc2 Amb24320762 [0,0,0,0,0,0|2,0,1]=3 94 B13R2.3 C1OCCNC1c2c[n]c[n]c2 Amb18828319 [0,0,0,0,0,0|2,0,1]=3 95 B13R2.3 C1OCCNC1c2c[n]ccc2 Amb17934236 [0,0,0,0,0,0|1,0,1]=2 96 B13R2.3 C1OCCNC1c2cc[n]cc2 Amb18563619 [0,0,0,0,0,0|3,0,1]=4 97 B13R2.3 C1OCCNC1c2cccc[n]2 Amb18563618 [0,0,0,0,0,0|3,0,1]=4 98 B13R2.3 C1OCCNC1c2ccccc2 Amb18528726 [0,0,0,0,0,0|2,0,1]=3 99 B13R2.3 C1OCCN[C@@H]1c2c[n]ccc2 Amb22746806 [0,0,0,0,0,0|1,0,1]=2 100 B13R2.3 C1OCCN[C@@H]1c2cc[n]cc2 Amb22746815 [0,0,0,0,0,0|3,0,1]=4 101 B13R2.3 C1OCCN[C@@H]1c2cccc[n]2 Amb22746805 [0,0,0,0,0,0|3,0,1]=4 102 B13R2.3 C1OCCN[C@@H]1c2ccccc2 Amb20242902 [0,0,0,0,0,0|2,0,1]=3 103 B13R2.3 C1OCCN[C@@H]1c2ccccc2 Amb22274558 [0,0,0,0,0,0|2,0,1]=3 104 B13R2.3 C1OCCN[C@H]1c2c[n]cc[n]2 Amb24715812 [0,0,0,0,0,0|2,0,1]=3 105 B13R2.3 C1OCCN[C@H]1c2cc[n]cc2 Amb25324236 [0,0,0,0,0,0|3,0,1]=4 106 B13R2.3 C1OCCN[C@H]1c2ccccc2 Amb20242901 [0,0,0,0,0,0|2,0,1]=3 107 B13R2.3 C1OCCN[C@H]1c2ccccc2 Amb24077482 [0,0,0,0,0,0|2,0,1]=3 108 B13R2.3 C1OCCOC1c2ccccc2 Amb24487623 [0,0,0,0,0,0|3,0,1]=4 109 B13R2.3 C1O[C@@H](CCO1)c2ccccc2 Amb22226715 [0,0,0,0,0,0|3,0,1]=4 110 B13R2.3 C1SCCNC1c2c[n]c[n]c2 Amb18823966 [0,0,0,0,0,0|2,0,1]=3 111 B13R2.3 C1SCCNC1c2cc[n]cc2 Amb24549071 [0,0,0,0,0,0|3,0,1]=4 112 B13R2.3 C1SCCN[C@@H]1c2ccccc2 Amb24652809 [0,0,0,0,0,0|2,0,1]=3 113 B13R2.3 N1CCC(CC1)c2ccccc2 Amb1019521 [0,0,0,0,0,0|3,0,1]=4 114 B13R2.3 N1CCC(CC1)c2ccccc2 Amb2099643 [0,0,0,0,0,0|3,0,1]=4 115 B13R2.3 N1CCC(CC1)c2cccnc2 Amb16206185 [0,0,0,0,0,0|2,0,1]=3 116 B13R2.3 N1CCN(CC1)c2cccnc2 Amb10603457 [0,0,0,0,0,0|3,0,1]=4 117 B13R2.3 N1CCN(CC1)c2cccnc2 Amb1102180 [0,0,0,0,0,0|3,0,1]=4 118 B13R2.3 N1CCNC(C1)c2ccccc2 Amb10068867 [0,0,0,0,0,0|2,0,1]=3 119 B13R2.3 N1CCOC(C1)c2ccccc2 Amb1782012 [0,0,0,0,0,0|3,0,1]=4 120 B13R2.3 N1CCSC(C1)c2ccccc2 Amb10068810 [0,0,0,0,0,0|3,0,1]=4 121 B13R2.3 O1CCNC(C1)c2ccccc2 Amb10068848 [0,0,0,0,0,0|2,0,1]=3 122 B13R2.3 c1[n]cccc1-c2[n]ccc[n]2 Amb24562773 [0,0,0,0,0,0|1,0,3]=4 123 B13R2.3 c1ccc(cn1)C2=NCCCC2 Amb1981490 [0,0,0,0,0,0|0,0,4]=4 124 B13R2.3 c1ccc(cn1)C2=NCCCN2 Amb17578179 [0,0,0,0,0,0|1,0,3]=4 125 B13R2.3 c1ccc(nc1)c2cccnc2 Amb10066897 [0,0,0,0,0,0|0,0,4]=4 126 B14R2.21 BrC1CC(CCC1)c2ccc[n]c2 Amb25358153 [0,1,0,0,0,0|1,0,2]=4 127 B14R2.21 BrC=1CN(CCC1)c2c[n]cc[n]2 Amb25688453 [0,1,0,0,0,0|3,0,0]=4 128 B14R2.21 Brc1cc(c[n]c1)C2CCCCC2 Amb20617720 [0,1,0,0,0,0|1,0,2]=4 129 B14R2.21 Brc1cc(c[n]c1)C2CCCCN2 Amb24179223 [0,1,0,0,0,0|0,0,2]=3 130 B14R2.21 Brc1cc(c[n]c1)C2CCCCO2 Amb24322634 [0,1,0,0,0,0|1,0,2]=4 131 B14R2.21 Brc1cc(c[n]c1)C2CCOCC2 Amb24320305 [0,1,0,0,0,0|2,0,1]=4 132 B14R2.21 Brc1cc(c[n]c1)C2CNCCC2 Amb24082807 [0,1,0,0,0,0|2,0,1]=4 133 B14R2.21 Brc1cc(c[n]c1)C2CNCCN2 Amb24319005 [0,1,0,0,0,0|1,0,1]=3 134 B14R2.21 Brc1cc(c[n]c1)C2CNCCO2 Amb24320757 [0,1,0,0,0,0|2,0,1]=4 135 B14R2.21 Brc1cc(c[n]c1)C2COCCC2 Amb24320759 [0,1,0,0,0,0|2,0,1]=4 136 B14R2.21 Brc1cc(c[n]c1)C2COCCO2 Amb24320758 [0,1,0,0,0,0|2,0,1]=4 137 B14R2.21 Brc1cc(c[n]c1)N2CCCCN2 Amb25281039 [0,1,0,0,0,0|1,0,2]=4 138 B14R2.21 Brc1cc(c[n]c1)[C@H]2CCCCN2 Amb25790432 [0,1,0,0,0,0|0,0,2]=3 139 B14R2.21 Brc1cc(c[n]c1)[C@H]2COCCN2 Amb25301502 [0,1,0,0,0,0|1,0,1]=3 140 B14R2.21 Brc1cc(ccc1)C2CCCCN2 Amb17659208 [0,1,0,0,0,0|1,0,2]=4 141 B14R2.21 Brc1cc(ccc1)C2CSCCN2 Amb24739224 [0,1,0,0,0,0|2,0,1]=4 142 B14R2.21 Brc1cc(ccc1)[C@@H]2CCCCN2 Amb24444941 [0,1,0,0,0,0|1,0,2]=4 143 B14R2.21 Brc1cccc(c1)C2CCCCN2 Amb2234935 [0,1,0,0,0,0|1,0,2]=4 144 B14R2.21 Brc1cncc(c1)C2CCCCN2 Amb2234925 [0,1,0,0,0,0|0,0,2]=3 145 B14R2.21 CC1C=CCC(N1)c2ccccc2 Amb25034556 [0,1,0,0,0,0|1,0,0]=2 146 B14R2.21 CC1C=CN=C(N1)c2ccccc2 Amb24461864 [0,1,0,0,0,0|2,0,1]=4 147 B14R2.21 CC1CC(NCC1)c2ccccc2 Amb24066154 [0,1,0,0,0,0|1,0,2]=4 148 B14R2.21 CC1CC=CC(N1)c2ccccc2 Amb18127123 [0,1,0,0,0,0|1,0,2]=4 149 B14R2.21 CC1CNCC(O1)c2cccnc2 Amb17138873 [0,1,0,0,0,0|2,0,1]=4 150 B14R2.21 CC1COCC(N1)c2ccccc2 Amb18065682 [0,1,0,0,0,0|2,0,1]=4 151 B14R2.21 CC1NC(CCS1)c2ccccc2 Amb25766531 [0,1,0,0,0,0|2,0,1]=4 152 B14R2.21 CC=1CC(NCC1)c2ccccc2 Amb25046867 [0,1,0,0,0,0|1,0,0]=2 153 B14R2.21 CC=1CC(OCC1)c2ccccc2 Amb24066155 [0,1,0,0,0,0|2,0,0]=3 154 B14R2.21 CC=1CN(CCC1)c2ccc[n][n]2 Amb25226158 [0,1,0,0,0,0|3,0,0]=4 155 B14R2.21 CN1CC(NCC1)c2c[n]c[n]c2 Amb18195110 [0,1,0,0,0,0|2,0,1]=4 156 B14R2.21 CN1CC(NCC1)c2ccccc2 Amb24064755 [0,1,0,0,0,0|2,0,1]=4 157 B14R2.21 CN1CCNC(C1)c2ccccc2 Amb1672626 [0,1,0,0,0,0|2,0,1]=4 158 B14R2.21 CN1C[C@@H](NCC1)c2ccccc2 Amb22032546 [0,1,0,0,0,0|2,0,1]=4 159 B14R2.21 C[C@@H]1CC=C[C@@H](N1)c2ccccc2 Amb24598902 [0,1,0,0,0,0|1,0,2]=4 160 B14R2.21 C[C@@H]1CCC[C@@H](N1)c2ccccc2 Amb24710306 [0,1,0,0,0,0|1,0,2]=4 161 B14R2.21 C[C@@H]1N[C@@H](CCS1)c2ccccc2 Amb24602392 [0,1,0,0,0,0|2,0,1]=4 162 B14R2.21 C[C@H]1CC=C[C@@H](N1)c2ccccc2 Amb25366489 [0,1,0,0,0,0|1,0,2]=4 163 B14R2.21 C[C@H]1CC=C[C@H](N1)c2ccccc2 Amb24578815 [0,1,0,0,0,0|1,0,2]=4 164 B14R2.21 C[C@H]1CCC[C@@H](N1)c2ccccc2 Amb25224330 [0,1,0,0,0,0|1,0,2]=4 165 B14R2.21 C[C@H]1C[C@H](NCC1)c2ccccc2 Amb24436064 [0,1,0,0,0,0|1,0,2]=4 166 B14R2.21 Cc1cc(c[n]c1)C2CCCCN2 Amb24467616 [0,1,0,0,0,0|0,0,2]=3 167 B14R2.21 Cc1cc(c[n]c1)[C@@H]2CNCCN2 Amb25817525 [0,1,0,0,0,0|1,0,1]=3 168 B14R2.21 Cc1cc(c[n]c1)[C@H]2CCCCN2 Amb25111616 [0,1,0,0,0,0|0,0,2]=3 169 B14R2.21 Cc1cc(ccc1)[C@@H]2CCCCN2 Amb24386070 [0,1,0,0,0,0|1,0,2]=4 170 B14R2.21 Cc1cc(ccc1)[C@@H]2COCCN2 Amb25791132 [0,1,0,0,0,0|2,0,1]=4 171 B14R2.21 Cc1cc(ccc1)[C@H]2CCCCN2 Amb24428747 [0,1,0,0,0,0|1,0,2]=4 172 B14R2.21 Cc1cccc(c1)C2CCCCN2 Amb2235540 [0,1,0,0,0,0|1,0,2]=4 173 B14R2.21 ClC1CC(NCC1)c2ccccc2 Amb24652601 [0,1,0,0,0,0|1,0,2]=4 174 B14R2.21 Clc1cc(c[n]c1)C2CCNCC2 Amb24320881 [0,1,0,0,0,0|2,0,1]=4 175 B14R2.21 Clc1cc(c[n]c1)C2COCCN2 Amb24698381 [0,1,0,0,0,0|1,0,1]=3 176 B14R2.21 Clc1cc(c[n]c1)[C@@H]2COCCN2 Amb25112023 [0,1,0,0,0,0|1,0,1]=3 177 B14R2.21 Clc1cc(c[n]c1)[C@H]2CNCCN2 Amb25084537 [0,1,0,0,0,0|1,0,1]=3 178 B14R2.21 Clc1cc(ccc1)C2CSCCN2 Amb19889624 [0,1,0,0,0,0|2,0,1]=4 179 B14R2.21 Clc1cc(ccc1)[C@H]2CCCCN2 Amb25142453 [0,1,0,0,0,0|1,0,2]=4 180 B14R2.21 Clc1cccc(c1)C2CCCCN2 Amb2235156 [0,1,0,0,0,0|1,0,2]=4 181 B14R2.21 Fc1cc(c[n]c1)C2CCCCN2 Amb18949214 [0,1,0,0,0,0|0,0,2]=3 182 B14R2.21 Fc1cc(c[n]c1)C2CCNCC2 Amb18280660 [0,1,0,0,0,0|2,0,1]=4 183 B14R2.21 Fc1cc(c[n]c1)C2CNCCC2 Amb25039493 [0,1,0,0,0,0|2,0,1]=4 184 B14R2.21 Fc1cc(c[n]c1)C2CNCCN2 Amb24341409 [0,1,0,0,0,0|1,0,1]=3 185 B14R2.21 Fc1cc(c[n]c1)[C@@H]2CNCCN2 Amb25791636 [0,1,0,0,0,0|1,0,1]=3 186 B14R2.21 Fc1cc(ccc1)C2COCCN2 Amb18065995 [0,1,0,0,0,0|2,0,1]=4 187 B14R2.21 Fc1cc(ccc1)C2CSCCN2 Amb25088202 [0,1,0,0,0,0|2,0,1]=4 188 B14R2.21 Fc1cc(ccc1)[C@@H]2CCCCN2 Amb25039514 [0,1,0,0,0,0|1,0,2]=4 189 B14R2.21 Fc1cc(ccc1)[C@H]2CNCCN2 Amb24453197 [0,1,0,0,0,0|2,0,1]=4 190 B14R2.21 Fc1cccc(c1)C2CCCCN2 Amb2234655 [0,1,0,0,0,0|1,0,2]=4 191 B14R2.21 Ic1cc(c[n]c1)C2CCNCC2 Amb24534235 [0,1,0,0,0,0|2,0,1]=4 192 B14R2.21 Ic1cc(c[n]c1)C2COCCN2 Amb25726388 [0,1,0,0,0,0|1,0,1]=3 193 B14R2.21 Ic1cc(c[n]c1)[C@H]2CNCCN2 Amb25063084 [0,1,0,0,0,0|1,0,1]=3 194 B14R2.21 Ic1cc(ccc1)[C@@H]2CCCCN2 Amb24728169 [0,1,0,0,0,0|1,0,2]=4 195 B14R2.21 Ic1cc(ccc1)[C@@H]2CNCCN2 Amb25096269 [0,1,0,0,0,0|2,0,1]=4 196 B14R2.21 Ic1cc(ccc1)[C@@H]2COCCN2 Amb24468818 [0,1,0,0,0,0|2,0,1]=4 197 B14R2.21 Ic1cc(ccc1)[C@H]2CCCCN2 Amb25096292 [0,1,0,0,0,0|1,0,2]=4 198 B14R2.21 Ic1cc(ccc1)[C@H]2COCCN2 Amb24691378 [0,1,0,0,0,0|2,0,1]=4 199 B14R2.21 Ic1cccc(c1)C2CCCCN2 Amb2234962 [0,1,0,0,0,0|1,0,2]=4 200 B14R2.21 NC1CC(CCC1)c2ccc[n]c2 Amb25095656 [0,1,0,0,0,0|1,0,2]=4 201 B14R2.21 NC1CC(NCC1)c2ccccc2 Amb25160938 [0,1,0,0,0,0|1,0,2]=4 202 B14R2.21 NN1CC(OCC1)c2c[n]ccc2 Amb18065841 [0,1,0,0,0,0|2,0,1]=4 203 B14R2.21 Nc1cc(c[n]c1)C2CCCCC2 Amb18196504 [0,1,0,0,0,0|1,0,2]=4 204 B14R2.21 Nc1cc(c[n]c1)C2CCCCN2 Amb24674075 [0,1,0,0,0,0|0,0,2]=3 205 B14R2.21 Nc1cc(c[n]c1)C2CCCCO2 Amb24322635 [0,1,0,0,0,0|1,0,2]=4 206 B14R2.21 Nc1cc(c[n]c1)C2CCNCC2 Amb24320796 [0,1,0,0,0,0|2,0,1]=4 207 B14R2.21 Nc1cc(c[n]c1)C2CCOCC2 Amb24320306 [0,1,0,0,0,0|2,0,1]=4 208 B14R2.21 Nc1cc(c[n]c1)C2CNCCC2 Amb24322559 [0,1,0,0,0,0|2,0,1]=4 209 B14R2.21 Nc1cc(c[n]c1)C2CNCCN2 Amb25311050 [0,1,0,0,0,0|1,0,1]=3 210 B14R2.21 Nc1cc(c[n]c1)C2COCCN2 Amb25320253 [0,1,0,0,0,0|1,0,1]=3 211 B14R2.21 Nc1cc(c[n]c1)C2COCCO2 Amb24318976 [0,1,0,0,0,0|2,0,1]=4 212 B14R2.21 Nc1cc(c[n]c1)[C@H]2CNCCN2 Amb24715858 [0,1,0,0,0,0|1,0,1]=3 213 B14R2.21 Nc1cc(ccc1)C2CCCCN2 Amb24763650 [0,1,0,0,0,0|1,0,2]=4 214 B14R2.21 Nc1cc(ccc1)C2CNCCN2 Amb24094193 [0,1,0,0,0,0|2,0,1]=4 215 B14R2.21 Nc1cc(ccc1)C2COCCN2 Amb24578762 [0,1,0,0,0,0|2,0,1]=4 216 B14R2.21 Nc1cc(ccc1)N2CCC=CC2 Amb24607515 [0,1,0,0,0,0|3,0,0]=4 217 B14R2.21 Nc1cc(ccc1)[C@@H]2CNCCN2 Amb24730820 [0,1,0,0,0,0|2,0,1]=4 218 B14R2.21 Nc1cc(ccc1)[C@@H]2COCCN2 Amb25298618 [0,1,0,0,0,0|2,0,1]=4 219 B14R2.21 Nc1cc(ccc1)[C@H]2CCCCN2 Amb25700351 [0,1,0,0,0,0|1,0,2]=4 220 B14R2.21 Nc1cc(ccc1)[C@H]2CNCCN2 Amb24683851 [0,1,0,0,0,0|2,0,1]=4 221 B14R2.21 O=C1C=CCC(N1)c2ccc[n]c2 Amb25315170 [0,1,0,0,0,0|0,0,1]=2 222 B14R2.21 O=C1C=CCC(N1)c2ccccc2 Amb25309660 [0,1,0,0,0,0|1,0,1]=3 223 B14R2.21 O=C1C=CC[C@@H](N1)c2ccccc2 Amb25201635 [0,1,0,0,0,0|1,0,1]=3 224 B14R2.21 O=C1C=CC[C@@H](O1)c2ccccc2 Amb25157497 [0,1,0,0,0,0|2,0,1]=4 225 B14R2.21 O=C1CC(CC=C1)c2ccccc2 Amb23443331 [0,1,0,0,0,0|2,0,1]=4 226 B14R2.21 O=C1CC(CCC1)c2ccc[n]c2 Amb24553703 [0,1,0,0,0,0|1,0,1]=3 227 B14R2.21 O=C1CC(CCC1)c2ccccc2 Amb18065540 [0,1,0,0,0,0|2,0,1]=4 228 B14R2.21 O=C1CC(CCN1)c2ccccc2 Amb20171612 [0,1,0,0,0,0|3,0,0]=4 229 B14R2.21 O=C1CC(CCO1)c2ccccc2 Amb22499444 [0,1,0,0,0,0|3,0,0]=4 230 B14R2.21 O=C1CC(NC=C1)c2cccc[n]2 Amb24428922 [0,1,0,0,0,0|2,0,1]=4 231 B14R2.21 O=C1CC(NCC1)c2c[n]c[n]c2 Amb18196098 [0,1,0,0,0,0|1,0,1]=3 232 B14R2.21 O=C1CC(NCC1)c2c[n]cc[n]2 Amb18196097 [0,1,0,0,0,0|1,0,1]=3 233 B14R2.21 O=C1CC(NCC1)c2cc[n]cc2 Amb18196727 [0,1,0,0,0,0|2,0,1]=4 234 B14R2.21 O=C1CC(NCC1)c2cccc[n]2 Amb18196728 [0,1,0,0,0,0|2,0,1]=4 235 B14R2.21 O=C1CC(NCC1)c2ccccc2 Amb22274020 [0,1,0,0,0,0|1,0,1]=3 236 B14R2.21 O=C1CC(OC=C1)c2ccc[n]c2 Amb25374871 [0,1,0,0,0,0|1,0,1]=3 237 B14R2.21 O=C1CC(OCC1)c2ccc[n]c2 Amb23586184 [0,1,0,0,0,0|1,0,1]=3 238 B14R2.21 O=C1CC(OCC1)c2ccccc2 Amb19957821 [0,1,0,0,0,0|2,0,1]=4 239 B14R2.21 O=C1CCNC(C1)c2ccccc2 Amb17233086 [0,1,0,0,0,0|1,0,1]=3 240 B14R2.21 O=C1CCNC(C1)c2cccnc2 Amb17233193 [0,1,0,0,0,0|0,0,1]=2 241 B14R2.21 O=C1COCC(N1)c2ccc[n]c2 Amb25125963 [0,1,0,0,0,0|1,0,2]=4 242 B14R2.21 O=C1COC[C@@H](N1)c2ccc[n]c2 Amb25704205 [0,1,0,0,0,0|1,0,2]=4 243 B14R2.21 O=C1COC[C@H](N1)c2ccc[n]c2 Amb25687602 [0,1,0,0,0,0|1,0,2]=4 244 B14R2.21 O=C1C[C@@H](CC=C1)c2ccccc2 Amb24492589 [0,1,0,0,0,0|2,0,1]=4 245 B14R2.21 O=C1C[C@@H](CCC1)c2ccccc2 Amb22745610 [0,1,0,0,0,0|2,0,1]=4 246 B14R2.21 O=C1C[C@@H](CCO1)c2ccccc2 Amb25113432 [0,1,0,0,0,0|3,0,0]=4 247 B14R2.21 O=C1C[C@@H](NC=C1)c2ccccc2 Amb25732040 [0,1,0,0,0,0|1,0,1]=3 248 B14R2.21 O=C1C[C@@H](OC=C1)c2ccccc2 Amb25785647 [0,1,0,0,0,0|2,0,1]=4 249 B14R2.21 O=C1C[C@@H](OCC1)c2ccccc2 Amb22748229 [0,1,0,0,0,0|2,0,1]=4 250 B14R2.21 O=C1C[C@H](CC=C1)c2ccccc2 Amb25373085 [0,1,0,0,0,0|2,0,1]=4 251 B14R2.21 O=C1C[C@H](CCN1)c2ccccc2 Amb25191711 [0,1,0,0,0,0|3,0,0]=4 252 B14R2.21 O=C1C[C@H](NC=C1)c2ccccc2 Amb25858746 [0,1,0,0,0,0|1,0,1]=3 253 B14R2.21 O=C1C[C@H](OCC1)c2ccccc2 Amb24408429 [0,1,0,0,0,0|2,0,1]=4 254 B14R2.21 O=C1N[C@H](CCO1)c2ccc[n]c2 Amb25156419 [0,1,0,0,0,0|1,0,2]=4 255 B14R2.21 O=S1CC(NCC1)c2ccccc2 Amb19374300 [0,1,0,0,0,0|2,0,1]=4 256 B14R2.21 OC1C=CCC(O1)c2ccccc2 Amb25332318 [0,1,0,0,0,0|2,0,0]=3 257 B14R2.21 OC1CC(CCC1)c2ccc[n]c2 Amb25799939 [0,1,0,0,0,0|1,0,2]=4 258 B14R2.21 OC1CC(NCC1)c2ccccc2 Amb22035160 [0,1,0,0,0,0|1,0,2]=4 259 B14R2.21 OC1CC(OC=C1)c2ccccc2 Amb25077998 [0,1,0,0,0,0|3,0,0]=4 260 B14R2.21 OC1CCNC(C1)c2ccccc2 Amb17233271 [0,1,0,0,0,0|1,0,2]=4 261 B14R2.21 OC1CCNC(C1)c2cccnc2 Amb17233437 [0,1,0,0,0,0|0,0,2]=3 262 B14R2.21 OC1CN(CC=C1)c2ccccc2 Amb24544573 [0,1,0,0,0,0|3,0,0]=4 263 B14R2.21 O[C@@H]1C[C@@H](OC=C1)c2ccccc2 Amb24714697 [0,1,0,0,0,0|3,0,0]=4 264 B14R2.21 O[C@@H]1C[C@H](CC=C1)c2ccccc2 Amb25296419 [0,1,0,0,0,0|2,0,0]=3 265 B14R2.21 O[C@@H]1C[C@H](NCC1)c2ccccc2 Amb24564463 [0,1,0,0,0,0|1,0,2]=4 266 B14R2.21 O[C@H]1C[C@@H](NCC1)c2ccccc2 Amb25351515 [0,1,0,0,0,0|1,0,2]=4 267 B14R2.21 O[C@H]1C[C@H](NCC1)c2ccccc2 Amb25253500 [0,1,0,0,0,0|1,0,2]=4 268 B14R2.21 Oc1cc(c[n]c1)C2CCCCC2 Amb20617721 [0,1,0,0,0,0|1,0,2]=4 269 B14R2.21 Oc1cc(c[n]c1)C2CCCCN2 Amb25328551 [0,1,0,0,0,0|0,0,2]=3 270 B14R2.21 Oc1cc(c[n]c1)C2CCNCC2 Amb24320797 [0,1,0,0,0,0|2,0,1]=4 271 B14R2.21 Oc1cc(c[n]c1)C2CCOCC2 Amb24320308 [0,1,0,0,0,0|2,0,1]=4 272 B14R2.21 Oc1cc(c[n]c1)C2CNCCC2 Amb24323219 [0,1,0,0,0,0|2,0,1]=4 273 B14R2.21 Oc1cc(c[n]c1)C2COCCN2 Amb24453249 [0,1,0,0,0,0|1,0,1]=3 274 B14R2.21 Oc1cc(c[n]c1)[C@@H]2CNCCN2 Amb25368261 [0,1,0,0,0,0|1,0,1]=3 275 B14R2.21 Oc1cc(c[n]c1)[C@H]2CCCCN2 Amb25104730 [0,1,0,0,0,0|0,0,2]=3 276 B14R2.21 Oc1cc(ccc1)C2CCCCN2 Amb25068507 [0,1,0,0,0,0|1,0,2]=4 277 B14R2.21 Oc1cc(ccc1)C2COCCN2 Amb25836410 [0,1,0,0,0,0|2,0,1]=4 278 B14R2.21 Oc1cc(ccc1)[C@H]2COCCN2 Amb24745512 [0,1,0,0,0,0|2,0,1]=4 279 B14R2.21 Oc1cccc(c1)C2CNCCN2 Amb10982519 [0,1,0,0,0,0|2,0,1]=4 280 B14R2.21 S=C1C=CC=C(N1)c2c[n]ccc2 Amb25265918 [0,1,0,0,0,0|0,0,3]=4 281 B14R2.21 S=C1C=CCC(N1)c2ccccc2 Amb25301424 [0,1,0,0,0,0|1,0,1]=3 282 B14R2.21 S=C1C=CN=C(N1)c2c[n]ccc2 Amb25345933 [0,1,0,0,0,0|1,0,2]=4 283 B14R2.21 Sc1cc(ccc1)C2CCCCN2 Amb24427284 [0,1,0,0,0,0|1,0,2]=4 284 B14R2.21 Sc1cc(ccc1)[C@@H]2CCCCN2 Amb24587757 [0,1,0,0,0,0|1,0,2]=4 285 B14R2.21 Sc1cc(ccc1)[C@H]2CCCCN2 Amb25141955 [0,1,0,0,0,0|1,0,2]=4 286 B14R2.21 Sc1cc(ccc1)[C@H]2COCCN2 Amb24571210 [0,1,0,0,0,0|2,0,1]=4 287 B14R2.21 [O-][n+]1cccc(c1)C2CCCCN2 Amb17594553 [0,1,0,0,0,0|0,0,3]=4 288 B14R2.24 BrC1CCCCC1c2ccc[n]c2 Amb25363017 [0,1,0,0,0,0|1,0,2]=4 289 B14R2.24 Brc1[n]cccc1C2CCCCC2 Amb24319284 [0,1,0,0,0,0|1,0,2]=4 290 B14R2.24 Brc1[n]cccc1C2CCCCO2 Amb24322642 [0,1,0,0,0,0|1,0,2]=4 291 B14R2.24 Brc1[n]cccc1C2CNCCC2 Amb24322560 [0,1,0,0,0,0|2,0,1]=4 292 B14R2.24 Brc1[n]cccc1C2CNCCN2 Amb25327403 [0,1,0,0,0,0|1,0,1]=3 293 B14R2.24 Brc1[n]cccc1C2CNCCO2 Amb25224329 [0,1,0,0,0,0|2,0,1]=4 294 B14R2.24 Brc1[n]cccc1C2COCCO2 Amb24318984 [0,1,0,0,0,0|2,0,1]=4 295 B14R2.24 Brc1[n]cccc1[C@@H]2CNCCN2 Amb24468894 [0,1,0,0,0,0|1,0,1]=3 296 B14R2.24 Brc1[n]cccc1[C@H]2COCCN2 Amb24597014 [0,1,0,0,0,0|1,0,1]=3 297 B14R2.24 Brc1cc[n]cc1C2CCCCC2 Amb20617518 [0,1,0,0,0,0|1,0,2]=4 298 B14R2.24 Brc1cc[n]cc1C2CCCCN2 Amb25804188 [0,1,0,0,0,0|0,0,2]=3 299 B14R2.24 Brc1cc[n]cc1C2CCCCO2 Amb24322640 [0,1,0,0,0,0|1,0,2]=4 300 B14R2.24 Brc1cc[n]cc1C2CCNCC2 Amb25155387 [0,1,0,0,0,0|2,0,1]=4 301 B14R2.24 Brc1cc[n]cc1C2CNCCC2 Amb24322562 [0,1,0,0,0,0|2,0,1]=4 302 B14R2.24 Brc1cc[n]cc1C2CNCCN2 Amb24616860 [0,1,0,0,0,0|1,0,1]=3 303 B14R2.24 Brc1cc[n]cc1C2COCCO2 Amb24318979 [0,1,0,0,0,0|2,0,1]=4 304 B14R2.24 Brc1cc[n]cc1[C@@H]2COCCN2 Amb24745136 [0,1,0,0,0,0|1,0,1]=3 305 B14R2.24 Brc1ccccc1C2CCCCN2 Amb2236461 [0,1,0,0,0,0|1,0,2]=4 306 B14R2.24 Brc1ccccc1C2CCCCN2 Amb2237213 [0,1,0,0,0,0|1,0,2]=4 307 B14R2.24 Brc1ccccc1C2CNCCN2 Amb19887466 [0,1,0,0,0,0|2,0,1]=4 308 B14R2.24 Brc1ccccc1C2COCCN2 Amb24471018 [0,1,0,0,0,0|2,0,1]=4 309 B14R2.24 Brc1ccccc1C2CSCCN2 Amb24565607 [0,1,0,0,0,0|2,0,1]=4 310 B14R2.24 Brc1ccccc1[C@@H]2CCCCN2 Amb25238726 [0,1,0,0,0,0|1,0,2]=4 311 B14R2.24 Brc1ccccc1[C@H]2CNCCN2 Amb24550331 [0,1,0,0,0,0|2,0,1]=4 312 B14R2.24 CC1=CC=CNC1c2ccccc2 Amb25742905 [0,1,0,0,0,0|1,0,2]=4 313 B14R2.24 CC1NCCNC1c2ccccc2 Amb24084752 [0,1,0,0,0,0|2,0,1]=4 314 B14R2.24 CC1OCCNC1c2ccccc2 Amb18065713 [0,1,0,0,0,0|2,0,1]=4 315 B14R2.24 CC1SCCNC1c2ccccc2 Amb19374434 [0,1,0,0,0,0|2,0,1]=4 316 B14R2.24 CN1CCCCC1c2cccnc2 Amb17768388 [0,1,0,0,0,0|0,0,2]=3 317 B14R2.24 CN1CCCC[C@@H]1c2c[n]ccc2 Amb24665737 [0,1,0,0,0,0|0,0,2]=3 318 B14R2.24 CN1CCCC[C@H]1c2ccccc2 Amb25119333 [0,1,0,0,0,0|1,0,2]=4 319 B14R2.24 CN1CCNCC1c2ccccc2 Amb21954179 [0,1,0,0,0,0|2,0,1]=4 320 B14R2.24 CN1CCNCC1c2ccccc2 Amb22499001 [0,1,0,0,0,0|2,0,1]=4 321 B14R2.24 CN1CCNCC1c2ccccc2 Amb22586681 [0,1,0,0,0,0|2,0,1]=4 322 B14R2.24 CN1CCNCC1c2cccnc2 Amb17062766 [0,1,0,0,0,0|1,0,1]=3 323 B14R2.24 C[NH+]1CCCCC1c2cccnc2 Amb10231622 [0,1,0,0,0,0|0,0,3]=4 324 B14R2.24 Cc1[n]c[n]cc1C2CCCCN2 Amb18195773 [0,1,0,0,0,0|1,0,2]=4 325 B14R2.24 Cc1[n]c[n]cc1C2COCCN2 Amb18194547 [0,1,0,0,0,0|2,0,1]=4 326 B14R2.24 Cc1[n]c[n]cc1C2CSCCN2 Amb18189198 [0,1,0,0,0,0|2,0,1]=4 327 B14R2.24 Cc1[n]cccc1C2CCCCC2 Amb24085947 [0,1,0,0,0,0|1,0,2]=4 328 B14R2.24 Cc1[n]cccc1C2CNCCC2 Amb25373840 [0,1,0,0,0,0|2,0,1]=4 329 B14R2.24 Cc1[n]cccc1[C@@H]2CNCCN2 Amb25836899 [0,1,0,0,0,0|1,0,1]=3 330 B14R2.24 Cc1[n]cccc1[C@H]2CNCCN2 Amb24680866 [0,1,0,0,0,0|1,0,1]=3 331 B14R2.24 Cc1cc[n]cc1C2CNCCN2 Amb25102582 [0,1,0,0,0,0|1,0,1]=3 332 B14R2.24 Cc1cc[n]cc1C2COCCN2 Amb25858060 [0,1,0,0,0,0|1,0,1]=3 333 B14R2.24 Cc1cc[n]cc1C2NCCCS2 Amb24637487 [0,1,0,0,0,0|1,0,2]=4 334 B14R2.24 Cc1cc[n]cc1[C@@H]2CNCCN2 Amb24401101 [0,1,0,0,0,0|1,0,1]=3 335 B14R2.24 Cc1cc[n]cc1[C@H]2COCCN2 Amb25324425 [0,1,0,0,0,0|1,0,1]=3 336 B14R2.24 Cc1ccccc1C2CCCCN2 Amb2235832 [0,1,0,0,0,0|1,0,2]=4 337 B14R2.24 Cc1ccccc1C2CCCCN2 Amb2237217 [0,1,0,0,0,0|1,0,2]=4 338 B14R2.24 Cc1ccccc1C2CNCCN2 Amb25062517 [0,1,0,0,0,0|2,0,1]=4 339 B14R2.24 Cc1ccccc1[C@H]2CCCCN2 Amb10568351 [0,1,0,0,0,0|1,0,2]=4 340 B14R2.24 Cc1ccccc1[C@H]2CCCCN2 Amb24629146 [0,1,0,0,0,0|1,0,2]=4 341 B14R2.24 Cc1ccncc1C2CCCC=C2 Amb13890752 [0,1,0,0,0,0|1,0,2]=4 342 B14R2.24 ClC1CCCCC1c2ccc[n]c2 Amb19064472 [0,1,0,0,0,0|1,0,2]=4 343 B14R2.24 Clc1[n]cccc1C2CCCCC2 Amb24319285 [0,1,0,0,0,0|1,0,2]=4 344 B14R2.24 Clc1[n]cccc1C2CCCCO2 Amb24322643 [0,1,0,0,0,0|1,0,2]=4 345 B14R2.24 Clc1[n]cccc1C2CCOCC2 Amb24319352 [0,1,0,0,0,0|2,0,1]=4 346 B14R2.24 Clc1[n]cccc1C2CNCCC2 Amb25066873 [0,1,0,0,0,0|2,0,1]=4 347 B14R2.24 Clc1[n]cccc1C2CNCCN2 Amb24341408 [0,1,0,0,0,0|1,0,1]=3 348 B14R2.24 Clc1[n]cccc1C2COCCN2 Amb24351367 [0,1,0,0,0,0|1,0,1]=3 349 B14R2.24 Clc1[n]cccc1[C@@H]2CCCCN2 Amb25709160 [0,1,0,0,0,0|0,0,2]=3 350 B14R2.24 Clc1cc[n]cc1C2CCNCC2 Amb18188601 [0,1,0,0,0,0|2,0,1]=4 351 B14R2.24 Clc1cc[n]cc1C2CCOCC2 Amb24320925 [0,1,0,0,0,0|2,0,1]=4 352 B14R2.24 Clc1cc[n]cc1C2CNCCC2 Amb18188599 [0,1,0,0,0,0|2,0,1]=4 353 B14R2.24 Clc1cc[n]cc1C2COCCN2 Amb24671062 [0,1,0,0,0,0|1,0,1]=3 354 B14R2.24 Clc1cc[n]cc1[C@@H]2CNCCN2 Amb25160756 [0,1,0,0,0,0|1,0,1]=3 355 B14R2.24 Clc1cc[n]cc1[C@@H]2COCCN2 Amb24560929 [0,1,0,0,0,0|1,0,1]=3 356 B14R2.24 Clc1ccccc1C2CCCCN2 Amb2237236 [0,1,0,0,0,0|1,0,2]=4 357 B14R2.24 Clc1ccccc1C2CNCCN2 Amb19887469 [0,1,0,0,0,0|2,0,1]=4 358 B14R2.24 Clc1ccccc1C2COCCN2 Amb10068853 [0,1,0,0,0,0|2,0,1]=4 359 B14R2.24 Clc1ccccc1C2CSCCN2 Amb10068815 [0,1,0,0,0,0|2,0,1]=4 360 B14R2.24 Clc1ccccc1[C@@H]2CCCCN2 Amb24377606 [0,1,0,0,0,0|1,0,2]=4 361 B14R2.24 Clc1ccccc1[C@H]2CCCCN2 Amb24436504 [0,1,0,0,0,0|1,0,2]=4 362 B14R2.24 Fc1[n]cccc1C2CCOCC2 Amb22234593 [0,1,0,0,0,0|2,0,1]=4 363 B14R2.24 Fc1[n]cccc1C2CNCCC2 Amb18824516 [0,1,0,0,0,0|2,0,1]=4 364 B14R2.24 Fc1[n]cccc1C2CNCCN2 Amb24374652 [0,1,0,0,0,0|1,0,1]=3 365 B14R2.24 Fc1[n]cccc1C2COCCN2 Amb24614852 [0,1,0,0,0,0|1,0,1]=3 366 B14R2.24 Fc1[n]cccc1[C@@H]2COCCN2 Amb24761344 [0,1,0,0,0,0|1,0,1]=3 367 B14R2.24 Fc1[n]cccc1[C@H]2CNCCC2 Amb24697817 [0,1,0,0,0,0|2,0,1]=4 368 B14R2.24 Fc1[n]cccc1[C@H]2CNCCN2 Amb25378807 [0,1,0,0,0,0|1,0,1]=3 369 B14R2.24 Fc1cc[n]cc1C2CCNCC2 Amb24496753 [0,1,0,0,0,0|2,0,1]=4 370 B14R2.24 Fc1ccccc1C2CCCCN2 Amb21954354 [0,1,0,0,0,0|1,0,2]=4 371 B14R2.24 Fc1ccccc1C2CNCCN2 Amb19887468 [0,1,0,0,0,0|2,0,1]=4 372 B14R2.24 Fc1ccccc1C2CSCCN2 Amb25046020 [0,1,0,0,0,0|2,0,1]=4 373 B14R2.24 Fc1ccccc1[C@@H]2CCCCN2 Amb25709116 [0,1,0,0,0,0|1,0,2]=4 374 B14R2.24 Fc1ccccc1[C@@H]2CNCCN2 Amb24182086 [0,1,0,0,0,0|2,0,1]=4 375 B14R2.24 Fc1ccccc1[C@@H]2COCCN2 Amb25791130 [0,1,0,0,0,0|2,0,1]=4 376 B14R2.24 Fc1ccccc1[C@H]2CNCCN2 Amb24761295 [0,1,0,0,0,0|2,0,1]=4 377 B14R2.24 Ic1ccccc1C2CCCCN2 Amb2237214 [0,1,0,0,0,0|1,0,2]=4 378 B14R2.24 Ic1ccccc1[C@@H]2CNCCN2 Amb25105001 [0,1,0,0,0,0|2,0,1]=4 379 B14R2.24 Ic1ccccc1[C@@H]2COCCN2 Amb25155068 [0,1,0,0,0,0|2,0,1]=4 380 B14R2.24 Ic1ccccc1[C@H]2CNCCN2 Amb25667994 [0,1,0,0,0,0|2,0,1]=4 381 B14R2.24 Ic1ccccc1[C@H]2COCCN2 Amb24697492 [0,1,0,0,0,0|2,0,1]=4 382 B14R2.24 NC1CC=CCC1c2ccccc2 Amb25125269 [0,1,0,0,0,0|2,0,0]=3 383 B14R2.24 NC1CCCCC1c2ccc[n]c2 Amb18280246 [0,1,0,0,0,0|1,0,2]=4 384 B14R2.24 NC1CCCNC1c2ccccc2 Amb17400581 [0,1,0,0,0,0|1,0,2]=4 385 B14R2.24 NC1CCCNC1c2cccnc2 Amb17400624 [0,1,0,0,0,0|0,0,2]=3 386 B14R2.24 NN1CCCCC1c2ccccc2 Amb25755123 [0,1,0,0,0,0|1,0,2]=4 387 B14R2.24 N[C@H]1CCCN[C@@H]1c2ccccc2 Amb24691659 [0,1,0,0,0,0|1,0,2]=4 388 B14R2.24 N[C@H]1CCCN[C@H]1c2ccccc2 Amb20242915 [0,1,0,0,0,0|1,0,2]=4 389 B14R2.24 Nc1[n]cccc1C2CCCCC2 Amb18196506 [0,1,0,0,0,0|1,0,2]=4 390 B14R2.24 Nc1[n]cccc1C2CCCCN2 Amb23445323 [0,1,0,0,0,0|0,0,2]=3 391 B14R2.24 Nc1[n]cccc1C2CCCCO2 Amb24322644 [0,1,0,0,0,0|1,0,2]=4 392 B14R2.24 Nc1[n]cccc1C2CCOCC2 Amb24319353 [0,1,0,0,0,0|2,0,1]=4 393 B14R2.24 Nc1[n]cccc1C2CNCCC2 Amb24322561 [0,1,0,0,0,0|2,0,1]=4 394 B14R2.24 Nc1[n]cccc1C2CNCCN2 Amb24490302 [0,1,0,0,0,0|1,0,1]=3 395 B14R2.24 Nc1[n]cccc1C2COCCN2 Amb24432282 [0,1,0,0,0,0|1,0,1]=3 396 B14R2.24 Nc1[n]cccc1C2COCCO2 Amb24318985 [0,1,0,0,0,0|2,0,1]=4 397 B14R2.24 Nc1[n]cccc1[C@H]2CCCCN2 Amb24378078 [0,1,0,0,0,0|0,0,2]=3 398 B14R2.24 Nc1[n]cccc1[C@H]2CNCCC2 Amb25291136 [0,1,0,0,0,0|2,0,1]=4 399 B14R2.24 Nc1cc[n]cc1C2CCCCC2 Amb24319532 [0,1,0,0,0,0|1,0,2]=4 400 B14R2.24 Nc1cc[n]cc1C2CCCCN2 Amb25727203 [0,1,0,0,0,0|0,0,2]=3 401 B14R2.24 Nc1cc[n]cc1C2CCCCO2 Amb24322641 [0,1,0,0,0,0|1,0,2]=4 402 B14R2.24 Nc1cc[n]cc1C2CCNCC2 Amb25793452 [0,1,0,0,0,0|2,0,1]=4 403 B14R2.24 Nc1cc[n]cc1C2CCOCC2 Amb24320926 [0,1,0,0,0,0|2,0,1]=4 404 B14R2.24 Nc1cc[n]cc1C2CNCCC2 Amb24322563 [0,1,0,0,0,0|2,0,1]=4 405 B14R2.24 Nc1cc[n]cc1C2CNCCN2 Amb25132020 [0,1,0,0,0,0|1,0,1]=3 406 B14R2.24 Nc1cc[n]cc1C2COCCO2 Amb24318980 [0,1,0,0,0,0|2,0,1]=4 407 B14R2.24 Nc1cc[n]cc1[C@@H]2COCCN2 Amb25693618 [0,1,0,0,0,0|1,0,1]=3 408 B14R2.24 Nc1cc[n]cc1[C@H]2COCCN2 Amb25674608 [0,1,0,0,0,0|1,0,1]=3 409 B14R2.24 Nc1ccccc1C2COCCN2 Amb25743087 [0,1,0,0,0,0|2,0,1]=4 410 B14R2.24 Nc1ccccc1[C@@H]2CCCCN2 Amb25137597 [0,1,0,0,0,0|1,0,2]=4 411 B14R2.24 Nc1ccccc1[C@@H]2CNCCN2 Amb24587756 [0,1,0,0,0,0|2,0,1]=4 412 B14R2.24 O=C1C=CCCC1c2ccccc2 Amb25373024 [0,1,0,0,0,0|2,0,1]=4 413 B14R2.24 O=C1CC=CCC1c2ccccc2 Amb25112660 [0,1,0,0,0,0|2,0,0]=3 414 B14R2.24 O=C1CCCCC1c2ccc[n]c2 Amb18183934 [0,1,0,0,0,0|1,0,2]=4 415 B14R2.24 O=C1CCNCC1c2ccc[n]c2 Amb18196703 [0,1,0,0,0,0|2,0,1]=4 416 B14R2.24 OC1CC=COC1c2ccccc2 Amb24404617 [0,1,0,0,0,0|3,0,0]=4 417 B14R2.24 OC1CCCCC1c2ccc[n]c2 Amb18804651 [0,1,0,0,0,0|1,0,2]=4 418 B14R2.24 OC1CCCNC1c2ccc[n][n]2 Amb18194530 [0,1,0,0,0,0|1,0,2]=4 419 B14R2.24 OC1CCCN[C@H]1c2ccccc2 Amb24379962 [0,1,0,0,0,0|1,0,2]=4 420 B14R2.24 O[C@@H]1CCCN[C@@H]1c2ccccc2 Amb23437772 [0,1,0,0,0,0|1,0,2]=4 421 B14R2.24 Oc1[n]c[n]cc1C2CCCCN2 Amb18194546 [0,1,0,0,0,0|1,0,2]=4 422 B14R2.24 Oc1[n]c[n]cc1C2COCCN2 Amb18193217 [0,1,0,0,0,0|2,0,1]=4 423 B14R2.24 Oc1[n]c[n]cc1C2CSCCN2 Amb18188395 [0,1,0,0,0,0|2,0,1]=4 424 B14R2.24 Oc1[n]cccc1C2CCCCC2 Amb24319286 [0,1,0,0,0,0|1,0,2]=4 425 B14R2.24 Oc1[n]cccc1C2CCCCN2 Amb23445257 [0,1,0,0,0,0|0,0,2]=3 426 B14R2.24 Oc1[n]cccc1C2CNCCC2 Amb24406705 [0,1,0,0,0,0|2,0,1]=4 427 B14R2.24 Oc1[n]cccc1C2COCCN2 Amb25160776 [0,1,0,0,0,0|1,0,1]=3 428 B14R2.24 Oc1cc[n]cc1C2CCCCN2 Amb25104905 [0,1,0,0,0,0|0,0,2]=3 429 B14R2.24 Oc1cc[n]cc1C2CCNCC2 Amb24364659 [0,1,0,0,0,0|2,0,1]=4 430 B14R2.24 Oc1cc[n]cc1C2CNCCN2 Amb25799070 [0,1,0,0,0,0|1,0,1]=3 431 B14R2.24 Oc1cc[n]cc1[C@@H]2CCCCN2 Amb25700414 [0,1,0,0,0,0|0,0,2]=3 432 B14R2.24 Oc1cc[n]cc1[C@@H]2COCCN2 Amb25095385 [0,1,0,0,0,0|1,0,1]=3 433 B14R2.24 Oc1cc[n]cc1[C@H]2CCCCN2 Amb25839220 [0,1,0,0,0,0|0,0,2]=3 434 B14R2.24 Oc1cc[n]cc1[C@H]2CNCCN2 Amb25087243 [0,1,0,0,0,0|1,0,1]=3 435 B14R2.24 Oc1ccccc1C2CCCCN2 Amb25843757 [0,1,0,0,0,0|1,0,2]=4 436 B14R2.24 Oc1ccccc1C2CNCCN2 Amb24693879 [0,1,0,0,0,0|2,0,1]=4 437 B14R2.24 Oc1ccccc1C2COCCN2 Amb25709140 [0,1,0,0,0,0|2,0,1]=4 438 B14R2.24 Oc1ccccc1[C@@H]2COCCN2 Amb25114284 [0,1,0,0,0,0|2,0,1]=4 439 B14R2.24 Sc1[n]cccc1C2CCCCN2 Amb23508053 [0,1,0,0,0,0|0,0,2]=3 440 B14R2.24 Sc1[n]cccc1C2CCNCC2 Amb24738349 [0,1,0,0,0,0|2,0,1]=4 441 B14R2.24 Sc1[n]cccc1C2CNCCC2 Amb25229882 [0,1,0,0,0,0|2,0,1]=4 442 B14R2.24 Sc1[n]cccc1C2CNCCN2 Amb25758815 [0,1,0,0,0,0|1,0,1]=3 443 B14R2.24 Sc1[n]cccc1[C@@H]2CCCCN2 Amb24620448 [0,1,0,0,0,0|0,0,2]=3 444 B14R2.24 Sc1[n]cccc1[C@@H]2CNCCN2 Amb24496946 [0,1,0,0,0,0|1,0,1]=3 445 B14R2.24 Sc1[n]cccc1[C@H]2CCCCN2 Amb24496851 [0,1,0,0,0,0|0,0,2]=3 446 B14R2.24 Sc1[n]cccc1[C@H]2CNCCN2 Amb25114199 [0,1,0,0,0,0|1,0,1]=3 447 B14R2.24 Sc1ccccc1C2CCCCN2 Amb25757374 [0,1,0,0,0,0|1,0,2]=4 448 B14R2.24 Sc1ccccc1C2COCCN2 Amb25838525 [0,1,0,0,0,0|2,0,1]=4 449 B14R2.24 Sc1ccccc1[C@@H]2COCCN2 Amb25829490 [0,1,0,0,0,0|2,0,1]=4 450 B14R2.24 Sc1ccccc1[C@H]2CCCCN2 Amb24428688 [0,1,0,0,0,0|1,0,2]=4 451 B14R2.24 Sc1ccccc1[C@H]2COCCN2 Amb25279433 [0,1,0,0,0,0|2,0,1]=4 452 B14R2.68 Brc1ccc(c[n]1)C2CCCCN2 Amb23444862 [0,1,0,0,0,0|0,0,2]=3 453 B14R2.68 Brc1ccc(c[n]1)C2CCCCO2 Amb24322632 [0,1,0,0,0,0|1,0,2]=4 454 B14R2.68 Brc1ccc(c[n]1)C2CNCCC2 Amb24082388 [0,1,0,0,0,0|2,0,1]=4 455 B14R2.68 Brc1ccc(c[n]1)C2CNCCN2 Amb25843146 [0,1,0,0,0,0|1,0,1]=3 456 B14R2.68 Brc1ccc(c[n]1)C2COCCN2 Amb24447163 [0,1,0,0,0,0|1,0,1]=3 457 B14R2.68 Brc1ccc(c[n]1)C2COCCO2 Amb24318977 [0,1,0,0,0,0|2,0,1]=4 458 B14R2.68 Brc1ccc(c[n]1)[C@@H]2CCCCN2 Amb25375972 [0,1,0,0,0,0|0,0,2]=3 459 B14R2.68 Brc1ccc(c[n]1)[C@H]2CCCCN2 Amb25324058 [0,1,0,0,0,0|0,0,2]=3 460 B14R2.68 Brc1ccc(c[n]1)[C@H]2CNCCC2 Amb25211099 [0,1,0,0,0,0|2,0,1]=4 461 B14R2.68 Brc1ccc(c[n]1)[C@H]2CNCCN2 Amb25353348 [0,1,0,0,0,0|1,0,1]=3 462 B14R2.68 Brc1ccc(cc1)C2CC=CCO2 Amb24386961 [0,1,0,0,0,0|2,0,0]=3 463 B14R2.68 Brc1ccc(cc1)C2CCCCN2 Amb2234960 [0,1,0,0,0,0|1,0,2]=4 464 B14R2.68 Brc1ccc(cc1)C2NCCNC2 Amb10602493 [0,1,0,0,0,0|2,0,1]=4 465 B14R2.68 Brc1ccc(cc1)C2NCCOC2 Amb17255958 [0,1,0,0,0,0|2,0,1]=4 466 B14R2.68 Brc1ccc(cc1)C2NCCSC2 Amb13881632 [0,1,0,0,0,0|2,0,1]=4 467 B14R2.68 Brc1ccc(cc1)[C@@H]2CNCCN2 Amb25080979 [0,1,0,0,0,0|2,0,1]=4 468 B14R2.68 Brc1ccc(cc1)[C@H]2CCCCN2 Amb25306118 [0,1,0,0,0,0|1,0,2]=4 469 B14R2.68 Brc1ccc(cc1)[C@H]2CNCCN2 Amb24443868 [0,1,0,0,0,0|2,0,1]=4 470 B14R2.68 Brc1ccc(cc1)[C@H]2COCCN2 Amb25096412 [0,1,0,0,0,0|2,0,1]=4 471 B14R2.68 Brc1ccc(cn1)C2CCCCC2 Amb10600545 [0,1,0,0,0,0|1,0,2]=4 472 B14R2.68 Brc1ccc(cn1)C2CCCOC2 Amb10600950 [0,1,0,0,0,0|2,0,1]=4 473 B14R2.68 Brc1ccc(cn1)C2CCNCC2 Amb10600938 [0,1,0,0,0,0|2,0,1]=4 474 B14R2.68 Brc1ccc(cn1)C2CCOCC2 Amb10600944 [0,1,0,0,0,0|2,0,1]=4 475 B14R2.68 C=C1CNC(CC1)c2ccccc2 Amb25799677 [0,1,0,0,0,0|1,0,1]=3 476 B14R2.68 C=C1CNC(OC1)c2ccccc2 Amb25765736 [0,1,0,0,0,0|2,0,1]=4 477 B14R2.68 CC1CCC(NC1)c2ccccc2 Amb24493698 [0,1,0,0,0,0|1,0,2]=4 478 B14R2.68 CC1CNC(C=C1)c2ccccc2 Amb18127122 [0,1,0,0,0,0|1,0,2]=4 479 B14R2.68 CC1CNC(CO1)c2ccccc2 Amb18065683 [0,1,0,0,0,0|2,0,1]=4 480 B14R2.68 CC1CNC(CS1)c2ccccc2 Amb25267409 [0,1,0,0,0,0|2,0,1]=4 481 B14R2.68 CC1CNC(SC1)c2ccc[n]c2 Amb24671710 [0,1,0,0,0,0|1,0,2]=4 482 B14R2.68 CC1COC(CN1)c2cccnc2 Amb17138870 [0,1,0,0,0,0|2,0,1]=4 483 B14R2.68 CC1NCC(NC1)c2ccccc2 Amb10982520 [0,1,0,0,0,0|2,0,1]=4 484 B14R2.68 CC=1CCN(CC1)c2c[n]cc[n]2 Amb24660608 [0,1,0,0,0,0|3,0,0]=4 485 B14R2.68 C[C@@H]1CN[C@H](C=C1)c2ccccc2 Amb24638898 [0,1,0,0,0,0|1,0,2]=4 486 B14R2.68 Cc1[n]cc(c[n]1)C2COCCN2 Amb18194545 [0,1,0,0,0,0|2,0,1]=4 487 B14R2.68 Cc1ccc(c[n]1)C2CC=CCC2 Amb24749841 [0,1,0,0,0,0|1,0,0]=2 488 B14R2.68 Cc1ccc(c[n]1)C2CCNCC2 Amb18196478 [0,1,0,0,0,0|2,0,1]=4 489 B14R2.68 Cc1ccc(c[n]1)C2CNCCC2 Amb18196477 [0,1,0,0,0,0|2,0,1]=4 490 B14R2.68 Cc1ccc(c[n]1)C2COCCO2 Amb24448878 [0,1,0,0,0,0|2,0,1]=4 491 B14R2.68 Cc1ccc(cc1)C2CCCCN2 Amb21954355 [0,1,0,0,0,0|1,0,2]=4 492 B14R2.68 Cc1ccc(cc1)C2CCCCN2 Amb2237218 [0,1,0,0,0,0|1,0,2]=4 493 B14R2.68 Cc1ccc(cc1)C2NCCNC2 Amb13881653 [0,1,0,0,0,0|2,0,1]=4 494 B14R2.68 Cc1ccc(cc1)C2NCCOC2 Amb10068851 [0,1,0,0,0,0|2,0,1]=4 495 B14R2.68 Cc1ccc(cc1)C2NCCSC2 Amb17098082 [0,1,0,0,0,0|2,0,1]=4 496 B14R2.68 Cc1ccc(cc1)[C@@H]2CCCCN2 Amb25062566 [0,1,0,0,0,0|1,0,2]=4 497 B14R2.68 Cc1ccc(cc1)[C@@H]2CNCCN2 Amb25328546 [0,1,0,0,0,0|2,0,1]=4 498 B14R2.68 Cc1ccc(cc1)[C@@H]2COCCN2 Amb22745544 [0,1,0,0,0,0|2,0,1]=4 499 B14R2.68 Cc1ccc(cc1)[C@H]2CCCCN2 Amb24715741 [0,1,0,0,0,0|1,0,2]=4 500 B14R2.68 Cc1ccc(cn1)C2CCCC=C2 Amb13890753 [0,1,0,0,0,0|1,0,2]=4 501 B14R2.68 Clc1ccc([n][n]1)C2CNCCN2 Amb25200101 [0,1,0,0,0,0|2,0,1]=4 502 B14R2.68 Clc1ccc(c[n]1)C2CNCCN2 Amb25072573 [0,1,0,0,0,0|1,0,1]=3 503 B14R2.68 Clc1ccc(c[n]1)C2COCCN2 Amb25369052 [0,1,0,0,0,0|1,0,1]=3 504 B14R2.68 Clc1ccc(c[n]1)[C@@H]2CNCCC2 Amb25249272 [0,1,0,0,0,0|2,0,1]=4 505 B14R2.68 Clc1ccc(c[n]1)[C@@H]2CNCCN2 Amb24548850 [0,1,0,0,0,0|1,0,1]=3 506 B14R2.68 Clc1ccc(cc1)C2CCCCN2 Amb10069010 [0,1,0,0,0,0|1,0,2]=4 507 B14R2.68 Clc1ccc(cc1)C2NCCNC2 Amb10068868 [0,1,0,0,0,0|2,0,1]=4 508 B14R2.68 Clc1ccc(cc1)C2NCCOC2 Amb10068850 [0,1,0,0,0,0|2,0,1]=4 509 B14R2.68 Clc1ccc(cc1)C2NCCSC2 Amb13881631 [0,1,0,0,0,0|2,0,1]=4 510 B14R2.68 Clc1ccc(cc1)[C@H]2CCCCN2 Amb24401064 [0,1,0,0,0,0|1,0,2]=4 511 B14R2.68 Clc1ccc(cc1)[C@H]2CNCCN2 Amb24761297 [0,1,0,0,0,0|2,0,1]=4 512 B14R2.68 Clc1ccc(cn1)C2CCCC=C2 Amb13890755 [0,1,0,0,0,0|1,0,2]=4 513 B14R2.68 Clc1ccc(nn1)N2CCC=CC2 Amb16667402 [0,1,0,0,0,0|3,0,0]=4 514 B14R2.68 Fc1ccc(c[n]1)C2CCNCC2 Amb18193737 [0,1,0,0,0,0|2,0,1]=4 515 B14R2.68 Fc1ccc(c[n]1)C2CNCCC2 Amb18193723 [0,1,0,0,0,0|2,0,1]=4 516 B14R2.68 Fc1ccc(c[n]1)C2COCCN2 Amb25789482 [0,1,0,0,0,0|1,0,1]=3 517 B14R2.68 Fc1ccc(c[n]1)[C@@H]2CNCCN2 Amb25187946 [0,1,0,0,0,0|1,0,1]=3 518 B14R2.68 Fc1ccc(c[n]1)[C@@H]2COCCN2 Amb24654798 [0,1,0,0,0,0|1,0,1]=3 519 B14R2.68 Fc1ccc(c[n]1)[C@H]2CCCCN2 Amb25809408 [0,1,0,0,0,0|0,0,2]=3 520 B14R2.68 Fc1ccc(c[n]1)[C@H]2CNCCN2 Amb25324404 [0,1,0,0,0,0|1,0,1]=3 521 B14R2.68 Fc1ccc(cc1)C2CCCCN2 Amb10808382 [0,1,0,0,0,0|1,0,2]=4 522 B14R2.68 Fc1ccc(cc1)C2CCCCN2 Amb17659190 [0,1,0,0,0,0|1,0,2]=4 523 B14R2.68 Fc1ccc(cc1)C2CNCCN2 Amb22396492 [0,1,0,0,0,0|2,0,1]=4 524 B14R2.68 Fc1ccc(cc1)C2NCCOC2 Amb10808452 [0,1,0,0,0,0|2,0,1]=4 525 B14R2.68 Fc1ccc(cc1)[C@@H]2CC=CCN2 Amb25780068 [0,1,0,0,0,0|1,0,0]=2 526 B14R2.68 Fc1ccc(cc1)[C@H]2CNCCN2 Amb25039432 [0,1,0,0,0,0|2,0,1]=4 527 B14R2.68 Fc1ccc(cc1)[C@H]2COCCN2 Amb24744390 [0,1,0,0,0,0|2,0,1]=4 528 B14R2.68 Ic1ccc(c[n]1)C2CCNCC2 Amb25805234 [0,1,0,0,0,0|2,0,1]=4 529 B14R2.68 Ic1ccc(c[n]1)[C@@H]2COCCN2 Amb24444928 [0,1,0,0,0,0|1,0,1]=3 530 B14R2.68 Ic1ccc(cc1)C2CCCCN2 Amb2235010 [0,1,0,0,0,0|1,0,2]=4 531 B14R2.68 Ic1ccc(cc1)[C@@H]2COCCN2 Amb24468332 [0,1,0,0,0,0|2,0,1]=4 532 B14R2.68 Ic1ccc(cc1)[C@H]2CCCCN2 Amb25155503 [0,1,0,0,0,0|1,0,2]=4 533 B14R2.68 Ic1ccc(cc1)[C@H]2CNCCN2 Amb25328037 [0,1,0,0,0,0|2,0,1]=4 534 B14R2.68 NC1CCC(CC1)c2ccc[n]c2 Amb18065642 [0,1,0,0,0,0|1,0,2]=4 535 B14R2.68 NC=1COC(CN1)c2ccccc2 Amb24407090 [0,1,0,0,0,0|3,0,0]=4 536 B14R2.68 Nc1[n]cc(c[n]1)C2CCCCN2 Amb18195126 [0,1,0,0,0,0|1,0,2]=4 537 B14R2.68 Nc1[n]cc(c[n]1)C2COCCN2 Amb18193769 [0,1,0,0,0,0|2,0,1]=4 538 B14R2.68 Nc1c[n]c(c[n]1)N2CCC=CC2 Amb25375538 [0,1,0,0,0,0|3,0,0]=4 539 B14R2.68 Nc1ccc(c[n]1)C2CCCCN2 Amb23445291 [0,1,0,0,0,0|0,0,2]=3 540 B14R2.68 Nc1ccc(c[n]1)C2CCCCO2 Amb24322633 [0,1,0,0,0,0|1,0,2]=4 541 B14R2.68 Nc1ccc(c[n]1)C2CNCCC2 Amb18195758 [0,1,0,0,0,0|2,0,1]=4 542 B14R2.68 Nc1ccc(c[n]1)C2COCCO2 Amb24318978 [0,1,0,0,0,0|2,0,1]=4 543 B14R2.68 Nc1ccc(c[n]1)N2CCC=CC2 Amb25201170 [0,1,0,0,0,0|2,0,0]=3 544 B14R2.68 Nc1ccc(c[n]1)[C@@H]2CNCCN2 Amb24568275 [0,1,0,0,0,0|1,0,1]=3 545 B14R2.68 Nc1ccc(c[n]1)[C@@H]2COCCN2 Amb25084597 [0,1,0,0,0,0|1,0,1]=3 546 B14R2.68 Nc1ccc(c[n]1)[C@H]2CCCCN2 Amb25817506 [0,1,0,0,0,0|0,0,2]=3 547 B14R2.68 Nc1ccc(cc1)C2CNCCN2 Amb24066206 [0,1,0,0,0,0|2,0,1]=4 548 B14R2.68 Nc1ccc(cc1)C2COCCN2 Amb24655900 [0,1,0,0,0,0|2,0,1]=4 549 B14R2.68 Nc1ccc(cc1)[C@@H]2CNCCN2 Amb25830604 [0,1,0,0,0,0|2,0,1]=4 550 B14R2.68 Nc1ccc(cc1)[C@H]2CNCCN2 Amb24432278 [0,1,0,0,0,0|2,0,1]=4 551 B14R2.68 Nc1ccc(cn1)C2CCCCC2 Amb10600546 [0,1,0,0,0,0|1,0,2]=4 552 B14R2.68 Nc1ccc(cn1)C2CCCOC2 Amb10600951 [0,1,0,0,0,0|2,0,1]=4 553 B14R2.68 Nc1ccc(cn1)C2CCNCC2 Amb10600939 [0,1,0,0,0,0|2,0,1]=4 554 B14R2.68 Nc1ccc(cn1)C2CCOCC2 Amb10600945 [0,1,0,0,0,0|2,0,1]=4 555 B14R2.68 O=C1CCC(CC1)c2c[n]c[n]c2 Amb25306688 [0,1,0,0,0,0|2,0,1]=4 556 B14R2.68 O=C1CCC(CC1)c2ccc[n]c2 Amb18065558 [0,1,0,0,0,0|1,0,1]=3 557 B14R2.68 O=C1CCC(CC1)c2ccccc2 Amb1208394 [0,1,0,0,0,0|2,0,1]=4 558 B14R2.68 O=C1CCC(CN1)c2ccccc2 Amb17400501 [0,1,0,0,0,0|3,0,0]=4 559 B14R2.68 O=C1CNC(CN1)c2cc[n]cc2 Amb23452783 [0,1,0,0,0,0|3,0,0]=4 560 B14R2.68 O=C1CNC(CN1)c2ccc[n]c2 Amb23452782 [0,1,0,0,0,0|1,0,0]=2 561 B14R2.68 O=C1CNC(CN1)c2ccccc2 Amb23452781 [0,1,0,0,0,0|2,0,0]=3 562 B14R2.68 O=C1CNC(CO1)c2ccccc2 Amb18127910 [0,1,0,0,0,0|2,0,0]=3 563 B14R2.68 O=C1CN[C@@H](CO1)c2ccccc2 Amb22748846 [0,1,0,0,0,0|2,0,0]=3 564 B14R2.68 O=C1CN[C@H](CO1)c2ccccc2 Amb24052958 [0,1,0,0,0,0|2,0,0]=3 565 B14R2.68 O=C1COC(CN1)c2ccccc2 Amb18224547 [0,1,0,0,0,0|3,0,0]=4 566 B14R2.68 O=C1NCC(CN1)c2ccc[n]c2 Amb25776935 [0,1,0,0,0,0|3,0,0]=4 567 B14R2.68 O=C1NNC(C=C1)c2ccccc2 Amb17597676 [0,1,0,0,0,0|2,0,1]=4 568 B14R2.68 OC1CCC(CC1)c2ccc[n]c2 Amb25681498 [0,1,0,0,0,0|1,0,2]=4 569 B14R2.68 OC1CCC(NC1)c2ccccc2 Amb24472962 [0,1,0,0,0,0|1,0,2]=4 570 B14R2.68 Oc1ccc(c[n]1)C2CCCCN2 Amb23445230 [0,1,0,0,0,0|0,0,2]=3 571 B14R2.68 Oc1ccc(c[n]1)C2CCNCC2 Amb25060115 [0,1,0,0,0,0|2,0,1]=4 572 B14R2.68 Oc1ccc(c[n]1)C2CNCCC2 Amb24323209 [0,1,0,0,0,0|2,0,1]=4 573 B14R2.68 Oc1ccc(c[n]1)C2CNCCN2 Amb24490303 [0,1,0,0,0,0|1,0,1]=3 574 B14R2.68 Oc1ccc(c[n]1)C2COCCN2 Amb25066496 [0,1,0,0,0,0|1,0,1]=3 575 B14R2.68 Oc1ccc(c[n]1)[C@H]2CCCCN2 Amb25292243 [0,1,0,0,0,0|0,0,2]=3 576 B14R2.68 Oc1ccc(c[n]1)[C@H]2CNCCN2 Amb25187832 [0,1,0,0,0,0|1,0,1]=3 577 B14R2.68 Oc1ccc(cc1)C2COCCN2 Amb24578763 [0,1,0,0,0,0|2,0,1]=4 578 B14R2.68 Oc1ccc(cc1)C2NCCNC2 Amb10982480 [0,1,0,0,0,0|2,0,1]=4 579 B14R2.68 Oc1ccc(cc1)[C@@H]2CNCCN2 Amb24401057 [0,1,0,0,0,0|2,0,1]=4 580 B14R2.68 Oc1ccc(cc1)[C@@H]2COCCN2 Amb24761321 [0,1,0,0,0,0|2,0,1]=4 581 B14R2.68 Oc1ccc(cc1)[C@H]2COCCN2 Amb24351091 [0,1,0,0,0,0|2,0,1]=4 582 B14R2.68 Oc1ccc(cn1)C2CCCCC2 Amb10600547 [0,1,0,0,0,0|1,0,2]=4 583 B14R2.68 Sc1ccc(c[n]1)C2CCCCN2 Amb23508019 [0,1,0,0,0,0|0,0,2]=3 584 B14R2.68 Sc1ccc(c[n]1)C2CCNCC2 Amb24626070 [0,1,0,0,0,0|2,0,1]=4 585 B14R2.68 Sc1ccc(c[n]1)C2CNCCC2 Amb24496740 [0,1,0,0,0,0|2,0,1]=4 586 B14R2.68 Sc1ccc(c[n]1)C2CNCCN2 Amb25695329 [0,1,0,0,0,0|1,0,1]=3 587 B14R2.68 Sc1ccc(c[n]1)C2COCCN2 Amb25350315 [0,1,0,0,0,0|1,0,1]=3 588 B14R2.68 Sc1ccc(c[n]1)[C@@H]2CNCCN2 Amb25127121 [0,1,0,0,0,0|1,0,1]=3 589 B14R2.68 Sc1ccc(c[n]1)[C@@H]2COCCN2 Amb25360782 [0,1,0,0,0,0|1,0,1]=3 590 B14R2.68 Sc1ccc(c[n]1)[C@H]2COCCN2 Amb24647959 [0,1,0,0,0,0|1,0,1]=3 591 B14R2.68 Sc1ccc(cc1)[C@@H]2COCCN2 Amb25839744 [0,1,0,0,0,0|2,0,1]=4 592 B14R2.5540 CC1(CCCCN1)c2ccccc2 Amb18063210 [0,1,0,0,0,0|1,0,2]=4 593 B14R2.5540 CC1(CNCCN1)c2ccccc2 Amb24065744 [0,1,0,0,0,0|2,0,1]=4 594 B14R2.5540 CC1(CNCCO1)c2c[n]ccc2 Amb24592960 [0,1,0,0,0,0|2,0,1]=4 595 B14R2.5540 C[C@]1(CCCCN1)c2ccccc2 Amb24440188 [0,1,0,0,0,0|1,0,2]=4 596 B14R2.5540 FC1(CCNCC1)c2c[n]ccc2 Amb24534689 [0,1,0,0,0,0|2,0,1]=4 597 B14R2.5540 NC1(CC=CCC1)c2ccccc2 Amb24520896 [0,1,0,0,0,0|2,0,0]=3 598 B14R2.5540 NC1(CCCCC1)c2c[n]ccc2 Amb18944275 [0,1,0,0,0,0|1,0,2]=4 599 B14R2.5540 NC1(CCCCC1)c2c[n]ccc2 Amb22292261 [0,1,0,0,0,0|1,0,2]=4 600 B14R2.5540 NC1(CCNCC1)c2c[n]ccc2 Amb25201710 [0,1,0,0,0,0|2,0,1]=4 601 B14R2.5540 OC1(CCCCC1)c2c[n]ccc2 Amb18180666 [0,1,0,0,0,0|1,0,2]=4 602 B14R2.5540 OC1(CCNCC1)c2c[n]ccc2 Amb21959825 [0,1,0,0,0,0|2,0,1]=4 603 B14R2.5540 OC1(CCNCC1)c2cccnc2 Amb10070396 [0,1,0,0,0,0|2,0,1]=4 604 B12R1.3 C=CCC(c1ccccc1)C#N Amb17593937 [0,0,1,0,0,0|3,0,0]=4 605 B12R1.3 CCNC(C#C)c1c[n]ccc1 Amb25363625 [0,0,1,0,0,0|0,0,3]=4 606 B12R1.3 CCN[C@@H](CO)c1ccccc1 Amb22745949 [0,0,1,0,0,0|2,0,1]=4 607 B12R1.3 CNC(C=C=C)c1ccccc1 Amb24427541 [0,0,1,0,0,0|1,0,2]=4 608 B12R1.3 CNC(CC#C)c1c[n]c[n]c1 Amb25294891 [0,0,1,0,0,0|1,0,2]=4 609 B12R1.3 CNC(CC#C)c1c[n]cc[n]1 Amb18987806 [0,0,1,0,0,0|1,0,2]=4 610 B12R1.3 CNC(CC#C)c1c[n]ccc1 Amb18296082 [0,0,1,0,0,0|0,0,2]=3 611 B12R1.3 CNC(CC#C)c1ccccc1 Amb18800161 [0,0,1,0,0,0|1,0,2]=4 612 B12R1.3 CNC(CC#C)c1ccccc1 Amb19514703 [0,0,1,0,0,0|1,0,2]=4 613 B12R1.3 CNC(CC#N)c1ccccc1 Amb18997456 [0,0,1,0,0,0|2,0,1]=4 614 B12R1.3 CNC(CCO)c1c[n]cc[n]1 Amb22301219 [0,0,1,0,0,0|2,0,1]=4 615 B12R1.3 CNC(CCO)c1ccccc1 Amb18563697 [0,0,1,0,0,0|2,0,1]=4 616 B12R1.3 C\C=C\C(NC)c1ccccc1 Amb18645551 [0,0,1,0,0,0|1,0,2]=4 617 B12R1.3 NCCC(c1cccnc1)CN Amb17232561 [0,0,1,0,0,0|3,0,0]=4 618 B12R1.3 OCCC(c1cccnc1)CN Amb17232607 [0,0,1,0,0,0|3,0,0]=4 619 B12R1.8 C=C=CCNCc1ccccc1 Amb25775091 [0,0,1,0,0,0|1,0,2]=4 620 B12R1.8 C=C\C=C\CCc1ccccc1 Amb20248567 [0,0,1,0,0,0|2,0,1]=4 621 B12R1.8 C=C\C=C\NCc1ccccc1 Amb24512239 [0,0,1,0,0,0|1,0,2]=4 622 B12R1.8 CC#CCNCc1c[n]cc[n]1 Amb24342145 [0,0,1,0,0,0|1,0,2]=4 623 B12R1.8 CC#CCNCc1c[n]ccc1 Amb18797863 [0,0,1,0,0,0|0,0,2]=3 624 B12R1.8 CC#CCNCc1ccc[n][n]1 Amb24471983 [0,0,1,0,0,0|1,0,2]=4 625 B12R1.8 CC#CCNCc1ccccc1 Amb10233665 [0,0,1,0,0,0|1,0,2]=4 626 B12R1.8 CC#CCSCc1c[n]ccc1 Amb25741943 [0,0,1,0,0,0|1,0,2]=4 627 B12R1.8 CCCCCCc1cccnc1 Amb10807465 [0,0,1,0,0,0|1,0,2]=4 628 B12R1.8 CCCCNCc1c[n]ccc1 Amb20673559 [0,0,1,0,0,0|0,0,2]=3 629 B12R1.8 CC\C=C\CNc1c[n]cc[n]1 Amb24536492 [0,0,1,0,0,0|3,0,0]=4 630 B12R1.8 CC\C=C\CNc1ccc[n][n]1 Amb24570640 [0,0,1,0,0,0|3,0,0]=4 631 B12R1.8 CC\C=C\NCc1ccccc1 Amb24519259 [0,0,1,0,0,0|1,0,2]=4 632 B12R1.8 CNCCCCc1cccnc1 Amb17617748 [0,0,1,0,0,0|2,0,1]=4 633 B12R1.8 CNCCNCc1c[n]ccc1 Amb18798457 [0,0,1,0,0,0|1,0,1]=3 634 B12R1.8 CNCCSCc1c[n]ccc1 Amb21984678 [0,0,1,0,0,0|2,0,1]=4 635 B12R1.8 CSCCNCc1ccccc1 Amb18187025 [0,0,1,0,0,0|2,0,1]=4 636 B12R1.8 C\C=C\CNCc1ccccc1 Amb18645560 [0,0,1,0,0,0|1,0,0]=2 637 B12R1.8 ClCCCNCc1c[n]ccc1 Amb20573314 [0,0,1,0,0,0|1,0,2]=4 638 B12R1.8 Cl\C=C/COCc1ccccc1 Amb24711309 [0,0,1,0,0,0|3,0,0]=4 639 B12R1.8 N#CCCNCc1cccnc1 Amb1651452 [0,0,1,0,0,0|1,0,2]=4 640 B12R1.8 N#C\C=C\CCc1ccccc1 Amb17477529 [0,0,1,0,0,0|1,0,2]=4 641 B12R1.8 NCCCCCc1ccccc1 Amb18034503 [0,0,1,0,0,0|1,0,2]=4 642 B12R1.8 NCCCNCc1cccnc1 Amb17315286 [0,0,1,0,0,0|1,0,2]=4 643 B12R1.8 NCCNCCc1ccccc1 Amb1086596 [0,0,1,0,0,0|2,0,1]=4 644 B12R1.8 NCCNCCc1ccccc1 Amb22283881 [0,0,1,0,0,0|2,0,1]=4 645 B12R1.8 NCCOCCc1ccccc1 Amb19374389 [0,0,1,0,0,0|2,0,1]=4 646 B12R1.8 NC\C=C/C=C/c1ccccc1 Amb25199167 [0,0,1,0,0,0|1,0,2]=4 647 B12R1.8 NC\C=C\C=C\c1ccccc1 Amb10567259 [0,0,1,0,0,0|1,0,2]=4 648 B12R1.8 NC\C=C\CNc1c[n]cc[n]1 Amb25374647 [0,0,1,0,0,0|2,0,0]=3 649 B12R1.8 NC\C=C\CNc1cccc[n]1 Amb25724555 [0,0,1,0,0,0|3,0,0]=4 650 B12R1.8 NC\C=C\CNc1ccccc1 Amb25046454 [0,0,1,0,0,0|2,0,0]=3 651 B12R1.8 O=CNCNCc1ccccc1 Amb24532665 [0,0,1,0,0,0|3,0,0]=4 652 B12R1.8 O=C\C=C\NCc1ccccc1 Amb18645517 [0,0,1,0,0,0|2,0,1]=4 653 B12R1.8 OCCCNCc1cccnc1 Amb2114454 [0,0,1,0,0,0|1,0,2]=4 654 B12R1.8 OC\C=C\C=Cc1c[n]ccc1 Amb25158051 [0,0,1,0,0,0|1,0,2]=4 655 B12R1.30 C=CCCC(N)c1ccccc1 Amb18126305 [0,0,1,0,0,0|1,0,2]=4 656 B12R1.30 C=CCCN(c1ccccc1)C Amb10559130 [0,0,1,0,0,0|3,0,0]=4 657 B12R1.30 C=CCNC(=O)c1cccnc1 Amb17794173 [0,0,1,0,0,0|1,0,1]=3 658 B12R1.30 C=CCNC(=O)c1cnccn1 Amb17793533 [0,0,1,0,0,0|2,0,1]=4 659 B12R1.30 C=CCNC(=[Cl])c1ccccc1 Amb10560950 [0,0,1,0,0,0|2,0,1]=4 660 B12R1.30 CC#CCC(N)c1c[n]cc[n]1 Amb18988283 [0,0,1,0,0,0|1,0,2]=4 661 B12R1.30 CC#CCC(N)c1c[n]ccc1 Amb18988275 [0,0,1,0,0,0|0,0,2]=3 662 B12R1.30 CC#CCC(N)c1ccccc1 Amb18988278 [0,0,1,0,0,0|1,0,2]=4 663 B12R1.30 CC#CCC(O)c1c[n]ccc1 Amb18797973 [0,0,1,0,0,0|1,0,2]=4 664 B12R1.30 CC#CC[C@H](N)c1ccccc1 Amb25055199 [0,0,1,0,0,0|1,0,2]=4 665 B12R1.30 CC(CCC=C)c1ccccc1 Amb24062989 [0,0,1,0,0,0|2,0,0]=3 666 B12R1.30 CC(NCC#C)c1c[n]c[n]c1 Amb25295757 [0,0,1,0,0,0|1,0,2]=4 667 B12R1.30 CC(NCCO)c1c[n]cc[n]1 Amb21861913 [0,0,1,0,0,0|2,0,1]=4 668 B12R1.30 CC=C=CC(N)c1ccccc1 Amb25679572 [0,0,1,0,0,0|1,0,2]=4 669 B12R1.30 CC=C=C[C@H](N)c1ccccc1 Amb25771886 [0,0,1,0,0,0|1,0,2]=4 670 B12R1.30 CC=CCC(C)c1ccccc1 Amb24062990 [0,0,1,0,0,0|2,0,0]=3 671 B12R1.30 CCCCC(c1cccnc1)N Amb10607965 [0,0,1,0,0,0|0,0,2]=3 672 B12R1.30 CCCNC(c1ccccc1)C Amb1833463 [0,0,1,0,0,0|1,0,2]=4 673 B12R1.30 CCNCC(N)c1ccccc1 Amb19009737 [0,0,1,0,0,0|2,0,1]=4 674 B12R1.30 CCNCC(c1cccnc1)O Amb17138609 [0,0,1,0,0,0|2,0,1]=4 675 B12R1.30 CCOC[C@H](c1ccccc1)N Amb17061646 [0,0,1,0,0,0|2,0,1]=4 676 B12R1.30 CC\C=C/C(N)c1ccccc1 Amb25696046 [0,0,1,0,0,0|1,0,2]=4 677 B12R1.30 CN(OCC=C)c1ccccc1 Amb22366090 [0,0,1,0,0,0|3,0,0]=4 678 B12R1.30 C[C@@H](NCC#C)c1c[n]ccc1 Amb25073667 [0,0,1,0,0,0|0,0,2]=3 679 B12R1.30 C[C@@H](NCC#N)c1c[n]ccc1 Amb25310882 [0,0,1,0,0,0|1,0,1]=3 680 B12R1.30 C[C@@H](OCC=O)c1ccccc1 Amb22896802 [0,0,1,0,0,0|3,0,0]=4 681 B12R1.30 C[C@H](NCC#C)c1c[n]ccc1 Amb25348197 [0,0,1,0,0,0|0,0,2]=3 682 B12R1.30 C\C=C/CC(=O)c1ccccc1 Amb24594702 [0,0,1,0,0,0|2,0,1]=4 683 B12R1.30 C\C=C/NC(C)c1ccccc1 Amb25158747 [0,0,1,0,0,0|1,0,2]=4 684 B12R1.30 C\C=C\CC(O)c1c[n]ccc1 Amb25832725 [0,0,1,0,0,0|1,0,0]=2 685 B12R1.30 C\C=C\CN(C)c1ccccc1 Amb22546831 [0,0,1,0,0,0|3,0,0]=4 686 B12R1.30 C\C=C\CS(=O)c1c[n]cc[n]1 Amb25816075 [0,0,1,0,0,0|3,0,0]=4 687 B12R1.30 C\C=N\CC(O)c1ccccc1 Amb25256333 [0,0,1,0,0,0|3,0,0]=4 688 B12R1.30 ClCCNC(c1ccccc1)C Amb10069614 [0,0,1,0,0,0|2,0,1]=4 689 B12R1.30 ClCCNC(c1ccccc1)C Amb17335659 [0,0,1,0,0,0|2,0,1]=4 690 B12R1.30 NCCCC(c1cccnc1)N Amb10070101 [0,0,1,0,0,0|1,0,2]=4 691 B12R1.30 NCCNC(c1ccccc1)C Amb17091024 [0,0,1,0,0,0|2,0,1]=4 692 B12R1.30 O=CCNC(=O)c1cccnc1 Amb17102107 [0,0,1,0,0,0|2,0,1]=4 693 B12R1.30 OC(C\C=C/Cl)c1ccccc1 Amb25109311 [0,0,1,0,0,0|3,0,0]=4 694 B12R1.30 OCCNC(c1ccccc1)C Amb2092663 [0,0,1,0,0,0|2,0,1]=4 695 B12R1.30 O[C@H](C\C=C/Cl)c1ccccc1 Amb25751194 [0,0,1,0,0,0|3,0,0]=4 696 B14R3.2531 C1C2NCCC1c3ccccc32 Amb25039192 [0,0,0,1,0,0|1,0,2]=4 697 B14R3.2531 C1NCC2CC1c3c[n]ccc32 Amb24117518 [0,0,0,1,0,0|2,0,1]=4 698 B14R3.2544 C1NC2CCC1c3ccccc32 Amb18126200 [0,0,0,1,0,0|1,0,2]=4 699 B14R3.2936 C1NCC2(CC21)c3c[n]ccc3 Amb24649782 [0,0,0,1,0,0|2,0,1]=4 700 B12R2.2 C/1=CC=N\C1=C/2\C=CC=CN2 Amb24763473 [0,0,0,0,1,0|0,0,3]=4 701 B12R2.2 C1=NC(CC1)c2cccnc2 Amb17616205 [0,0,0,0,1,0|0,0,2]=3 702 B12R2.2 C1C=CC(N1)c2c[n]cc[n]2 Amb24458701 [0,0,0,0,1,0|1,0,0]=2 703 B12R2.2 C1C=CC(N1)c2c[n]ccc2 Amb25076492 [0,0,0,0,1,0|0,0,0]=1 704 B12R2.2 C1C=CC(N1)c2ccccc2 Amb25087257 [0,0,0,0,1,0|1,0,0]=2 705 B12R2.2 C1C=CCCC1c2[n]cco2 Amb25305822 [0,0,0,0,1,0|2,0,0]=3 706 B12R2.2 C1C=CCP1c2ccccc2 Amb25736369 [0,0,0,0,1,0|2,0,0]=3 707 B12R2.2 C1C=CNC1c2c[n]ccc2 Amb24085149 [0,0,0,0,1,0|0,0,0]=1 708 B12R2.2 C1C=COC1c2ccccc2 Amb24081226 [0,0,0,0,1,0|2,0,0]=3 709 B12R2.2 C1C=NC(N1)c2ccccc2 Amb25145901 [0,0,0,0,1,0|2,0,0]=3 710 B12R2.2 C1C=NC(S1)c2ccccc2 Amb25375170 [0,0,0,0,1,0|3,0,0]=4 711 B12R2.2 C1C=NNC1c2cc[n]cc2 Amb25151828 [0,0,0,0,1,0|3,0,0]=4 712 B12R2.2 C1CC=C(N1)c2ccccc2 Amb17938860 [0,0,0,0,1,0|1,0,2]=4 713 B12R2.2 C1CCC(N1)c2[n][n]cc[n]2 Amb18224273 [0,0,0,0,1,0|2,0,1]=4 714 B12R2.2 C1CCC(N1)c2c[n][n]cc2 Amb18125020 [0,0,0,0,1,0|1,0,1]=3 715 B12R2.2 C1CCC(N1)c2c[n]c[n]c2 Amb21959835 [0,0,0,0,1,0|1,0,1]=3 716 B12R2.2 C1CCC(N1)c2c[n]cc[n]2 Amb21960665 [0,0,0,0,1,0|1,0,1]=3 717 B12R2.2 C1CCC(N1)c2c[n]ccc2 Amb17659140 [0,0,0,0,1,0|0,0,1]=2 718 B12R2.2 C1CCC(N1)c2c[n]ccc2 Amb22899128 [0,0,0,0,1,0|0,0,1]=2 719 B12R2.2 C1CCC(N1)c2cc[n]cc2 Amb17659139 [0,0,0,0,1,0|2,0,1]=4 720 B12R2.2 C1CCC(N1)c2ccc[n][n]2 Amb24568934 [0,0,0,0,1,0|1,0,1]=3 721 B12R2.2 C1CCC(N1)c2cccc[n]2 Amb21960411 [0,0,0,0,1,0|2,0,1]=4 722 B12R2.2 C1CCC(NC1)c2ccco2 Amb2234909 [0,0,0,0,1,0|1,0,2]=4 723 B12R2.2 C1CCC(NC1)c2cccs2 Amb2234701 [0,0,0,0,1,0|1,0,2]=4 724 B12R2.2 C1CCC(NC1)c2nccs2 Amb2234731 [0,0,0,0,1,0|1,0,2]=4 725 B12R2.2 C1CCC(S1)c2c[n]ccc2 Amb19373816 [0,0,0,0,1,0|1,0,1]=3 726 B12R2.2 C1CCC(S1)c2ccccc2 Amb25801021 [0,0,0,0,1,0|2,0,1]=4 727 B12R2.2 C1CCC=C1c2c[n]ccc2 Amb25357774 [0,0,0,0,1,0|1,0,2]=4 728 B12R2.2 C1CCCC(N1)c2[n]cc[s]2 Amb19373128 [0,0,0,0,1,0|1,0,2]=4 729 B12R2.2 C1CCCC(N1)c2c[nH][n]c2 Amb19330096 [0,0,0,0,1,0|1,0,2]=4 730 B12R2.2 C1CCCC(N1)c2c[nH]cc2 Amb18065337 [0,0,0,0,1,0|0,0,3]=4 731 B12R2.2 C1CCCC(N1)c2c[n][s]c2 Amb18199186 [0,0,0,0,1,0|1,0,2]=4 732 B12R2.2 C1CCCC(N1)c2c[n]co2 Amb25350904 [0,0,0,0,1,0|1,0,2]=4 733 B12R2.2 C1CCCC(N1)c2c[n]oc2 Amb18831195 [0,0,0,0,1,0|1,0,2]=4 734 B12R2.2 C1CCCC(N1)c2cc[nH][n]2 Amb18201546 [0,0,0,0,1,0|1,0,2]=4 735 B12R2.2 C1CCCC(N1)c2cc[nH][n]2 Amb21955888 [0,0,0,0,1,0|1,0,2]=4 736 B12R2.2 C1CCCC(N1)c2cc[n][s]2 Amb24657779 [0,0,0,0,1,0|1,0,2]=4 737 B12R2.2 C1CCCC(N1)c2cc[n]o2 Amb23438252 [0,0,0,0,1,0|1,0,2]=4 738 B12R2.2 C1CCCC(N1)c2ccc[nH]2 Amb25084564 [0,0,0,0,1,0|0,0,3]=4 739 B12R2.2 C1CCCC(N1)c2coc[n]2 Amb18201340 [0,0,0,0,1,0|1,0,2]=4 740 B12R2.2 C1CCCC1c2c[n]c[n]c2 Amb24684970 [0,0,0,0,1,0|1,0,2]=4 741 B12R2.2 C1CCCC1c2c[n]ccc2 Amb25121665 [0,0,0,0,1,0|0,0,2]=3 742 B12R2.2 C1CCC[C@@H](N1)c2[n]cc[s]2 Amb20241515 [0,0,0,0,1,0|1,0,2]=4 743 B12R2.2 C1CCC[C@H](N1)c2[n]cc[s]2 Amb20241518 [0,0,0,0,1,0|1,0,2]=4 744 B12R2.2 C1CCC[C@H](N1)c2c[s]cc2 Amb24437132 [0,0,0,0,1,0|1,0,2]=4 745 B12R2.2 C1CCN(N1)c2c[n]cc[n]2 Amb25243762 [0,0,0,0,1,0|2,0,1]=4 746 B12R2.2 C1CCN=C1c2c[n]ccc2 Amb21917062 [0,0,0,0,1,0|0,0,3]=4 747 B12R2.2 C1CC[C@@H](N1)c2c[n]cc[n]2 Amb25843337 [0,0,0,0,1,0|1,0,1]=3 748 B12R2.2 C1CC[C@@H](N1)c2c[n]ccc2 Amb22748224 [0,0,0,0,1,0|0,0,1]=2 749 B12R2.2 C1CC[C@@H](N1)c2c[n]ccc2 Amb22899133 [0,0,0,0,1,0|0,0,1]=2 750 B12R2.2 C1CC[C@@H](N1)c2cccc[n]2 Amb22747201 [0,0,0,0,1,0|2,0,1]=4 751 B12R2.2 C1CC[C@@H](N1)c2cccc[n]2 Amb22754028 [0,0,0,0,1,0|2,0,1]=4 752 B12R2.2 C1CC[C@@H](N1)c2cccc[n]2 Amb22754034 [0,0,0,0,1,0|2,0,1]=4 753 B12R2.2 C1CC[C@@H](N1)c2ccccc2 Amb20241932 [0,0,0,0,1,0|1,0,1]=3 754 B12R2.2 C1CC[C@@H](NC1)c2ccco2 Amb13886455 [0,0,0,0,1,0|1,0,2]=4 755 B12R2.2 C1CC[C@H](N1)c2c[n]c[n]c2 Amb24657188 [0,0,0,0,1,0|1,0,1]=3 756 B12R2.2 C1CC[C@H](N1)c2cccc[n]2 Amb22802416 [0,0,0,0,1,0|2,0,1]=4 757 B12R2.2 C1CC[C@H](N1)c2ccccc2 Amb20241933 [0,0,0,0,1,0|1,0,1]=3 758 B12R2.2 C1CNC(C1)c2ccccc2 Amb10808365 [0,0,0,0,1,0|1,0,1]=3 759 B12R2.2 C1CNC(C1)c2ccccc2 Amb1106311 [0,0,0,0,1,0|1,0,1]=3 760 B12R2.2 C1CNC(C1)c2ccccn2 Amb2235736 [0,0,0,0,1,0|2,0,1]=4 761 B12R2.2 C1CNC(C1)c2cccnc2 Amb10067968 [0,0,0,0,1,0|0,0,1]=2 762 B12R2.2 C1CNC(C1)c2cccnc2 Amb2234638 [0,0,0,0,1,0|0,0,1]=2 763 B12R2.2 C1CNC(C1)c2ccncc2 Amb1162826 [0,0,0,0,1,0|2,0,1]=4 764 B12R2.2 C1CNC(C1)c2ccncc2 Amb2234645 [0,0,0,0,1,0|2,0,1]=4 765 B12R2.2 C1CNC(C1)c2cncnc2 Amb16187083 [0,0,0,0,1,0|1,0,1]=3 766 B12R2.2 C1CNC(CN1)c2ccco2 Amb10070785 [0,0,0,0,1,0|2,0,1]=4 767 B12R2.2 C1CNC(CN1)c2cscc2 Amb10982508 [0,0,0,0,1,0|2,0,1]=4 768 B12R2.2 C1CNC(CS1)c2cccs2 Amb17234247 [0,0,0,0,1,0|2,0,1]=4 769 B12R2.2 C1COC(C1)c2ccccc2 Amb17334283 [0,0,0,0,1,0|2,0,1]=4 770 B12R2.2 C1COC(N1)c2ccccc2 Amb17334284 [0,0,0,0,1,0|2,0,1]=4 771 B12R2.2 C1COC(N1)c2cccnc2 Amb17334299 [0,0,0,0,1,0|1,0,1]=3 772 B12R2.2 C1COC(O1)c2cccnc2 Amb17334308 [0,0,0,0,1,0|2,0,1]=4 773 B12R2.2 C1N=CNC1c2c[n]ccc2 Amb24085256 [0,0,0,0,1,0|1,0,0]=2 774 B12R2.2 C1NC(CO1)c2ccccc2 Amb25258799 [0,0,0,0,1,0|2,0,0]=3 775 B12R2.2 C1NC(CS1)c2ccccc2 Amb24460745 [0,0,0,0,1,0|2,0,0]=3 776 B12R2.2 C1NCC(C1)c2ccccc2 Amb10069263 [0,0,0,0,1,0|2,0,1]=4 777 B12R2.2 C1NCC(C1)c2ccccc2 Amb10072809 [0,0,0,0,1,0|2,0,1]=4 778 B12R2.2 C1NCC(C1)c2cnccn2 Amb10068866 [0,0,0,0,1,0|2,0,1]=4 779 B12R2.2 C1NCC(O1)c2c[n]ccc2 Amb18065317 [0,0,0,0,1,0|2,0,0]=3 780 B12R2.2 C1NCC(O1)c2ccccc2 Amb18065307 [0,0,0,0,1,0|3,0,0]=4 781 B12R2.2 C1NCCC1c2c[n]c[n]c2 Amb18202037 [0,0,0,0,1,0|2,0,1]=4 782 B12R2.2 C1NCCC1c2c[n]c[n]c2 Amb21961683 [0,0,0,0,1,0|2,0,1]=4 783 B12R2.2 C1NCCC1c2c[n]c[n]c2 Amb22292101 [0,0,0,0,1,0|2,0,1]=4 784 B12R2.2 C1NCCC1c2c[n]cc[n]2 Amb22735780 [0,0,0,0,1,0|2,0,1]=4 785 B12R2.2 C1NCCC1c2c[n]ccc2 Amb19958035 [0,0,0,0,1,0|1,0,1]=3 786 B12R2.2 C1NCCC1c2c[n]ccc2 Amb22490712 [0,0,0,0,1,0|1,0,1]=3 787 B12R2.2 C1NCCC1c2ccc[n][n]2 Amb24538769 [0,0,0,0,1,0|2,0,1]=4 788 B12R2.2 C1NCCNC1c2c[nH][n]c2 Amb25293720 [0,0,0,0,1,0|2,0,1]=4 789 B12R2.2 C1NCCNC1c2c[nH]cc2 Amb18065361 [0,0,0,0,1,0|1,0,2]=4 790 B12R2.2 C1NCCNC1c2cc[nH]n2 Amb13882911 [0,0,0,0,1,0|2,0,1]=4 791 B12R2.2 C1NCCNC1c2ccc[nH]2 Amb24484576 [0,0,0,0,1,0|1,0,2]=4 792 B12R2.2 C1NCCNC1c2cocc2 Amb24089815 [0,0,0,0,1,0|2,0,1]=4 793 B12R2.2 C1NCCN[C@H]1c2ccc[nH]2 Amb25836792 [0,0,0,0,1,0|1,0,2]=4 794 B12R2.2 C1NCCN[C@H]1c2ccc[s]2 Amb24417560 [0,0,0,0,1,0|2,0,1]=4 795 B12R2.2 C1NCCN[C@H]1c2cocc2 Amb25077196 [0,0,0,0,1,0|2,0,1]=4 796 B12R2.2 C1NCC[C@@H]1c2c[n]ccc2 Amb24673743 [0,0,0,0,1,0|1,0,1]=3 797 B12R2.2 C1NCC[C@@H]1c2ccccc2 Amb19887561 [0,0,0,0,1,0|2,0,1]=4 798 B12R2.2 C1NCC[C@@H]1c2ccccc2 Amb24183516 [0,0,0,0,1,0|2,0,1]=4 799 B12R2.2 C1NCC[C@H]1c2c[n]ccc2 Amb24085651 [0,0,0,0,1,0|1,0,1]=3 800 B12R2.2 C1NCC[C@H]1c2ccccc2 Amb19888399 [0,0,0,0,1,0|2,0,1]=4 801 B12R2.2 C1OC=NC1c2ccccc2 Amb20247138 [0,0,0,0,1,0|2,0,1]=4 802 B12R2.2 C1OC=NN1c2c[n]ccc2 Amb24085088 [0,0,0,0,1,0|2,0,1]=4 803 B12R2.2 C1OCCC1c2c[n]ccc2 Amb24320767 [0,0,0,0,1,0|1,0,1]=3 804 B12R2.2 C1OCCC1c2ccccc2 Amb21960825 [0,0,0,0,1,0|2,0,1]=4 805 B12R2.2 C1OCCNC1c2c[nH][n]c2 Amb18201043 [0,0,0,0,1,0|2,0,1]=4 806 B12R2.2 C1OCCNC1c2c[nH]cc2 Amb18563448 [0,0,0,0,1,0|1,0,2]=4 807 B12R2.2 C1OCCNC1c2c[n][s]c2 Amb18198870 [0,0,0,0,1,0|2,0,1]=4 808 B12R2.2 C1OCCNC1c2c[n]oc2 Amb18200792 [0,0,0,0,1,0|2,0,1]=4 809 B12R2.2 C1OCCNC1c2c[s]c[n]2 Amb18198874 [0,0,0,0,1,0|2,0,1]=4 810 B12R2.2 C1OCCNC1c2c[s]cc2 Amb22236069 [0,0,0,0,1,0|2,0,1]=4 811 B12R2.2 C1OCCNC1c2cc[nH][n]2 Amb18201045 [0,0,0,0,1,0|2,0,1]=4 812 B12R2.2 C1OCCNC1c2cc[n]o2 Amb18200794 [0,0,0,0,1,0|2,0,1]=4 813 B12R2.2 C1OCCNC1c2cocc2 Amb22236071 [0,0,0,0,1,0|2,0,1]=4 814 B12R2.2 C1OCCN[C@@H]1c2[nH]cc[n]2 Amb25330125 [0,0,0,0,1,0|2,0,1]=4 815 B12R2.2 C1OCCN[C@@H]1c2c[nH]cc2 Amb24405088 [0,0,0,0,1,0|1,0,2]=4 816 B12R2.2 C1OCCN[C@@H]1c2c[s]cc2 Amb22746808 [0,0,0,0,1,0|2,0,1]=4 817 B12R2.2 C1OCCN[C@@H]1c2ccc[s]2 Amb22746807 [0,0,0,0,1,0|2,0,1]=4 818 B12R2.2 C1OCCN[C@@H]1c2ccco2 Amb24586281 [0,0,0,0,1,0|2,0,1]=4 819 B12R2.2 C1OCCN[C@@H]1c2cocc2 Amb22746810 [0,0,0,0,1,0|2,0,1]=4 820 B12R2.2 C1OCCN[C@H]1c2ccc[nH]2 Amb25087994 [0,0,0,0,1,0|1,0,2]=4 821 B12R2.2 C1OCCN[C@H]1c2ccc[s]2 Amb25303548 [0,0,0,0,1,0|2,0,1]=4 822 B12R2.2 C1OCCN[C@H]1c2cocc2 Amb24383735 [0,0,0,0,1,0|2,0,1]=4 823 B12R2.2 C1OCOC1c2ccccc2 Amb24101078 [0,0,0,0,1,0|3,0,0]=4 824 B12R2.2 C1SCCNC1c2[nH]cc[n]2 Amb25794092 [0,0,0,0,1,0|2,0,1]=4 825 B12R2.2 C1SCCNC1c2[n]cc[s]2 Amb24390718 [0,0,0,0,1,0|2,0,1]=4 826 B12R2.2 C1SCCNC1c2c[nH]cc2 Amb18563876 [0,0,0,0,1,0|1,0,2]=4 827 B12R2.2 C1SCCNC1c2c[s]cc2 Amb24485857 [0,0,0,0,1,0|2,0,1]=4 828 B12R2.2 C1SCCNC1c2cc[nH][n]2 Amb18825901 [0,0,0,0,1,0|2,0,1]=4 829 B12R2.2 c1[n]c[n]cc1-c2[nH]cc[n]2 Amb24671078 [0,0,0,0,1,0|2,0,1]=4 830 B12R2.2 c1[n]cccc1-[n]2[n]cc[n]2 Amb24085197 [0,0,0,0,1,0|2,0,1]=4 831 B12R2.2 c1[n]cccc1-[n]2cc[n][n]2 Amb24085121 [0,0,0,0,1,0|2,0,1]=4 832 B12R2.2 c1[n]cccc1-[n]2ccc[n]2 Amb19515135 [0,0,0,0,1,0|1,0,2]=4 833 B12R2.2 c1[n]cccc1-[n]2cccc2 Amb22741091 [0,0,0,0,1,0|1,0,2]=4 834 B12R2.2 c1[n]cccc1-c2c[n]c[nH]2 Amb22491868 [0,0,0,0,1,0|1,0,2]=4 835 B12R2.2 c1[n]cccc1-c2cc[n]o2 Amb24085086 [0,0,0,0,1,0|2,0,1]=4 836 B12R2.2 c1[n]cccc1-c2ccco2 Amb24087423 [0,0,0,0,1,0|1,0,2]=4 837 B12R2.2 c1[n]cccc1-c2cco[n]2 Amb19887524 [0,0,0,0,1,0|1,0,2]=4 838 B12R2.2 c1c[nH]c(n1)-c2ccccc2 Amb17842973 [0,0,0,0,1,0|2,0,1]=4 839 B12R2.2 c1cc(cc[n]1)C2NC=CN2 Amb24102710 [0,0,0,0,1,0|3,0,0]=4 840 B12R2.2 c1ccc(cc1)c2ccn[nH]2 Amb10235721 [0,0,0,0,1,0|2,0,1]=4 841 B12R2.2 c1ccc(cn1)c2n[nH]cc2 Amb2426915 [0,0,0,0,1,0|1,0,2]=4 842 B12R2.2 c1ccc(cn1)c2ncco2 Amb17399898 [0,0,0,0,1,0|1,0,2]=4 843 B12R2.2 c1ccc(cn1)c2nccs2 Amb10601030 [0,0,0,0,1,0|1,0,2]=4 844 B12R2.2 c1ccc(cn1)n2cccc2 Amb2236511 [0,0,0,0,1,0|1,0,2]=4 845 B12R2.2 c1ccc(cn1)n2cncc2 Amb2540105 [0,0,0,0,1,0|3,0,0]=4 846 B12R2.2 c1cccc([n]1)C2NC=CO2 Amb24070044 [0,0,0,0,1,0|3,0,0]=4 847 B12R2.2 c1ccccc1-c2[nH]cc[p]2 Amb24533180 [0,0,0,0,1,0|2,0,1]=4 848 B12R2.2 c1ccccc1C2C=CC=C2 Amb24351108 [0,0,0,0,1,0|1,0,2]=4 849 B12R2.2 c1ccccc1C2NC=CO2 Amb20621985 [0,0,0,0,1,0|2,0,0]=3 850 B12R2.2 c1cnc(cn1)c2ncc[nH]2 Amb13952512 [0,0,0,0,1,0|2,0,1]=4 851 B14R2.6 C(C1C=CCCN1)c2ccccc2 Amb18127112 [0,0,0,0,0,1|1,0,2]=4 852 B14R2.6 C(C1CCCCN1)c2c[n]c[n]c2 Amb18962129 [0,0,0,0,0,1|1,0,2]=4 853 B14R2.6 C(C1CCCCN1)c2c[n]cc[n]2 Amb25726165 [0,0,0,0,0,1|1,0,2]=4 854 B14R2.6 C(C1CCCCN1)c2c[n]ccc2 Amb24085209 [0,0,0,0,0,1|0,0,2]=3 855 B14R2.6 C(C1CCCCN1)c2ccccc2 Amb17659191 [0,0,0,0,0,1|1,0,2]=4 856 B14R2.6 C([C@@H]1CCCCN1)c2ccccc2 Amb22892828 [0,0,0,0,0,1|1,0,2]=4 857 B14R2.6 C([C@H]1CC=CCN1)c2ccccc2 Amb25035648 [0,0,0,0,0,1|1,0,0]=2 858 B14R2.6 C1=CCN(CC1)Cc2ccccc2 Amb13885466 [0,0,0,0,0,1|3,0,0]=4 859 B14R2.6 C1C=CCCC1Nc2c[n]cc[n]2 Amb25265490 [0,0,0,0,0,1|2,0,0]=3 860 B14R2.6 C1C=CCCC1Nc2cccc[n]2 Amb25155046 [0,0,0,0,0,1|3,0,0]=4 861 B14R2.6 C1C=CCCN1Cc2c[n]ccc2 Amb25669086 [0,0,0,0,0,1|2,0,0]=3 862 B14R2.6 C1C=CCCN1Cc2ccccc2 Amb20240698 [0,0,0,0,0,1|3,0,0]=4 863 B14R2.6 C1CC(CCN1)Nc2c[n]ccc2 Amb22058875 [0,0,0,0,0,1|2,0,1]=4 864 B14R2.6 C1CC(CCN1)Oc2c[n]ccc2 Amb21955228 [0,0,0,0,0,1|2,0,1]=4 865 B14R2.6 C1CC(CCN1)Oc2c[n]ccc2 Amb21957650 [0,0,0,0,0,1|2,0,1]=4 866 B14R2.6 C1CC(CCN1)Sc2c[n]ccc2 Amb24580735 [0,0,0,0,0,1|2,0,1]=4 867 B14R2.6 C1CC(CCO1)Oc2ccc[n]c2 Amb24681912 [0,0,0,0,0,1|2,0,1]=4 868 B14R2.6 C1CCC(C=C1)Oc2c[n]ccc2 Amb24085172 [0,0,0,0,0,1|1,0,2]=4 869 B14R2.6 C1CCC(CN1)Cc2cccnc2 Amb10068907 [0,0,0,0,0,1|2,0,1]=4 870 B14R2.6 C1CCC(NC1)Cc2ccccc2 Amb1087934 [0,0,0,0,0,1|1,0,2]=4 871 B14R2.6 C1CCC(NC1)Cc2ccccc2 Amb2236228 [0,0,0,0,0,1|1,0,2]=4 872 B14R2.6 C1CNC(CN1)Cc2cccnc2 Amb15690740 [0,0,0,0,0,1|1,0,1]=3 873 B14R2.6 C1NCCCC1Nc2c[n]ccc2 Amb18955857 [0,0,0,0,0,1|2,0,1]=4 874 B14R2.6 C1NCCCC1Oc2c[n]ccc2 Amb21954944 [0,0,0,0,0,1|2,0,1]=4 875 B14R2.6 C1NCCCC1Oc2c[n]ccc2 Amb21957649 [0,0,0,0,0,1|2,0,1]=4 876 B14R2.6 C1NCCC[C@@H]1Cc2c[n]ccc2 Amb24578489 [0,0,0,0,0,1|2,0,1]=4 877 B14R2.6 C1NCCC[C@@H]1Oc2c[n]ccc2 Amb24468289 [0,0,0,0,0,1|2,0,1]=4 878 B14R2.6 C1NCCC[C@H]1Cc2c[n]ccc2 Amb25288614 [0,0,0,0,0,1|2,0,1]=4 879 B14R2.6 C1NCCNC1Cc2c[n]ccc2 Amb22491673 [0,0,0,0,0,1|1,0,1]=3 880 B14R2.6 C1NCCNC1Cc2ccccc2 Amb20240950 [0,0,0,0,0,1|2,0,1]=4 881 B14R2.6 C1NCCN[C@@H]1Cc2c[n]ccc2 Amb22284340 [0,0,0,0,0,1|1,0,1]=3 882 B14R2.6 C1NCCN[C@@H]1Cc2ccccc2 Amb19515800 [0,0,0,0,0,1|2,0,1]=4 883 B14R2.6 C1NCCN[C@@H]1Cc2ccccc2 Amb22752072 [0,0,0,0,0,1|2,0,1]=4 884 B14R2.6 C1NCCN[C@@H]1Cc2ccccc2 Amb22752073 [0,0,0,0,0,1|2,0,1]=4 885 B14R2.6 C1NCCN[C@H]1Cc2c[n]ccc2 Amb22284339 [0,0,0,0,0,1|1,0,1]=3 886 B14R2.6 C1OCCCC1Oc2c[n]ccc2 Amb25698730 [0,0,0,0,0,1|2,0,1]=4 887 B14R2.6 C1OCCN[C@@H]1Cc2ccccc2 Amb20242985 [0,0,0,0,0,1|2,0,1]=4 888 B14R2.6 C1OCCN[C@@H]1Cc2ccccc2 Amb24077524 [0,0,0,0,0,1|2,0,1]=4 889 B14R2.6 C1OCCN[C@H]1Cc2ccccc2 Amb20242986 [0,0,0,0,0,1|2,0,1]=4 890 B14R2.6 C1OCCN[C@H]1Cc2ccccc2 Amb22226651 [0,0,0,0,0,1|2,0,1]=4 891 B14R2.6 C1SCCCC1Nc2c[n]ccc2 Amb18287632 [0,0,0,0,0,1|2,0,1]=4 892 B14R2.6 C1SCCNC1Cc2ccccc2 Amb18565445 [0,0,0,0,0,1|2,0,1]=4 893 B14R2.6 C1SCCN[C@H]1Cc2ccccc2 Amb24627357 [0,0,0,0,0,1|2,0,1]=4 894 B14R2.6 N1CCC(CC1)Cc2cccnc2 Amb10068863 [0,0,0,0,0,1|2,0,1]=4 895 B14R2.6 N1CCC(CC1)Nc2cccnc2 Amb13952495 [0,0,0,0,0,1|2,0,1]=4 896 B14R2.6 N1CCNC(C1)Cc2ccccc2 Amb10068437 [0,0,0,0,0,1|2,0,1]=4 897 B14R2.6 N1CCN[C@H](C1)Cc2ccccc2 Amb15690734 [0,0,0,0,0,1|2,0,1]=4 898 B14R2.6 O1CCNC(C1)Cc2ccccc2 Amb10068897 [0,0,0,0,0,1|2,0,1]=4 899 B14R2.1253 C1CCNC(CC1)c2ccccc2 Amb10609226 [0,0,0,0,0,1|1,0,2]=4 900 B14R2.1253 C1CCNC(CC1)c2ccccc2 Amb2234659 [0,0,0,0,0,1|1,0,2]=4 901 B14R2.1253 C1COCCC(N1)c2ccccc2 Amb22750167 [0,0,0,0,0,1|1,0,2]=4 902 B14R2.1253 C1NCC=CCC1c2c[n]ccc2 Amb25795406 [0,0,0,0,0,1|0,0,0]=1 903 B14R2.1253 C1NCC=CCC1c2cc[n]cc2 Amb24496179 [0,0,0,0,0,1|2,0,0]=3 904 B14R2.1253 C1NCCCCC1c2c[n]cc[n]2 Amb24563162 [0,0,0,0,0,1|1,0,2]=4 905 B14R2.1253 C1NCCCCC1c2ccccc2 Amb21937009 [0,0,0,0,0,1|1,0,2]=4 906 B14R2.1253 C1NCCOCC1c2ccccc2 Amb18065703 [0,0,0,0,0,1|2,0,1]=4 907 B14R2.1253 C1NCCSCC1c2ccccc2 Amb25198560 [0,0,0,0,0,1|2,0,1]=4 908 B14R2.1253 C1SCCCNC1c2ccccc2 Amb25341704 [0,0,0,0,0,1|1,0,2]=4 909 B11R1.12 C=CC(NN)c1c[n][n]cc1 Amb24548796 [1,0,1,0,0,0|2,0,0]=4 910 B11R1.12 C=CC(NN)c1c[n]c[n]c1 Amb25304835 [1,0,1,0,0,0|2,0,0]=4 911 B11R1.12 C=CC(NN)c1c[n]ccc1 Amb24427177 [1,0,1,0,0,0|1,0,0]=3 912 B11R1.12 C=CC(NN)c1ccccc1 Amb25287533 [1,0,1,0,0,0|2,0,0]=4 913 B11R1.12 CCC(C=C)c1ccccc1 Amb24485761 [1,0,1,0,0,0|2,0,0]=4 914 B11R1.12 CCC(CN)c1c[n]ccc1 Amb18251338 [1,0,1,0,0,0|1,0,1]=4 915 B11R1.12 CCC(CO)c1c[n]ccc1 Amb25043708 [1,0,1,0,0,0|1,0,1]=4 916 B11R1.12 CCC(NC)c1c[n]c[n]c1 Amb18298659 [1,0,1,0,0,0|1,0,1]=4 917 B11R1.12 CCC(NC)c1c[n]cc[n]1 Amb18301460 [1,0,1,0,0,0|1,0,1]=4 918 B11R1.12 CCC(NC)c1ccccc1 Amb22492401 [1,0,1,0,0,0|1,0,1]=4 919 B11R1.12 CCC(NN)c1c[n]ccc1 Amb24484404 [1,0,1,0,0,0|1,0,1]=4 920 B11R1.12 CCC(NO)c1c[n]ccc1 Amb25344867 [1,0,1,0,0,0|1,0,1]=4 921 B11R1.12 CCC(c1ccccc1)NC Amb1116786 [1,0,1,0,0,0|1,0,1]=4 922 B11R1.12 CCC(c1cccnc1)NC Amb10607958 [1,0,1,0,0,0|0,0,1]=3 923 B11R1.12 CC[C@@H](NO)c1c[n]ccc1 Amb24486823 [1,0,1,0,0,0|1,0,1]=4 924 B11R1.12 CNC(C#N)c1c[n]ccc1 Amb22551064 [1,0,1,0,0,0|1,0,1]=4 925 B11R1.12 CNC(C=C)c1cccc[n]1 Amb25341977 [1,0,1,0,0,0|2,0,0]=4 926 B11R1.12 CNC(C=C)c1ccccc1 Amb18124852 [1,0,1,0,0,0|1,0,0]=3 927 B11R1.12 CNC(CBr)c1ccccc1 Amb25095723 [1,0,1,0,0,0|2,0,0]=4 928 B11R1.12 CNC(CF)c1c[n]ccc1 Amb25270473 [1,0,1,0,0,0|1,0,0]=3 929 B11R1.12 CNC(CF)c1ccccc1 Amb23443830 [1,0,1,0,0,0|2,0,0]=4 930 B11R1.12 CNC(CN)c1c[n]c[n]c1 Amb24636225 [1,0,1,0,0,0|2,0,0]=4 931 B11R1.12 CNC(CN)c1c[n]ccc1 Amb18985333 [1,0,1,0,0,0|1,0,0]=3 932 B11R1.12 CNC(CO)c1ccccc1 Amb18035932 [1,0,1,0,0,0|2,0,0]=4 933 B11R1.12 CNC(c1cccnc1)CO Amb17232101 [1,0,1,0,0,0|1,0,0]=3 934 B11R1.12 CN[C@@H](CO)c1c[n]cc[n]1 Amb25808073 [1,0,1,0,0,0|2,0,0]=4 935 B11R1.12 CN[C@@H](CO)c1ccccc1 Amb22746483 [1,0,1,0,0,0|2,0,0]=4 936 B11R1.12 CN[C@@H](CO)c1ccccc1 Amb23400921 [1,0,1,0,0,0|2,0,0]=4 937 B11R1.12 CN[C@H](CO)c1c[n]ccc1 Amb24745307 [1,0,1,0,0,0|1,0,0]=3 938 B11R1.12 COC(C=C)c1ccccc1 Amb22002227 [1,0,1,0,0,0|2,0,0]=4 939 B11R1.12 COC(CN)c1c[n]ccc1 Amb18980565 [1,0,1,0,0,0|2,0,0]=4 940 B11R1.12 CSC(CN)c1c[n]ccc1 Amb18293257 [1,0,1,0,0,0|2,0,0]=4 941 B11R1.12 NCC(CN)c1c[n]ccc1 Amb18065357 [1,0,1,0,0,0|2,0,0]=4 942 B11R1.12 NCC(CO)c1c[n]ccc1 Amb18644523 [1,0,1,0,0,0|2,0,0]=4 943 B11R1.12 NCC(c1ccccc1)NC Amb10879686 [1,0,1,0,0,0|2,0,0]=4 944 B11R1.12 OCC(NO)c1c[n]ccc1 Amb25344594 [1,0,1,0,0,0|2,0,0]=4 945 B11R1.12 OC[C@@H](NO)c1c[n]ccc1 Amb25704259 [1,0,1,0,0,0|2,0,0]=4 946 B11R1.16 C#CCC(N)c1c[n]ccc1 Amb18959769 [1,0,1,0,0,0|0,0,2]=4 947 B11R1.16 C=CCC(=O)c1cccnc1 Amb17334267 [1,0,1,0,0,0|1,0,1]=4 948 B11R1.16 C=CCC(Br)c1ccccc1 Amb24668989 [1,0,1,0,0,0|2,0,0]=4 949 B11R1.16 C=CCC(N)c1c[n]cc[n]1 Amb18292011 [1,0,1,0,0,0|1,0,0]=3 950 B11R1.16 C=CCC(N)c1c[n]ccc1 Amb18292092 [1,0,1,0,0,0|0,0,0]=2 951 B11R1.16 C=CCC(N)c1cc[n]cc1 Amb18292093 [1,0,1,0,0,0|2,0,0]=4 952 B11R1.16 C=CCC(N)c1cc[n]cc1 Amb19374106 [1,0,1,0,0,0|2,0,0]=4 953 B11R1.16 C=CCC(N)c1cccc[n]1 Amb18977590 [1,0,1,0,0,0|2,0,0]=4 954 B11R1.16 C=CCC(N)c1ccccc1 Amb22831520 [1,0,1,0,0,0|1,0,0]=3 955 B11R1.16 C=CCC(O)c1c[n]cc[n]1 Amb18177151 [1,0,1,0,0,0|2,0,0]=4 956 B11R1.16 C=CCC(O)c1ccccc1 Amb22228007 [1,0,1,0,0,0|2,0,0]=4 957 B11R1.16 C=CCC(c1ccccc1)N Amb17226687 [1,0,1,0,0,0|1,0,0]=3 958 B11R1.16 C=CCC(c1ccccc1)O Amb2389146 [1,0,1,0,0,0|2,0,0]=4 959 B11R1.16 C=CCN(c1ccccc1)N Amb17226668 [1,0,1,0,0,0|2,0,0]=4 960 B11R1.16 C=CC[C@@H](N)c1c[n]cc[n]1 Amb24504922 [1,0,1,0,0,0|1,0,0]=3 961 B11R1.16 C=CC[C@@H](N)c1c[n]ccc1 Amb24487504 [1,0,1,0,0,0|0,0,0]=2 962 B11R1.16 C=CC[C@@H](N)c1cccc[n]1 Amb25844369 [1,0,1,0,0,0|2,0,0]=4 963 B11R1.16 C=CC[C@@H](N)c1ccccc1 Amb22829899 [1,0,1,0,0,0|1,0,0]=3 964 B11R1.16 C=CC[C@@H](N)c1ccccc1 Amb22831832 [1,0,1,0,0,0|1,0,0]=3 965 B11R1.16 C=CC[C@@H](O)c1ccccc1 Amb24726216 [1,0,1,0,0,0|2,0,0]=4 966 B11R1.16 C=CC[C@H](N)c1c[n]c[n]c1 Amb25324319 [1,0,1,0,0,0|1,0,0]=3 967 B11R1.16 C=CC[C@H](N)c1c[n]ccc1 Amb24699940 [1,0,1,0,0,0|0,0,0]=2 968 B11R1.16 C=CC[C@H](N)c1cccc[n]1 Amb25117558 [1,0,1,0,0,0|2,0,0]=4 969 B11R1.16 C=CC[C@H](O)c1c[n]ccc1 Amb25724316 [1,0,1,0,0,0|1,0,0]=3 970 B11R1.16 C=CNC(=O)c1ccc[n]c1 Amb24715715 [1,0,1,0,0,0|1,0,1]=4 971 B11R1.16 CC(CC=C)c1c[n]ccc1 Amb24085283 [1,0,1,0,0,0|0,0,0]=2 972 B11R1.16 CC(CC=C)c1ccccc1 Amb25829403 [1,0,1,0,0,0|1,0,0]=3 973 B11R1.16 CC(CC=O)c1c[n]cc[n]1 Amb24591956 [1,0,1,0,0,0|2,0,0]=4 974 B11R1.16 CC(CC=O)c1c[n]ccc1 Amb18125013 [1,0,1,0,0,0|1,0,0]=3 975 B11R1.16 CC(CCN)c1c[n]ccc1 Amb18293554 [1,0,1,0,0,0|1,0,1]=4 976 B11R1.16 CC(CCO)c1c[n]ccc1 Amb25808756 [1,0,1,0,0,0|1,0,1]=4 977 B11R1.16 CC(CNN)c1c[n]ccc1 Amb25734660 [1,0,1,0,0,0|2,0,0]=4 978 B11R1.16 CC(NC#N)c1c[n]ccc1 Amb24445387 [1,0,1,0,0,0|1,0,1]=4 979 B11R1.16 CC(NC=S)c1ccccc1 Amb25191191 [1,0,1,0,0,0|2,0,0]=4 980 B11R1.16 CC(OC=C)c1ccccc1 Amb22522122 [1,0,1,0,0,0|2,0,0]=4 981 B11R1.16 CC=CC(O)c1ccccc1 Amb22228005 [1,0,1,0,0,0|2,0,0]=4 982 B11R1.16 CCCC(N)c1c[n]c[n]c1 Amb18991851 [1,0,1,0,0,0|1,0,1]=4 983 B11R1.16 CCCC(N)c1c[n]ccc1 Amb18984960 [1,0,1,0,0,0|0,0,1]=3 984 B11R1.16 CCCC(c1cccnc1)O Amb17232090 [1,0,1,0,0,0|1,0,1]=4 985 B11R1.16 CCCC(c1cnccn1)N Amb17505550 [1,0,1,0,0,0|1,0,1]=4 986 B11R1.16 CCC[C@@H](N)c1c[n]cc[n]1 Amb24484506 [1,0,1,0,0,0|1,0,1]=4 987 B11R1.16 CCC[C@@H](N)c1c[n]ccc1 Amb24617547 [1,0,1,0,0,0|0,0,1]=3 988 B11R1.16 CCC[C@@H](N)c1ccccc1 Amb22388605 [1,0,1,0,0,0|1,0,1]=4 989 B11R1.16 CCC[C@H](N)c1ccccc1 Amb20241164 [1,0,1,0,0,0|1,0,1]=4 990 B11R1.16 CCC[C@H](N)c1ccccc1 Amb23385315 [1,0,1,0,0,0|1,0,1]=4 991 B11R1.16 CCC[C@H](O)c1c[n]ccc1 Amb25845549 [1,0,1,0,0,0|1,0,1]=4 992 B11R1.16 CCC[C@H](c1ccccc1)N Amb16233791 [1,0,1,0,0,0|1,0,1]=4 993 B11R1.16 CCNC(C)c1c[n][n]cc1 Amb24718778 [1,0,1,0,0,0|1,0,1]=4 994 B11R1.16 CCNC(C)c1c[n]c[n]c1 Amb18298705 [1,0,1,0,0,0|1,0,1]=4 995 B11R1.16 CCNC(C)c1c[n]cc[n]1 Amb18968355 [1,0,1,0,0,0|1,0,1]=4 996 B11R1.16 CCNC(c1ccccc1)C Amb1771733 [1,0,1,0,0,0|1,0,1]=4 997 B11R1.16 CCN[C@H](C)c1c[n]ccc1 Amb25114990 [1,0,1,0,0,0|0,0,1]=3 998 B11R1.16 CCN[C@H](C)c1ccccc1 Amb24363134 [1,0,1,0,0,0|1,0,1]=4 999 B11R1.16 CCOC(C)c1c[n]ccc1 Amb24085116 [1,0,1,0,0,0|1,0,1]=4 1000 B11R1.16 CCSC(C)c1c[n]ccc1 Amb25099407 [1,0,1,0,0,0|1,0,1]=4 1001 B11R1.16 CN(CC=C)c1ccc[n][n]1 Amb25130186 [1,0,1,0,0,0|2,0,0]=4 1002 B11R1.16 CNCC(N)c1ccccc1 Amb18290185 [1,0,1,0,0,0|2,0,0]=4 1003 B11R1.16 CNCC(O)c1c[n]ccc1 Amb19515701 [1,0,1,0,0,0|2,0,0]=4 1004 B11R1.16 CNCC(c1ccccc1)N Amb13883001 [1,0,1,0,0,0|2,0,0]=4 1005 B11R1.16 CNCC(c1cccnc1)O Amb17138441 [1,0,1,0,0,0|2,0,0]=4 1006 B11R1.16 CNC[C@@H](N)c1ccccc1 Amb24487965 [1,0,1,0,0,0|2,0,0]=4 1007 B11R1.16 CNC[C@H](N)c1ccccc1 Amb25040662 [1,0,1,0,0,0|2,0,0]=4 1008 B11R1.16 CNC[C@H](O)c1c[n]ccc1 Amb25172815 [1,0,1,0,0,0|2,0,0]=4 1009 B11R1.16 COCC(N)c1c[n]c[n]c1 Amb18992089 [1,0,1,0,0,0|2,0,0]=4 1010 B11R1.16 COCC(N)c1c[n]ccc1 Amb18292631 [1,0,1,0,0,0|1,0,0]=3 1011 B11R1.16 COCC(O)c1c[n]ccc1 Amb18179473 [1,0,1,0,0,0|2,0,0]=4 1012 B11R1.16 COCC(c1ccccc1)N Amb1134749 [1,0,1,0,0,0|2,0,0]=4 1013 B11R1.16 COCC(c1ccccc1)N Amb13952604 [1,0,1,0,0,0|2,0,0]=4 1014 B11R1.16 COC[C@@H](N)c1c[n]ccc1 Amb24351094 [1,0,1,0,0,0|1,0,0]=3 1015 B11R1.16 COC[C@H](N)c1c[n][n]cc1 Amb25280057 [1,0,1,0,0,0|2,0,0]=4 1016 B11R1.16 COC[C@H](N)c1c[n]c[n]c1 Amb25151807 [1,0,1,0,0,0|2,0,0]=4 1017 B11R1.16 COC[C@H](N)c1c[n]cc[n]1 Amb24485758 [1,0,1,0,0,0|2,0,0]=4 1018 B11R1.16 COC[C@H](N)c1c[n]ccc1 Amb24533043 [1,0,1,0,0,0|1,0,0]=3 1019 B11R1.16 COC[C@H](N)c1ccccc1 Amb22737495 [1,0,1,0,0,0|2,0,0]=4 1020 B11R1.16 COC[C@H](c1ccccc1)N Amb17061641 [1,0,1,0,0,0|2,0,0]=4 1021 B11R1.16 CSCC(N)c1c[n]c[n]c1 Amb18995353 [1,0,1,0,0,0|2,0,0]=4 1022 B11R1.16 CSCC(N)c1c[n]ccc1 Amb18300195 [1,0,1,0,0,0|1,0,0]=3 1023 B11R1.16 CSCC(N)c1ccccc1 Amb18300065 [1,0,1,0,0,0|2,0,0]=4 1024 B11R1.16 CSCC(O)c1c[n]ccc1 Amb18801395 [1,0,1,0,0,0|2,0,0]=4 1025 B11R1.16 CSC[C@@H](N)c1ccccc1 Amb25368447 [1,0,1,0,0,0|2,0,0]=4 1026 B11R1.16 C[C@@H](NC=O)c1c[n]ccc1 Amb24390688 [1,0,1,0,0,0|1,0,0]=3 1027 B11R1.16 C[C@H](CC=O)c1ccccc1 Amb25843699 [1,0,1,0,0,0|2,0,0]=4 1028 B11R1.16 C[C@H](NC=O)c1c[n]ccc1 Amb24709803 [1,0,1,0,0,0|1,0,0]=3 1029 B11R1.16 C[C@H](NC=O)c1ccccc1 Amb24696096 [1,0,1,0,0,0|2,0,0]=4 1030 B11R1.16 C\C=C/C(O)c1c[n]ccc1 Amb25241944 [1,0,1,0,0,0|1,0,0]=3 1031 B11R1.16 C\C=C\C(=O)c1ccc[n]c1 Amb25712944 [1,0,1,0,0,0|1,0,1]=4 1032 B11R1.16 C\C=C\C(N)c1ccccc1 Amb18124850 [1,0,1,0,0,0|1,0,0]=3 1033 B11R1.16 C\C=C\[C@@H](O)c1ccccc1 Amb25760539 [1,0,1,0,0,0|2,0,0]=4 1034 B11R1.16 C\C=C\[C@H](O)c1ccccc1 Amb25190477 [1,0,1,0,0,0|2,0,0]=4 1035 B11R1.16 NC(CC#N)c1c[n]ccc1 Amb18064998 [1,0,1,0,0,0|1,0,1]=4 1036 B11R1.16 N[C@H](CC#N)c1c[n]ccc1 Amb24700424 [1,0,1,0,0,0|1,0,1]=4 1037 B11R1.16 O=CNC(c1cccnc1)C Amb10070156 [1,0,1,0,0,0|1,0,0]=3 1038 B11R1.28 BrC\C=C\Cc1ccccc1 Amb25039914 [1,0,1,0,0,0|2,0,0]=4 1039 B11R1.28 Br\C=C/CNc1ccccc1 Amb25063133 [1,0,1,0,0,0|2,0,0]=4 1040 B11R1.28 C/C=C/CCc1ccccc1 Amb17940149 [1,0,1,0,0,0|1,0,0]=3 1041 B11R1.28 C=CCC#Cc1c[n]ccc1 Amb24085282 [1,0,1,0,0,0|1,0,1]=4 1042 B11R1.28 C=CCCCc1ccccc1 Amb24062985 [1,0,1,0,0,0|2,0,0]=4 1043 B11R1.28 C=CCCOc1c[n]ccc1 Amb24085225 [1,0,1,0,0,0|2,0,0]=4 1044 B11R1.28 C=CCNCc1c[n]c[n]c1 Amb19029394 [1,0,1,0,0,0|1,0,0]=3 1045 B11R1.28 C=CCNCc1c[n]cc[n]1 Amb18314215 [1,0,1,0,0,0|1,0,0]=3 1046 B11R1.28 C=CCNCc1c[n]ccc1 Amb19890377 [1,0,1,0,0,0|0,0,0]=2 1047 B11R1.28 C=CCNCc1c[n]ccc1 Amb19891174 [1,0,1,0,0,0|0,0,0]=2 1048 B11R1.28 C=CCNCc1cc[n]cc1 Amb19890311 [1,0,1,0,0,0|2,0,0]=4 1049 B11R1.28 C=CCNCc1cc[n]cc1 Amb19890811 [1,0,1,0,0,0|2,0,0]=4 1050 B11R1.28 C=CCNCc1cccc[n]1 Amb19890291 [1,0,1,0,0,0|2,0,0]=4 1051 B11R1.28 C=CCNCc1cccc[n]1 Amb19891173 [1,0,1,0,0,0|2,0,0]=4 1052 B11R1.28 C=CCOCc1ccccc1 Amb17933917 [1,0,1,0,0,0|2,0,0]=4 1053 B11R1.28 C=CCSCc1ccccc1 Amb17799426 [1,0,1,0,0,0|2,0,0]=4 1054 B11R1.28 CC=CCCc1cccc[n]1 Amb24100575 [1,0,1,0,0,0|2,0,0]=4 1055 B11R1.28 CC=CCCc1ccccc1 Amb24062987 [1,0,1,0,0,0|1,0,0]=3 1056 B11R1.28 CCCCCc1cccnc1 Amb17672949 [1,0,1,0,0,0|0,0,2]=4 1057 B11R1.28 CCCNCc1c[n]c[n]c1 Amb18313855 [1,0,1,0,0,0|1,0,1]=4 1058 B11R1.28 CCCNCc1c[n]ccc1 Amb19890575 [1,0,1,0,0,0|0,0,1]=3 1059 B11R1.28 CCCNCc1ccccc1 Amb1105937 [1,0,1,0,0,0|1,0,1]=4 1060 B11R1.28 CCNCCc1c[n]ccc1 Amb18303850 [1,0,1,0,0,0|1,0,1]=4 1061 B11R1.28 CNCCCc1c[n]ccc1 Amb23442716 [1,0,1,0,0,0|1,0,1]=4 1062 B11R1.28 COCCCc1c[n]ccc1 Amb25382996 [1,0,1,0,0,0|1,0,1]=4 1063 B11R1.28 COCCNc1c[n]ccc1 Amb18268638 [1,0,1,0,0,0|1,0,1]=4 1064 B11R1.28 COCNCc1ccccc1 Amb25053350 [1,0,1,0,0,0|2,0,0]=4 1065 B11R1.28 C\C=C/N=C/c1c[n]ccc1 Amb24486027 [1,0,1,0,0,0|0,0,2]=4 1066 B11R1.28 C\C=C\CCc1cc[n]cc1 Amb25830692 [1,0,1,0,0,0|2,0,0]=4 1067 B11R1.28 C\C=C\CNc1c[n]ccc1 Amb25228933 [1,0,1,0,0,0|0,0,0]=2 1068 B11R1.28 C\C=C\COc1c[n]ccc1 Amb25151771 [1,0,1,0,0,0|1,0,0]=3 1069 B11R1.28 C\C=C\CSc1c[n]cc[n]1 Amb24588011 [1,0,1,0,0,0|2,0,0]=4 1070 B11R1.28 C\C=C\N=Cc1c[n]ccc1 Amb24518405 [1,0,1,0,0,0|0,0,2]=4 1071 B11R1.28 ClCCCCc1c[n]ccc1 Amb24762958 [1,0,1,0,0,0|1,0,1]=4 1072 B11R1.28 ClCCNCc1cccnc1 Amb17334833 [1,0,1,0,0,0|1,0,1]=4 1073 B11R1.28 ClC\C=C\Cc1ccccc1 Amb24462747 [1,0,1,0,0,0|2,0,0]=4 1074 B11R1.28 Cl\C=C/CNc1ccccc1 Amb25241241 [1,0,1,0,0,0|2,0,0]=4 1075 B11R1.28 Cl\C=C\CNc1ccccc1 Amb25148081 [1,0,1,0,0,0|2,0,0]=4 1076 B11R1.28 Cl\C=C\COc1c[n]ccc1 Amb25733978 [1,0,1,0,0,0|2,0,0]=4 1077 B11R1.28 NCC#CCc1c[n]ccc1 Amb24553113 [1,0,1,0,0,0|0,0,2]=4 1078 B11R1.28 NCCCCc1c[n]c[n]c1 Amb18125322 [1,0,1,0,0,0|1,0,1]=4 1079 B11R1.28 NCCCCc1c[n]cc[n]1 Amb25385068 [1,0,1,0,0,0|1,0,1]=4 1080 B11R1.28 NCCCCc1ccc[n][n]1 Amb18201561 [1,0,1,0,0,0|1,0,1]=4 1081 B11R1.28 NCCCCc1ccccc1 Amb1227740 [1,0,1,0,0,0|1,0,1]=4 1082 B11R1.28 NCCCCc1ccccc1 Amb19929939 [1,0,1,0,0,0|1,0,1]=4 1083 B11R1.28 NCCCNc1cccnc1 Amb10607841 [1,0,1,0,0,0|1,0,1]=4 1084 B11R1.28 NCCNCc1cccnc1 Amb17091029 [1,0,1,0,0,0|1,0,1]=4 1085 B11R1.28 NCCOCc1c[n]ccc1 Amb18307736 [1,0,1,0,0,0|1,0,1]=4 1086 B11R1.28 NCC\C=C\c1c[n]ccc1 Amb25061778 [1,0,1,0,0,0|0,0,2]=4 1087 B11R1.28 NCNCCc1ccccc1 Amb25385258 [1,0,1,0,0,0|2,0,0]=4 1088 B11R1.28 NC\C=C\Cc1ccccc1 Amb24351087 [1,0,1,0,0,0|1,0,0]=3 1089 B11R1.28 NNCCCc1c[n]ccc1 Amb18125323 [1,0,1,0,0,0|1,0,1]=4 1090 B11R1.28 NOCCCc1cccnc1 Amb17089547 [1,0,1,0,0,0|1,0,1]=4 1091 B11R1.28 O=CCCCc1c[n]ccc1 Amb24099514 [1,0,1,0,0,0|1,0,1]=4 1092 B11R1.28 O=CCNCc1ccccc1 Amb19886524 [1,0,1,0,0,0|2,0,0]=4 1093 B11R1.28 O=CNCCc1c[n]ccc1 Amb24592209 [1,0,1,0,0,0|2,0,0]=4 1094 B11R1.28 OCCCCc1c[n]ccc1 Amb22732495 [1,0,1,0,0,0|1,0,1]=4 1095 B11R1.28 OC\C=C\Cc1ccccc1 Amb25074433 [1,0,1,0,0,0|2,0,0]=4 1096 B11R1.28 SCCCCc1c[n]ccc1 Amb18563823 [1,0,1,0,0,0|1,0,1]=4 1097 B13R1.2 CNC(CC#C)c1c[n]cc(Br)c1 Amb25204177 [0,1,1,0,0,0|0,0,2]=4 1098 B13R1.2 CNC(CC#C)c1c[n]cc(F)c1 Amb25157376 [0,1,1,0,0,0|0,0,2]=4 1099 B13R1.2 Cc1c[n]cc(c1)C(CC#C)NC Amb25191823 [0,1,1,0,0,0|0,0,2]=4 1100 B13R1.26 C=CCNC(c1cccnc1)C#N Amb17043441 [0,1,1,0,0,0|1,0,1]=4 1101 B13R1.26 CC#CCC(NC)c1c[n]ccc1 Amb18804165 [0,1,1,0,0,0|0,0,2]=4 1102 B13R1.26 CCCCC(c1cccnc1)NC Amb10607966 [0,1,1,0,0,0|0,0,2]=4 1103 B13R1.26 CCCCC(c1cccnc1)NC Amb13949195 [0,1,1,0,0,0|0,0,2]=4 1104 B13R1.26 OCCCC(c1cccnc1)NC Amb17617179 [0,1,1,0,0,0|0,0,2]=4 1105 B13R1.173 CNC(CCO)c1ccc[n]c1Cl Amb22301215 [0,1,1,0,0,0|1,0,1]=4 1106 B13R1.173 Cc1cc[n]cc1C(CC#C)NC Amb24452829 [0,1,1,0,0,0|0,0,2]=4 1107 B13R1.405 CC(C)C(NCC)c1c[n]ccc1 Amb19003591 [0,1,1,0,0,0|0,0,2]=4 1108 B13R1.405 CNCC(c1cccnc1)N(C)C Amb10576427 [0,1,1,0,0,0|1,0,1]=4 1109 B13R1.713 C=C(Br)CC(C#N)c1ccc[n]c1 Amb22896779 [0,1,1,0,0,0|2,0,0]=4 1110 B13R1.6 CC#CCNCc1cc(Br)c[n]c1 Amb25696141 [0,1,1,0,0,0|0,0,2]=4 1111 B13R1.6 CCCCNCc1c[n]cc(Br)c1 Amb22276865 [0,1,1,0,0,0|0,0,2]=4 1112 B13R1.6 CNCCNCc1cc(Br)c[n]c1 Amb24769199 [0,1,1,0,0,0|1,0,1]=4 1113 B13R1.6 COCCNCc1c[n]cc(Br)c1 Amb22276843 [0,1,1,0,0,0|1,0,1]=4 1114 B13R1.6 Cc1cc(NC\C=C\CN)[n][n]c1 Amb25691726 [0,1,1,0,0,0|2,0,0]=4 1115 B13R1.6 NC\C=C\CNc1c[n]cc(Cl)[n]1 Amb25155683 [0,1,1,0,0,0|2,0,0]=4 1116 B13R1.6 NC\C=C\CNc1cc(Br)c[n]c1 Amb25850264 [0,1,1,0,0,0|1,0,0]=3 1117 B13R1.9 CC#CCNCc1ccc(F)[n]c1 Amb24749312 [0,1,1,0,0,0|0,0,2]=4 1118 B13R1.9 CC\C=C\CNc1c[n]c(N)cc1 Amb24578081 [0,1,1,0,0,0|2,0,0]=4 1119 B13R1.9 COCCNCc1ccc(Cl)[n]c1 Amb21988401 [0,1,1,0,0,0|1,0,1]=4 1120 B13R1.9 C\C=C\CCNc1ccc(N)[n]c1 Amb24645916 [0,1,1,0,0,0|2,0,0]=4 1121 B13R1.9 Cc1ccc(CNCC#CC)c[n]1 Amb18315902 [0,1,1,0,0,0|0,0,2]=4 1122 B13R1.9 Cc1ccc(NC\C=C\CN)[n][n]1 Amb25067203 [0,1,1,0,0,0|2,0,0]=4 1123 B13R1.9 NC\C=C\CNc1ccc(Cl)[n][n]1 Amb25153683 [0,1,1,0,0,0|2,0,0]=4 1124 B13R1.24 CC#CCNC(C)c1c[n]ccc1 Amb18183864 [0,1,1,0,0,0|0,0,2]=4 1125 B13R1.24 CC#CCN[C@@H](C)c1c[n]ccc1 Amb24489255 [0,1,1,0,0,0|0,0,2]=4 1126 B13R1.24 C\C=C\CNC(=O)c1ccccc1 Amb24072901 [0,1,1,0,0,0|1,0,1]=4 1127 B13R1.24 C\C=C\CNC(=S)c1ccccc1 Amb25294300 [0,1,1,0,0,0|1,0,1]=4 1128 B13R1.28 BrC\C=C\COCc1ccccc1 Amb25180905 [0,1,1,0,0,0|2,0,0]=4 1129 B13R1.28 C=C\C=C\CNCc1ccccc1 Amb18127120 [0,1,1,0,0,0|1,0,1]=4 1130 B13R1.28 CC=C=CCNCc1ccccc1 Amb25073248 [0,1,1,0,0,0|1,0,0]=3 1131 B13R1.28 CCCCNCCc1c[n]ccc1 Amb18180859 [0,1,1,0,0,0|0,0,2]=4 1132 B13R1.28 CCNCCNCc1c[n]ccc1 Amb18184617 [0,1,1,0,0,0|0,0,2]=4 1133 B13R1.28 CNCCCNCc1c[n]ccc1 Amb20171993 [0,1,1,0,0,0|0,0,2]=4 1134 B13R1.28 C\C=C\CCNCc1ccccc1 Amb10601621 [0,1,1,0,0,0|1,0,0]=3 1135 B13R1.28 C\C=C\CNOCc1ccccc1 Amb25088761 [0,1,1,0,0,0|1,0,0]=3 1136 B13R1.28 ClC\C=C/COCc1ccccc1 Amb25258321 [0,1,1,0,0,0|2,0,0]=4 1137 B13R1.28 Cl\C=C\CNOCc1ccccc1 Amb24383522 [0,1,1,0,0,0|2,0,0]=4 1138 B13R1.28 OC\C=C\CNCc1ccccc1 Amb18648063 [0,1,1,0,0,0|1,0,0]=3 1139 B13R1.42 CCOC(=N)CCc1ccc[n]c1 Amb24094202 [0,1,1,0,0,0|2,0,0]=4 1140 B13R1.42 C\C=C/C(=O)NCc1ccccc1 Amb24432668 [0,1,1,0,0,0|1,0,1]=4 1141 B13R1.42 C\C=C\C(=O)NCc1ccc[n][n]1 Amb24495130 [0,1,1,0,0,0|1,0,1]=4 1142 B13R1.42 C\C=C\C(=O)NCc1ccccc1 Amb1196143 [0,1,1,0,0,0|1,0,1]=4 1143 B13R1.42 C\C=C\C(C)NCc1ccccc1 Amb24355890 [0,1,1,0,0,0|1,0,0]=3 1144 B13R1.42 C\C=C\[C@@H](C)NCc1ccccc1 Amb25350237 [0,1,1,0,0,0|1,0,0]=3 1145 B13R1.42 NCCC(=O)NCc1cccnc1 Amb10610041 [0,1,1,0,0,0|1,0,1]=4 1146 B13R1.42 NCCC(=O)NCc1cccnc1 Amb10610056 [0,1,1,0,0,0|1,0,1]=4 1147 B13R1.44 CC#CCN(C)Cc1c[n]ccc1 Amb25796808 [0,1,1,0,0,0|0,0,2]=4 1148 B13R1.44 CN(C\C=C\Cl)Cc1ccccc1 Amb24688896 [0,1,1,0,0,0|2,0,0]=4 1149 B13R1.337 CC(=O)/C=C\NCc1ccccc1 Amb17778144 [0,1,1,0,0,0|1,0,1]=4 1150 B13R1.337 CC(=O)CCNCc1ccccc1 Amb23399608 [0,1,1,0,0,0|1,0,1]=4 1151 B13R1.337 CC(=O)NCNCc1ccccc1 Amb24728285 [0,1,1,0,0,0|2,0,0]=4 1152 B13R1.337 CC(=O)OCCCc1ccc[n]c1 Amb24094205 [0,1,1,0,0,0|2,0,0]=4 1153 B13R1.337 CC(=O)SCNCc1ccccc1 Amb25858716 [0,1,1,0,0,0|2,0,0]=4 1154 B13R1.337 CC(=O)\C=C\NCc1ccccc1 Amb25303594 [0,1,1,0,0,0|1,0,1]=4 1155 B13R1.337 CC(=O)\C=N\NCc1ccccc1 Amb25767927 [0,1,1,0,0,0|2,0,0]=4 1156 B13R1.337 CC(C)=CCOCc1ccccc1 Amb25045065 [0,1,1,0,0,0|2,0,0]=4 1157 B13R1.337 CC(CCNCc1cccnc1)C Amb2172489 [0,1,1,0,0,0|0,0,2]=4 1158 B13R1.337 C\C(=C/CNCc1ccccc1)\Cl Amb1811425 [0,1,1,0,0,0|1,0,0]=3 1159 B13R1.337 OC(=O)CCNCc1ccc[n]c1 Amb19373040 [0,1,1,0,0,0|1,0,1]=4 1160 B13R1.337 OC(=O)CCNCc1cccnc1 Amb1110655 [0,1,1,0,0,0|1,0,1]=4 1161 B13R1.337 OC(=O)\C=C\NCc1ccc[n]c1 Amb24643313 [0,1,1,0,0,0|1,0,1]=4 1162 B13R1.555 CC\C=C\CNc1c[n]ccc1N Amb24608410 [0,1,1,0,0,0|2,0,0]=4 1163 B13R1.555 Cc1cc[n]cc1CNCC#CC Amb24415714 [0,1,1,0,0,0|0,0,2]=4 1164 B13R1.718 C=C(CNCc1ccccc1)C=C Amb25312120 [0,1,1,0,0,0|1,0,1]=4 1165 B13R1.718 CCC(O)CNCc1c[n]ccc1 Amb18181125 [0,1,1,0,0,0|0,0,2]=4 1166 B13R1.718 COC(=N)CNCc1ccccc1 Amb25074070 [0,1,1,0,0,0|2,0,0]=4 1167 B13R1.718 COC(=O)CCCc1ccc[n]c1 Amb24066737 [0,1,1,0,0,0|2,0,0]=4 1168 B13R1.718 COC(=O)CNCc1ccccc1 Amb21929289 [0,1,1,0,0,0|2,0,0]=4 1169 B13R1.718 C\C(\CNCc1ccccc1)=C/C Amb18127531 [0,1,1,0,0,0|1,0,0]=3 1170 B13R1.718 C\C(\CNCc1ccccc1)=C\C Amb24414647 [0,1,1,0,0,0|1,0,0]=3 1171 B13R1.718 NCC(=O)NCCc1ccccc1 Amb13951619 [0,1,1,0,0,0|2,0,0]=4 1172 B13R1.718 NNC(=O)NCCc1ccc[n]c1 Amb18181087 [0,1,1,0,0,0|2,0,0]=4 1173 B13R1.718 NNC(=S)NCCc1ccc[n]c1 Amb18321486 [0,1,1,0,0,0|2,0,0]=4 1174 B13R1.718 O=C(CCl)NCCc1ccc[n]c1 Amb19056184 [0,1,1,0,0,0|2,0,0]=4 1175 B13R1.11 C=CC(=O)N[C@@H](c1ccccc1)C Amb16192564 [0,1,1,0,0,0|1,0,1]=4 1176 B13R1.11 CC(NC(C)C#N)c1c[n]ccc1 Amb18981193 [0,1,1,0,0,0|1,0,1]=4 1177 B13R1.11 CNC(=O)CC(C)c1ccc[n]c1 Amb24397679 [0,1,1,0,0,0|2,0,0]=4 1178 B13R1.11 CNC(=O)CC(c1cccnc1)N Amb17233543 [0,1,1,0,0,0|1,0,0]=3 1179 B13R1.11 CNC(=O)C[C@H](N)c1ccccc1 Amb24637726 [0,1,1,0,0,0|2,0,0]=4 1180 B13R1.11 COC(=O)CC(c1ccccc1)N Amb1221582 [0,1,1,0,0,0|2,0,0]=4 1181 B13R1.11 COC(=O)CC(c1ccccc1)N Amb2371447 [0,1,1,0,0,0|2,0,0]=4 1182 B13R1.11 COC(=O)C[C@@H](N)c1ccc[n]c1 Amb24107581 [0,1,1,0,0,0|1,0,0]=3 1183 B13R1.11 COC(=O)C[C@@H](N)c1ccccc1 Amb18796125 [0,1,1,0,0,0|2,0,0]=4 1184 B13R1.11 COC(=O)C[C@@H](N)c1ccccc1 Amb19373681 [0,1,1,0,0,0|2,0,0]=4 1185 B13R1.11 COC(=O)C[C@@H](c1ccccc1)N Amb17617178 [0,1,1,0,0,0|2,0,0]=4 1186 B13R1.11 COC(=O)C[C@H](N)c1ccccc1 Amb22268691 [0,1,1,0,0,0|2,0,0]=4 1187 B13R1.11 C[C@H](NC(=O)C=C)c1ccc[n]c1 Amb25192059 [0,1,1,0,0,0|0,0,1]=3 1188 B13R1.11 C[C@H](NC(=O)C=C)c1ccccc1 Amb25858461 [0,1,1,0,0,0|1,0,1]=4 1189 B13R1.11 C[C@H](NC(C)C#C)c1c[n]ccc1 Amb25190106 [0,1,1,0,0,0|0,0,2]=4 1190 B13R1.11 C[C@H](NC(C)C#N)c1c[n]ccc1 Amb25793765 [0,1,1,0,0,0|1,0,1]=4 1191 B13R1.11 C\C(\CC(O)c1ccccc1)=C\C Amb24576542 [0,1,1,0,0,0|2,0,0]=4 1192 B13R1.17 C=CCNC(=O)c1ccc(N)[n]c1 Amb25119956 [0,1,1,0,0,0|1,0,1]=4 1193 B13R1.17 CC(NCC#C)c1ccc(Cl)[n]c1 Amb24665478 [0,1,1,0,0,0|0,0,2]=4 1194 B13R1.17 CC(NCC#N)c1ccc(Cl)[n]c1 Amb25235918 [0,1,1,0,0,0|1,0,1]=4 1195 B13R1.17 CC(OCC=C)c1ccc(Br)cc1 Amb23443738 [0,1,1,0,0,0|2,0,0]=4 1196 B13R1.17 CC(OCC=C)c1ccc(N)cc1 Amb23443730 [0,1,1,0,0,0|2,0,0]=4 1197 B13R1.17 C\C=C\CC(O)c1ccc(F)cc1 Amb24495600 [0,1,1,0,0,0|2,0,0]=4 1198 B13R1.17 C\C=C\C[C@@H](O)c1ccc(Cl)cc1 Amb24466198 [0,1,1,0,0,0|2,0,0]=4 1199 B13R1.17 C\C=C\C[C@H](O)c1ccc(F)cc1 Amb25136288 [0,1,1,0,0,0|2,0,0]=4 1200 B13R1.17 Cc1ccc(c[n]1)C(=O)NCC=C Amb25734827 [0,1,1,0,0,0|1,0,1]=4 1201 B13R1.17 Cc1ccc(c[n]1)C(N)CC#CC Amb25090799 [0,1,1,0,0,0|0,0,2]=4 1202 B13R1.18 C=CCNC(=O)c1c[n]cc(Cl)c1 Amb24391025 [0,1,1,0,0,0|1,0,1]=4 1203 B13R1.18 C=CCNC(=O)c1c[n]cc(O)c1 Amb24350834 [0,1,1,0,0,0|1,0,1]=4 1204 B13R1.18 C=CCNC(=O)c1cncc(c1)Br Amb2554950 [0,1,1,0,0,0|1,0,1]=4 1205 B13R1.18 CC#CCC(N)c1c[n]cc(Br)c1 Amb24489561 [0,1,1,0,0,0|0,0,2]=4 1206 B13R1.18 CC#CCC(N)c1c[n]cc(Cl)c1 Amb25108737 [0,1,1,0,0,0|0,0,2]=4 1207 B13R1.18 CC#CCC(N)c1c[n]cc(F)c1 Amb24384644 [0,1,1,0,0,0|0,0,2]=4 1208 B13R1.18 CC(NCC#N)c1c[n]cc(F)c1 Amb25078872 [0,1,1,0,0,0|1,0,1]=4 1209 B13R1.18 Cc1c[n]cc(c1)C(C)NCC#C Amb24747795 [0,1,1,0,0,0|0,0,2]=4 1210 B13R1.45 BrC(=C)CNC(=O)c1cccnc1 Amb11588338 [0,1,1,0,0,0|1,0,1]=4 1211 B13R1.45 CC(=C)CNC(=O)c1ccc[n]c1 Amb25694651 [0,1,1,0,0,0|1,0,1]=4 1212 B13R1.45 CC(=O)CCC(c1cccnc1)Cl Amb17402227 [0,1,1,0,0,0|1,0,1]=4 1213 B13R1.45 CC(=O)NCC(O)c1ccc[n]c1 Amb25091917 [0,1,1,0,0,0|2,0,0]=4 1214 B13R1.45 CC(=O)NC[C@H](N)c1ccccc1 Amb25752007 [0,1,1,0,0,0|2,0,0]=4 1215 B13R1.45 CC(C)=CC[C@@H](N)c1ccccc1 Amb25188074 [0,1,1,0,0,0|1,0,0]=3 1216 B13R1.45 CC(NCC(O)=O)c1c[n]cc[n]1 Amb21861984 [0,1,1,0,0,0|2,0,0]=4 1217 B13R1.45 CC(c1ccccc1)NCC(=O)N Amb1114995 [0,1,1,0,0,0|2,0,0]=4 1218 B13R1.45 C[C@@H](NCC(N)=O)c1ccccc1 Amb24271280 [0,1,1,0,0,0|2,0,0]=4 1219 B13R1.45 C[C@@H](NCC(O)=O)c1ccccc1 Amb17935709 [0,1,1,0,0,0|2,0,0]=4 1220 B13R1.45 C[C@H](NCC(O)=O)c1ccccc1 Amb17935708 [0,1,1,0,0,0|2,0,0]=4 1221 B13R1.45 C\C(\Cl)=C\CC(O)c1ccccc1 Amb24752308 [0,1,1,0,0,0|2,0,0]=4 1222 B13R1.47 CC(C(O)\C=C\C)c1ccccc1 Amb24495615 [0,1,1,0,0,0|2,0,0]=4 1223 B13R1.47 CC(c1c[n]ccc1)N(C)CC#C Amb25795966 [0,1,1,0,0,0|0,0,2]=4 1224 B13R1.47 C[C@@H](\C=C\C)[C@H](O)c1ccccc1 Amb24420791 [0,1,1,0,0,0|2,0,0]=4 1225 B13R1.47 C[C@H]([C@@H](O)\C=C\C)c1ccccc1 Amb24412124 [0,1,1,0,0,0|2,0,0]=4 1226 B13R1.47 C[C@H](\C=C\C)[C@H](O)c1ccccc1 Amb25687816 [0,1,1,0,0,0|2,0,0]=4 1227 B13R1.47 C\C=C\C(O)C(O)c1c[n]ccc1 Amb24748571 [0,1,1,0,0,0|1,0,0]=3 1228 B13R1.47 C\C=C\C(O)C(O)c1ccccc1 Amb25180187 [0,1,1,0,0,0|2,0,0]=4 1229 B13R1.47 C\C=C\[C@@H](O)C(N)c1ccccc1 Amb25835244 [0,1,1,0,0,0|1,0,0]=3 1230 B13R1.47 C\C=C\[C@@H](O)[C@@H](N)c1ccccc1 Amb24553109 [0,1,1,0,0,0|1,0,0]=3 1231 B13R1.47 C\C=C\[C@H](O)[C@@H](O)c1ccccc1 Amb24495294 [0,1,1,0,0,0|2,0,0]=4 1232 B13R1.122 C=CCNS(=O)(=O)c1c[n]ccc1 Amb24062562 [0,1,1,0,0,0|2,0,0]=4 1233 B13R1.122 CC(C)(OCC=C)c1ccccc1 Amb24101152 [0,1,1,0,0,0|2,0,0]=4 1234 B13R1.674 C=CCNC(=O)c1ccc[n]c1Br Amb24633730 [0,1,1,0,0,0|1,0,1]=4 1235 B13R1.674 C=CCNC(=O)c1ccc[n]c1I Amb25749163 [0,1,1,0,0,0|1,0,1]=4 1236 B13R1.674 C=CCNC(=O)c1ccc[n]c1N Amb24400402 [0,1,1,0,0,0|1,0,1]=4 1237 B13R1.674 C=CCNC(=O)c1ccc[n]c1O Amb25122509 [0,1,1,0,0,0|1,0,1]=4 1238 B13R1.674 C=CCNC(=O)c1ccc[n]c1S Amb24734813 [0,1,1,0,0,0|1,0,1]=4 1239 B13R1.674 CC(NCC#C)c1ccc[n]c1Cl Amb25226632 [0,1,1,0,0,0|0,0,2]=4 1240 B13R1.674 C\C=C\CC(O)c1ccccc1Cl Amb25069733 [0,1,1,0,0,0|2,0,0]=4 1241 B13R1.674 C\C=C\CC(O)c1ccccc1O Amb24690502 [0,1,1,0,0,0|2,0,0]=4 1242 B13R1.674 Cc1[n]cccc1C(=O)NCC=C Amb24712231 [0,1,1,0,0,0|1,0,1]=4 1243 B13R1.674 Cc1[n]cccc1C(N)CC#CC Amb24730333 [0,1,1,0,0,0|0,0,2]=4 1244 B13R1.674 Cc1cc[n]cc1C(C)NCC#C Amb25192611 [0,1,1,0,0,0|0,0,2]=4 1245 B13R1.674 Cc1cc[n]cc1C(C)NCC#N Amb24450770 [0,1,1,0,0,0|1,0,1]=4 1246 B13R2.10 BrC1CC(CC1)c2c[n]ccc2 Amb24749984 [0,1,0,0,1,0|0,0,2]=4 1247 B13R2.10 C=C1COC(C1)c2ccccc2 Amb25692265 [0,1,0,0,1,0|2,0,0]=4 1248 B13R2.10 CC1CC(CN1)c2ccc[n]c2 Amb24749030 [0,1,0,0,1,0|1,0,1]=4 1249 B13R2.10 CC1CC(NC1)c2c[n]c[n]c2 Amb25299611 [0,1,0,0,1,0|1,0,1]=4 1250 B13R2.10 CC1CCC(N1)c2c[n]ccc2 Amb25674368 [0,1,0,0,1,0|0,0,1]=3 1251 B13R2.10 CC1NC(CS1)c2ccccc2 Amb25375933 [0,1,0,0,1,0|2,0,0]=4 1252 B13R2.10 CC1N[C@H](CO1)c2ccccc2 Amb25150915 [0,1,0,0,1,0|2,0,0]=4 1253 B13R2.10 CC=1CC(NN1)c2ccccc2 Amb24069512 [0,1,0,0,1,0|2,0,0]=4 1254 B13R2.10 CC=1CNC(C1)c2ccccc2 Amb24727039 [0,1,0,0,1,0|1,0,0]=3 1255 B13R2.10 CC=1COC(C1)c2ccccc2 Amb25174191 [0,1,0,0,1,0|2,0,0]=4 1256 B13R2.10 CC=1CP(CC1)c2ccccc2 Amb22734694 [0,1,0,0,1,0|2,0,0]=4 1257 B13R2.10 CC=1NC(CN1)c2c[n]ccc2 Amb24085204 [0,1,0,0,1,0|1,0,0]=3 1258 B13R2.10 CN1CCC(C1)c2cccnc2 Amb17616208 [0,1,0,0,1,0|1,0,1]=4 1259 B13R2.10 CN1CNC(C1)c2ccccc2 Amb18645727 [0,1,0,0,1,0|2,0,0]=4 1260 B13R2.10 CN1C[C@@H](CC1)c2c[n]ccc2 Amb24085650 [0,1,0,0,1,0|1,0,1]=4 1261 B13R2.10 CN1C[C@H](CC1)c2c[n]ccc2 Amb24085649 [0,1,0,0,1,0|1,0,1]=4 1262 B13R2.10 C[C@@H]1CC[C@H](N1)c2ccccc2 Amb24627148 [0,1,0,0,1,0|1,0,1]=4 1263 B13R2.10 C[C@@H]1C[C@@H](NC1)c2c[n]ccc2 Amb18829579 [0,1,0,0,1,0|0,0,1]=3 1264 B13R2.10 C[C@@H]1C[C@@H](NC1)c2ccccc2 Amb18829883 [0,1,0,0,1,0|1,0,1]=4 1265 B13R2.10 C[C@H]1CC[C@H](N1)c2ccccc2 Amb24519292 [0,1,0,0,1,0|1,0,1]=4 1266 B13R2.10 C[C@H]1C[C@H](NC1)c2c[n]ccc2 Amb24539921 [0,1,0,0,1,0|0,0,1]=3 1267 B13R2.10 Cc1c[nH]c(n1)c2cccnc2 Amb17232292 [0,1,0,0,1,0|1,0,1]=4 1268 B13R2.10 Cc1cc([nH][n]1)-c2c[n]ccc2 Amb23539672 [0,1,0,0,1,0|1,0,1]=4 1269 B13R2.10 Cc1ccc([nH]1)c2cccnc2 Amb17232249 [0,1,0,0,1,0|0,0,2]=4 1270 B13R2.10 FC1CC(NC1)c2ccccc2 Amb25045554 [0,1,0,0,1,0|1,0,1]=4 1271 B13R2.10 N=C1CC(CN1)c2ccccc2 Amb25363924 [0,1,0,0,1,0|2,0,0]=4 1272 B13R2.10 N=C1N[C@H](CO1)c2ccccc2 Amb25326051 [0,1,0,0,1,0|2,0,0]=4 1273 B13R2.10 NC1CC(C=C1)c2ccccc2 Amb25142018 [0,1,0,0,1,0|2,0,0]=4 1274 B13R2.10 NC1CCC(C1)c2cccnc2 Amb17400118 [0,1,0,0,1,0|0,0,2]=4 1275 B13R2.10 N[C@@H]1C[C@@H](C=C1)c2ccccc2 Amb25267512 [0,1,0,0,1,0|2,0,0]=4 1276 B13R2.10 N[C@H]1C[C@H](C=C1)c2ccccc2 Amb24568927 [0,1,0,0,1,0|2,0,0]=4 1277 B13R2.10 Nc1c[n]c([nH]1)-c2c[n]ccc2 Amb18140122 [0,1,0,0,1,0|1,0,1]=4 1278 B13R2.10 Nc1n[nH]c(c1)c2cccnc2 Amb17065527 [0,1,0,0,1,0|1,0,1]=4 1279 B13R2.10 O=C1C=CC(N1)c2ccccc2 Amb25311888 [0,1,0,0,1,0|1,0,1]=4 1280 B13R2.10 O=C1C=CC(S1)c2ccc[n]c2 Amb25074487 [0,1,0,0,1,0|1,0,1]=4 1281 B13R2.10 O=C1CC(CC1)c2c[n]c[n]c2 Amb25233832 [0,1,0,0,1,0|1,0,1]=4 1282 B13R2.10 O=C1CC(CC1)c2c[n]cc[n]2 Amb24413348 [0,1,0,0,1,0|1,0,1]=4 1283 B13R2.10 O=C1CC(CN1)c2cc[n][n]c2 Amb25758810 [0,1,0,0,1,0|2,0,0]=4 1284 B13R2.10 O=C1CCC(=C1)c2cccnc2 Amb17138485 [0,1,0,0,1,0|1,0,1]=4 1285 B13R2.10 O=C1CCC(C1)c2ccccc2 Amb17138497 [0,1,0,0,1,0|1,0,1]=4 1286 B13R2.10 O=C1CCC(C1)c2cccnc2 Amb17138527 [0,1,0,0,1,0|0,0,1]=3 1287 B13R2.10 O=C1CCC(N1)c2ccccc2 Amb17470413 [0,1,0,0,1,0|1,0,1]=4 1288 B13R2.10 O=C1CCC(N1)c2cccnc2 Amb17618670 [0,1,0,0,1,0|0,0,1]=3 1289 B13R2.10 O=C1CCC(O1)c2cccnc2 Amb17619714 [0,1,0,0,1,0|1,0,1]=4 1290 B13R2.10 O=C1CC[C@@H](N1)c2ccc[n]c2 Amb25233097 [0,1,0,0,1,0|0,0,1]=3 1291 B13R2.10 O=C1CNC(C1)c2ccccc2 Amb23437185 [0,1,0,0,1,0|1,0,0]=3 1292 B13R2.10 O=C1CNC(N1)c2c[n]ccc2 Amb25188367 [0,1,0,0,1,0|1,0,0]=3 1293 B13R2.10 O=C1CNC(N1)c2ccccc2 Amb24342220 [0,1,0,0,1,0|2,0,0]=4 1294 B13R2.10 O=C1COC(C1)c2ccccc2 Amb25830079 [0,1,0,0,1,0|2,0,0]=4 1295 B13R2.10 O=C1CSC(C1)c2ccccc2 Amb25702041 [0,1,0,0,1,0|2,0,0]=4 1296 B13R2.10 O=C1C[C@@H](CC1)c2ccccc2 Amb24323281 [0,1,0,0,1,0|1,0,1]=4 1297 B13R2.10 O=C1C[C@@H](CN1)c2ccccc2 Amb23401452 [0,1,0,0,1,0|2,0,0]=4 1298 B13R2.10 O=C1C[C@H](CC1)c2ccccc2 Amb24484347 [0,1,0,0,1,0|1,0,1]=4 1299 B13R2.10 O=C1C[C@H](CN1)c2ccccc2 Amb25277165 [0,1,0,0,1,0|2,0,0]=4 1300 B13R2.10 O=C1NC(CO1)c2c[n]c[n]c2 Amb24609227 [0,1,0,0,1,0|2,0,0]=4 1301 B13R2.10 O=C1NC(CS1)c2ccccc2 Amb23439132 [0,1,0,0,1,0|2,0,0]=4 1302 B13R2.10 O=C1NCC(C1)c2ccccc2 Amb1772919 [0,1,0,0,1,0|2,0,0]=4 1303 B13R2.10 O=C1NCC(C1)c2cccnc2 Amb13783612 [0,1,0,0,1,0|1,0,0]=3 1304 B13R2.10 O=C1NCC(N1)c2c[n]ccc2 Amb24346599 [0,1,0,0,1,0|1,0,0]=3 1305 B13R2.10 O=C1NCC(N1)c2ccccc2 Amb22056050 [0,1,0,0,1,0|2,0,0]=4 1306 B13R2.10 O=C1NCC(O1)c2cccnc2 Amb17232462 [0,1,0,0,1,0|2,0,0]=4 1307 B13R2.10 O=C1NC[C@@H](N1)c2ccccc2 Amb24568910 [0,1,0,0,1,0|2,0,0]=4 1308 B13R2.10 O=C1NC[C@H](N1)c2c[n]ccc2 Amb25251578 [0,1,0,0,1,0|1,0,0]=3 1309 B13R2.10 O=C1NC[C@H](N1)c2ccccc2 Amb25054081 [0,1,0,0,1,0|2,0,0]=4 1310 B13R2.10 O=C1N[C@@H](CS1)c2ccccc2 Amb24653499 [0,1,0,0,1,0|2,0,0]=4 1311 B13R2.10 O=C1N[C@H](CO1)c2ccc[n]c2 Amb25159332 [0,1,0,0,1,0|1,0,0]=3 1312 B13R2.10 OC1C=CC(O1)c2ccccc2 Amb24733235 [0,1,0,0,1,0|2,0,0]=4 1313 B13R2.10 OC1CC(C=C1)c2ccccc2 Amb25357514 [0,1,0,0,1,0|2,0,0]=4 1314 B13R2.10 OC1CC(NC1)c2c[n]ccc2 Amb18646112 [0,1,0,0,1,0|0,0,1]=3 1315 B13R2.10 OC1CC(NC1)c2ccccc2 Amb24710004 [0,1,0,0,1,0|1,0,1]=4 1316 B13R2.10 OC1CCC(C1)c2cccnc2 Amb17400131 [0,1,0,0,1,0|0,0,2]=4 1317 B13R2.10 OC1CCC(O1)c2c[n]ccc2 Amb25284284 [0,1,0,0,1,0|1,0,1]=4 1318 B13R2.10 OC=1CC(CN1)c2ccccc2 Amb19866679 [0,1,0,0,1,0|2,0,0]=4 1319 B13R2.10 O[C@@H]1C[C@H](C=C1)c2ccccc2 Amb24666654 [0,1,0,0,1,0|2,0,0]=4 1320 B13R2.10 O[C@H]1C[C@@H](CC1)c2c[n]ccc2 Amb25249203 [0,1,0,0,1,0|0,0,2]=4 1321 B13R2.10 O[C@H]1C[C@H](C=C1)c2ccccc2 Amb24584078 [0,1,0,0,1,0|2,0,0]=4 1322 B13R2.10 Oc1c[nH]c([n]1)-c2c[n]ccc2 Amb24412625 [0,1,0,0,1,0|1,0,1]=4 1323 B13R2.10 S=C1NC(CS1)c2ccccc2 Amb24101079 [0,1,0,0,1,0|2,0,0]=4 1324 B13R2.12 Brc1c[n]c(c[n]1)N2CC=CC2 Amb25100158 [0,1,0,0,1,0|2,0,0]=4 1325 B13R2.12 Brc1ccc(c[n]1)-c2cc[n][nH]2 Amb25123449 [0,1,0,0,1,0|1,0,1]=4 1326 B13R2.12 Brc1ccc(c[n]1)C2CCCN2 Amb20617292 [0,1,0,0,1,0|0,0,1]=3 1327 B13R2.12 Brc1ccc(c[n]1)C2CCCO2 Amb20617289 [0,1,0,0,1,0|1,0,1]=4 1328 B13R2.12 Brc1ccc(c[n]1)[C@@H]2CCCN2 Amb24399394 [0,1,0,0,1,0|0,0,1]=3 1329 B13R2.12 Brc1ccc(cc1)C2CCCN2 Amb20623816 [0,1,0,0,1,0|1,0,1]=4 1330 B13R2.12 Brc1ccc(cc1)C2CCCN2 Amb2234648 [0,1,0,0,1,0|1,0,1]=4 1331 B13R2.12 Brc1ccc(cc1)C2NCC=N2 Amb25270655 [0,1,0,0,1,0|2,0,0]=4 1332 B13R2.12 Brc1ccc(cc1)N2CC=CC2 Amb25041519 [0,1,0,0,1,0|2,0,0]=4 1333 B13R2.12 Brc1ccc(cc1)[C@@H]2CCCN2 Amb23440338 [0,1,0,0,1,0|1,0,1]=4 1334 B13R2.12 Brc1ccc(cn1)C2CCCC2 Amb10600542 [0,1,0,0,1,0|0,0,2]=4 1335 B13R2.12 Brc1ccc(cn1)C2CNCC2 Amb10600925 [0,1,0,0,1,0|1,0,1]=4 1336 B13R2.12 Brc1ccc(cn1)C2COCC2 Amb10600931 [0,1,0,0,1,0|1,0,1]=4 1337 B13R2.12 Cc1ccc([n][n]1)C2CCCN2 Amb25247672 [0,1,0,0,1,0|1,0,1]=4 1338 B13R2.12 Cc1ccc(c[n]1)C2C=CCN2 Amb25719056 [0,1,0,0,1,0|0,0,0]=2 1339 B13R2.12 Cc1ccc(c[n]1)C2CNCC2 Amb18829563 [0,1,0,0,1,0|1,0,1]=4 1340 B13R2.12 Cc1ccc(c[n]1)C2NCCS2 Amb24434844 [0,1,0,0,1,0|1,0,1]=4 1341 B13R2.12 Cc1ccc(cc1)C2CCCN2 Amb2234807 [0,1,0,0,1,0|1,0,1]=4 1342 B13R2.12 Cc1ccc(cc1)C2NCC=N2 Amb25299358 [0,1,0,0,1,0|2,0,0]=4 1343 B13R2.12 Cc1ccc(cn1)C2CCCN2 Amb15692074 [0,1,0,0,1,0|0,0,1]=3 1344 B13R2.12 Clc1[n]cc(c[n]1)C2C=CCO2 Amb25159700 [0,1,0,0,1,0|2,0,0]=4 1345 B13R2.12 Clc1ccc(c[n]1)-c2ccc[nH]2 Amb24689358 [0,1,0,0,1,0|0,0,2]=4 1346 B13R2.12 Clc1ccc(c[n]1)C2CCCN2 Amb20617293 [0,1,0,0,1,0|0,0,1]=3 1347 B13R2.12 Clc1ccc(c[n]1)C2CCCO2 Amb20617290 [0,1,0,0,1,0|1,0,1]=4 1348 B13R2.12 Clc1ccc(c[n]1)[C@@H]2CCCN2 Amb24341786 [0,1,0,0,1,0|0,0,1]=3 1349 B13R2.12 Clc1ccc(cc1)C2CCCN2 Amb13951478 [0,1,0,0,1,0|1,0,1]=4 1350 B13R2.12 Clc1ccc(cc1)C2CCCN2 Amb2234462 [0,1,0,0,1,0|1,0,1]=4 1351 B13R2.12 Clc1ccc(cc1)[C@@H]2CCCN2 Amb24061830 [0,1,0,0,1,0|1,0,1]=4 1352 B13R2.12 Clc1ccc(cc1)[C@H]2CCCN2 Amb24078653 [0,1,0,0,1,0|1,0,1]=4 1353 B13R2.12 Fc1ccc(c[n]1)C2CCCN2 Amb24487131 [0,1,0,0,1,0|0,0,1]=3 1354 B13R2.12 Fc1ccc(c[n]1)C2CNCC2 Amb18199644 [0,1,0,0,1,0|1,0,1]=4 1355 B13R2.12 Fc1ccc(c[n]1)[C@@H]2CCCN2 Amb25314401 [0,1,0,0,1,0|0,0,1]=3 1356 B13R2.12 Fc1ccc(c[n]1)[C@H]2CCCN2 Amb25339425 [0,1,0,0,1,0|0,0,1]=3 1357 B13R2.12 Fc1ccc(cc1)C2CC=NN2 Amb25667317 [0,1,0,0,1,0|2,0,0]=4 1358 B13R2.12 Fc1ccc(cc1)C2CCCN2 Amb17659144 [0,1,0,0,1,0|1,0,1]=4 1359 B13R2.12 Fc1ccc(cc1)C2CCCN2 Amb24100665 [0,1,0,0,1,0|1,0,1]=4 1360 B13R2.12 Fc1ccc(cc1)[C@@H]2C=CCN2 Amb25799461 [0,1,0,0,1,0|1,0,0]=3 1361 B13R2.12 Fc1ccc(cc1)[C@@H]2CCCN2 Amb22225502 [0,1,0,0,1,0|1,0,1]=4 1362 B13R2.12 Fc1ccc(cc1)[C@@H]2COCN2 Amb24117849 [0,1,0,0,1,0|2,0,0]=4 1363 B13R2.12 Fc1ccc(cc1)[C@H]2CCCN2 Amb22265444 [0,1,0,0,1,0|1,0,1]=4 1364 B13R2.12 Fc1ccc(cc1)[C@H]2COCN2 Amb24531529 [0,1,0,0,1,0|2,0,0]=4 1365 B13R2.12 Ic1ccc(c[n]1)C2CNCC2 Amb25843941 [0,1,0,0,1,0|1,0,1]=4 1366 B13R2.12 Ic1ccc(c[n]1)[C@@H]2CCCN2 Amb24754044 [0,1,0,0,1,0|0,0,1]=3 1367 B13R2.12 Nc1[n]cc(c[n]1)C2CCCN2 Amb18828771 [0,1,0,0,1,0|1,0,1]=4 1368 B13R2.12 Nc1ccc([n][n]1)N2CC=CC2 Amb25325683 [0,1,0,0,1,0|2,0,0]=4 1369 B13R2.12 Nc1ccc(c[n]1)-c2[nH]cc[n]2 Amb25159695 [0,1,0,0,1,0|1,0,1]=4 1370 B13R2.12 Nc1ccc(c[n]1)C2CCCN2 Amb20617294 [0,1,0,0,1,0|0,0,1]=3 1371 B13R2.12 Nc1ccc(c[n]1)C2CCCO2 Amb20617291 [0,1,0,0,1,0|1,0,1]=4 1372 B13R2.12 Nc1ccc(c[n]1)[C@@H]2CCCN2 Amb25736346 [0,1,0,0,1,0|0,0,1]=3 1373 B13R2.12 Nc1ccc(c[n]1)[C@H]2CCCN2 Amb25335529 [0,1,0,0,1,0|0,0,1]=3 1374 B13R2.12 Nc1ccc(cc1)C2CCCN2 Amb18562044 [0,1,0,0,1,0|1,0,1]=4 1375 B13R2.12 Nc1ccc(cc1)C2NC=CN2 Amb24102709 [0,1,0,0,1,0|2,0,0]=4 1376 B13R2.12 Nc1ccc(cc1)N2CC=CC2 Amb25211239 [0,1,0,0,1,0|2,0,0]=4 1377 B13R2.12 Nc1ccc(cc1)[C@H]2CCCN2 Amb25149803 [0,1,0,0,1,0|1,0,1]=4 1378 B13R2.12 Nc1ccc(cn1)C2CCCC2 Amb10600543 [0,1,0,0,1,0|0,0,2]=4 1379 B13R2.12 Nc1ccc(cn1)C2CNCC2 Amb10600926 [0,1,0,0,1,0|1,0,1]=4 1380 B13R2.12 Nc1ccc(cn1)C2COCC2 Amb10600932 [0,1,0,0,1,0|1,0,1]=4 1381 B13R2.12 Oc1ccc(c[n]1)C2CCCN2 Amb23445213 [0,1,0,0,1,0|0,0,1]=3 1382 B13R2.12 Oc1ccc(c[n]1)[C@H]2CCCN2 Amb24725455 [0,1,0,0,1,0|0,0,1]=3 1383 B13R2.12 Oc1ccc(cc1)C2CCCN2 Amb10610042 [0,1,0,0,1,0|1,0,1]=4 1384 B13R2.12 Oc1ccc(cn1)C2CCCC2 Amb10600544 [0,1,0,0,1,0|0,0,2]=4 1385 B13R2.12 Sc1ccc(c[n]1)C2CCCN2 Amb23508000 [0,1,0,0,1,0|0,0,1]=3 1386 B13R2.12 Sc1ccc(c[n]1)[C@H]2CCCN2 Amb25228441 [0,1,0,0,1,0|0,0,1]=3 1387 B13R2.12 Sc1ccc(cc1)[C@H]2CCCN2 Amb25667071 [0,1,0,0,1,0|1,0,1]=4 1388 B13R2.13 Brc1cc(c[n]c1)-c2[nH]cc[n]2 Amb18336919 [0,1,0,0,1,0|1,0,1]=4 1389 B13R2.13 Brc1cc(c[n]c1)-c2cc[n][nH]2 Amb25034964 [0,1,0,0,1,0|1,0,1]=4 1390 B13R2.13 Brc1cc(c[n]c1)C2CCCC2 Amb20617717 [0,1,0,0,1,0|0,0,2]=4 1391 B13R2.13 Brc1cc(c[n]c1)C2CNCC2 Amb24082796 [0,1,0,0,1,0|1,0,1]=4 1392 B13R2.13 Brc1cc(c[n]c1)C2COCC2 Amb24320760 [0,1,0,0,1,0|1,0,1]=4 1393 B13R2.13 Brc1cc(c[n]c1)N2CC=CC2 Amb24497580 [0,1,0,0,1,0|1,0,0]=3 1394 B13R2.13 Brc1cc(ccc1)C2CCCN2 Amb17659178 [0,1,0,0,1,0|1,0,1]=4 1395 B13R2.13 Brc1cc(ccc1)N2CC=CC2 Amb22227591 [0,1,0,0,1,0|2,0,0]=4 1396 B13R2.13 Brc1cc(ccc1)[C@@H]2CCCN2 Amb23440340 [0,1,0,0,1,0|1,0,1]=4 1397 B13R2.13 Brc1cccc(c1)C2CCCN2 Amb2235034 [0,1,0,0,1,0|1,0,1]=4 1398 B13R2.13 Brc1cccc(c1)C2CCCN2 Amb2237174 [0,1,0,0,1,0|1,0,1]=4 1399 B13R2.13 Brc1cncc(c1)C2CCCN2 Amb17610051 [0,1,0,0,1,0|0,0,1]=3 1400 B13R2.13 Brc1cncc(c1)[C@@H]2CCCN2 Amb10603130 [0,1,0,0,1,0|0,0,1]=3 1401 B13R2.13 Cc1c[n]cc([n]1)C2CCCN2 Amb20062000 [0,1,0,0,1,0|1,0,1]=4 1402 B13R2.13 Cc1c[n]cc([n]1)C2CCCN2 Amb21960653 [0,1,0,0,1,0|1,0,1]=4 1403 B13R2.13 Cc1cc(c[n]c1)C2C=CCN2 Amb25817392 [0,1,0,0,1,0|0,0,0]=2 1404 B13R2.13 Cc1cc(ccc1)C2C=CCN2 Amb24439878 [0,1,0,0,1,0|1,0,0]=3 1405 B13R2.13 Cc1cc(ccc1)C2NCC=N2 Amb25846303 [0,1,0,0,1,0|2,0,0]=4 1406 B13R2.13 Cc1cc(ccc1)[C@H]2CCCN2 Amb24426768 [0,1,0,0,1,0|1,0,1]=4 1407 B13R2.13 Cc1cccc(c1)C2CCCN2 Amb2234644 [0,1,0,0,1,0|1,0,1]=4 1408 B13R2.13 Cc1cncc(c1)C2CCCN2 Amb17617711 [0,1,0,0,1,0|0,0,1]=3 1409 B13R2.13 Clc1cc(c[n]c1)C2CCCN2 Amb24709338 [0,1,0,0,1,0|0,0,1]=3 1410 B13R2.13 Clc1cc(c[n]c1)[C@H]2CCCN2 Amb25723391 [0,1,0,0,1,0|0,0,1]=3 1411 B13R2.13 Clc1cc(ccc1)C2CCCN2 Amb17659158 [0,1,0,0,1,0|1,0,1]=4 1412 B13R2.13 Clc1cc(ccc1)[C@@H]2CCCN2 Amb23440341 [0,1,0,0,1,0|1,0,1]=4 1413 B13R2.13 Clc1cc(ccc1)[C@H]2CCCN2 Amb24093535 [0,1,0,0,1,0|1,0,1]=4 1414 B13R2.13 Clc1cccc(c1)C2CCCN2 Amb2234805 [0,1,0,0,1,0|1,0,1]=4 1415 B13R2.13 Clc1cccc(c1)C2CCCN2 Amb2237167 [0,1,0,0,1,0|1,0,1]=4 1416 B13R2.13 Fc1cc(c[n]c1)C2C=CCN2 Amb25043053 [0,1,0,0,1,0|0,0,0]=2 1417 B13R2.13 Fc1cc(c[n]c1)C2CNCC2 Amb23586021 [0,1,0,0,1,0|1,0,1]=4 1418 B13R2.13 Fc1cc(c[n]c1)[C@@H]2CCCN2 Amb25757421 [0,1,0,0,1,0|0,0,1]=3 1419 B13R2.13 Fc1cc(ccc1)C2C=CCN2 Amb24593653 [0,1,0,0,1,0|1,0,0]=3 1420 B13R2.13 Fc1cc(ccc1)C2CCC=C2 Amb25751416 [0,1,0,0,1,0|2,0,0]=4 1421 B13R2.13 Fc1cc(ccc1)C2CCCN2 Amb17659166 [0,1,0,0,1,0|1,0,1]=4 1422 B13R2.13 Fc1cc(ccc1)[C@@H]2CCCN2 Amb22756941 [0,1,0,0,1,0|1,0,1]=4 1423 B13R2.13 Fc1cccc(c1)C2CCCN2 Amb10609533 [0,1,0,0,1,0|1,0,1]=4 1424 B13R2.13 Fc1cccc(c1)[C@H]2CCCN2 Amb17912088 [0,1,0,0,1,0|1,0,1]=4 1425 B13R2.13 Ic1cc(c[n]c1)C2CCCN2 Amb25786231 [0,1,0,0,1,0|0,0,1]=3 1426 B13R2.13 Ic1cc(c[n]c1)[C@@H]2CCCN2 Amb25770637 [0,1,0,0,1,0|0,0,1]=3 1427 B13R2.13 Ic1cc(ccc1)C2CCCN2 Amb17659161 [0,1,0,0,1,0|1,0,1]=4 1428 B13R2.13 Ic1cc(ccc1)[C@H]2CCCN2 Amb24483625 [0,1,0,0,1,0|1,0,1]=4 1429 B13R2.13 Ic1cccc(c1)C2CCCN2 Amb2235906 [0,1,0,0,1,0|1,0,1]=4 1430 B13R2.13 Nc1c[n]cc([n]1)N2CC=CC2 Amb25289873 [0,1,0,0,1,0|2,0,0]=4 1431 B13R2.13 Nc1cc(c[n]c1)C2CCCC2 Amb18829594 [0,1,0,0,1,0|0,0,2]=4 1432 B13R2.13 Nc1cc(c[n]c1)C2CCCN2 Amb24401013 [0,1,0,0,1,0|0,0,1]=3 1433 B13R2.13 Nc1cc(ccc1)C2CC=CC2 Amb24399732 [0,1,0,0,1,0|1,0,0]=3 1434 B13R2.13 Nc1cc(ccc1)C2CCC=C2 Amb25858701 [0,1,0,0,1,0|2,0,0]=4 1435 B13R2.13 Nc1cc(ccc1)C2CCCN2 Amb18064042 [0,1,0,0,1,0|1,0,1]=4 1436 B13R2.13 O=C1C=C(C=NN1)C2CCCN2 Amb24538770 [0,1,0,0,1,0|1,0,1]=4 1437 B13R2.13 O=C1C=CCC(N1)c2ccc[s]2 Amb24674259 [0,1,0,0,1,0|1,0,1]=4 1438 B13R2.13 O=C1C=CCC(N1)c2ccco2 Amb24447070 [0,1,0,0,1,0|1,0,1]=4 1439 B13R2.13 O=C1C=CC[C@H](N1)c2ccc[s]2 Amb24496811 [0,1,0,0,1,0|1,0,1]=4 1440 B13R2.13 O=C1CC(NC=C1)c2ccco2 Amb24382074 [0,1,0,0,1,0|1,0,1]=4 1441 B13R2.13 O=C1CC(NCC1)c2[n]cc[s]2 Amb18823627 [0,1,0,0,1,0|1,0,1]=4 1442 B13R2.13 O=C1CC(NCC1)c2c[n]co2 Amb18827849 [0,1,0,0,1,0|1,0,1]=4 1443 B13R2.13 O=C1CC(NCC1)c2c[n]oc2 Amb18827848 [0,1,0,0,1,0|1,0,1]=4 1444 B13R2.13 O=C1CC(NCC1)c2cco[n]2 Amb18827847 [0,1,0,0,1,0|1,0,1]=4 1445 B13R2.13 O=C1CC(NCC1)c2ccoc2 Amb18828418 [0,1,0,0,1,0|1,0,1]=4 1446 B13R2.13 O=C1CC(NCC1)c2coc[n]2 Amb18827846 [0,1,0,0,1,0|1,0,1]=4 1447 B13R2.13 O=C1CCNC(C1)c2ccco2 Amb17232522 [0,1,0,0,1,0|1,0,1]=4 1448 B13R2.13 O=C1CCNC(C1)c2cccs2 Amb17233846 [0,1,0,0,1,0|1,0,1]=4 1449 B13R2.13 O=C1C[C@H](NC=C1)c2ccco2 Amb25106834 [0,1,0,0,1,0|1,0,1]=4 1450 B13R2.13 OC1C=CCC(O1)c2cocc2 Amb25284611 [0,1,0,0,1,0|2,0,0]=4 1451 B13R2.13 Oc1cc(c[n]c1)-c2ccc[nH]2 Amb25713880 [0,1,0,0,1,0|0,0,2]=4 1452 B13R2.13 Oc1cc(c[n]c1)C2CCCC2 Amb20617719 [0,1,0,0,1,0|0,0,2]=4 1453 B13R2.13 Oc1cc(c[n]c1)[C@@H]2CCCN2 Amb24488503 [0,1,0,0,1,0|0,0,1]=3 1454 B13R2.13 Oc1cc(ccc1)C2CCC=C2 Amb24370125 [0,1,0,0,1,0|2,0,0]=4 1455 B13R2.13 Oc1cc(ccc1)C2CCCN2 Amb18062874 [0,1,0,0,1,0|1,0,1]=4 1456 B13R2.13 Oc1cc(ccc1)[C@@H]2CCCN2 Amb24446614 [0,1,0,0,1,0|1,0,1]=4 1457 B13R2.13 Sc1cc(ccc1)C2CCCN2 Amb24094046 [0,1,0,0,1,0|1,0,1]=4 1458 B13R2.13 Sc1cc(ccc1)[C@@H]2CCCN2 Amb25088883 [0,1,0,0,1,0|1,0,1]=4 1459 B13R2.13 Sc1cc(ccc1)[C@H]2CCCN2 Amb25697091 [0,1,0,0,1,0|1,0,1]=4 1460 B13R2.15 Brc1cn[nH]c1c2cccnc2 Amb17133651 [0,1,0,0,1,0|1,0,1]=4 1461 B13R2.15 CC1NCCC1c2c[n]ccc2 Amb18947151 [0,1,0,0,1,0|1,0,1]=4 1462 B13R2.15 CN1CCC=C1c2cccnc2 Amb17612969 [0,1,0,0,1,0|0,0,2]=4 1463 B13R2.15 CN1CCCC1c2c[n]ccc2 Amb22734154 [0,1,0,0,1,0|0,0,1]=3 1464 B13R2.15 CN1CCCC1c2c[n]ccc2 Amb22800345 [0,1,0,0,1,0|0,0,1]=3 1465 B13R2.15 CN1CCCC1c2c[n]ccc2 Amb24325351 [0,1,0,0,1,0|0,0,1]=3 1466 B13R2.15 CN1CCCC1c2cccnc2 Amb17618349 [0,1,0,0,1,0|0,0,1]=3 1467 B13R2.15 CN1CCC[13CH]1[13c]2[13cH][13cH][13cH]n[13cH]2 Amb17618328 [0,1,0,0,1,0|0,0,1]=3 1468 B13R2.15 CN1CCC[C@@H]1c2c[n]ccc2 Amb22748721 [0,1,0,0,1,0|0,0,1]=3 1469 B13R2.15 CN1CCC[C@@H]1c2c[n]ccc2 Amb22801243 [0,1,0,0,1,0|0,0,1]=3 1470 B13R2.15 CN1CCC[C@@H]1c2c[n]ccc2 Amb23591442 [0,1,0,0,1,0|0,0,1]=3 1471 B13R2.15 CN1CCC[C@@H]1c2c[n]ccc2 Amb24325365 [0,1,0,0,1,0|0,0,1]=3 1472 B13R2.15 CN1CCC[C@@H]1c2ccc[n]c2 Amb22748284 [0,1,0,0,1,0|0,0,1]=3 1473 B13R2.15 CN1CCC[C@@H]1c2ccccc2 Amb25817229 [0,1,0,0,1,0|1,0,1]=4 1474 B13R2.15 CN1CCOC1c2cccnc2 Amb17334613 [0,1,0,0,1,0|1,0,1]=4 1475 B13R2.15 C[C@@H]1CCN[C@H]1c2ccc[n]c2 Amb18829583 [0,1,0,0,1,0|0,0,1]=3 1476 B13R2.15 C[C@@H]1CCN[C@H]1c2ccccc2 Amb18829884 [0,1,0,0,1,0|1,0,1]=4 1477 B13R2.15 C[C@H]1CCN[C@H]1c2ccc[n]c2 Amb25261345 [0,1,0,0,1,0|0,0,1]=3 1478 B13R2.15 C[C@H]1CCN[C@H]1c2ccccc2 Amb24741661 [0,1,0,0,1,0|1,0,1]=4 1479 B13R2.15 C[n]1[n]ccc1-c2c[n]ccc2 Amb21927563 [0,1,0,0,1,0|1,0,1]=4 1480 B13R2.15 C[n]1cccc1-c2c[n]ccc2 Amb19133407 [0,1,0,0,1,0|0,0,2]=4 1481 B13R2.15 ClC1CCCC1c2ccc[n]c2 Amb18805468 [0,1,0,0,1,0|0,0,2]=4 1482 B13R2.15 Cn1ccnc1c2cccnc2 Amb17232291 [0,1,0,0,1,0|1,0,1]=4 1483 B13R2.15 FC1CCNC1c2ccccc2 Amb25160023 [0,1,0,0,1,0|1,0,1]=4 1484 B13R2.15 NC1=CCNN1c2ccccc2 Amb17594021 [0,1,0,0,1,0|2,0,0]=4 1485 B13R2.15 NC1C=CNN1c2ccccc2 Amb25708429 [0,1,0,0,1,0|2,0,0]=4 1486 B13R2.15 NC1CCCC1c2ccc[n]c2 Amb18947759 [0,1,0,0,1,0|0,0,2]=4 1487 B13R2.15 NC1CCNC1c2ccccc2 Amb18829599 [0,1,0,0,1,0|1,0,1]=4 1488 B13R2.15 NC1CCOC1c2ccc[n]c2 Amb24407840 [0,1,0,0,1,0|1,0,1]=4 1489 B13R2.15 NN1CCCC1c2ccccc2 Amb22288944 [0,1,0,0,1,0|1,0,1]=4 1490 B13R2.15 Nc1cc[nH]c1-c2c[n]ccc2 Amb18830356 [0,1,0,0,1,0|0,0,2]=4 1491 B13R2.15 O=C1C=CCC1c2ccccc2 Amb24520656 [0,1,0,0,1,0|1,0,1]=4 1492 B13R2.15 O=C1CCCC1c2ccc[n]c2 Amb18797977 [0,1,0,0,1,0|1,0,1]=4 1493 B13R2.15 O=C1CCNC1c2ccccc2 Amb18829957 [0,1,0,0,1,0|1,0,1]=4 1494 B13R2.15 O=C1CCNC1c2ccccc2 Amb22901061 [0,1,0,0,1,0|1,0,1]=4 1495 B13R2.15 O=C1NCCC1c2ccc[n]c2 Amb24393400 [0,1,0,0,1,0|2,0,0]=4 1496 B13R2.15 O=C1OCCC1c2ccc[n]c2 Amb22757403 [0,1,0,0,1,0|2,0,0]=4 1497 B13R2.15 OC1CCCC1c2ccc[n]c2 Amb18798202 [0,1,0,0,1,0|0,0,2]=4 1498 B13R2.15 OC1CCNC1c2ccc[n][n]2 Amb18828315 [0,1,0,0,1,0|1,0,1]=4 1499 B13R2.15 OC1CCNC1c2ccc[n]c2 Amb18646111 [0,1,0,0,1,0|0,0,1]=3 1500 B13R2.15 OC1CCNC1c2ccccc2 Amb18829239 [0,1,0,0,1,0|1,0,1]=4 1501 B13R2.15 O[C@H]1CC=C[C@@H]1c2ccccc2 Amb24519780 [0,1,0,0,1,0|2,0,0]=4 1502 B13R2.15 O[C@H]1CC=C[C@H]1c2ccccc2 Amb25236124 [0,1,0,0,1,0|2,0,0]=4 1503 B13R2.18 Brc1[n]cccc1C2CCCC2 Amb24319280 [0,1,0,0,1,0|0,0,2]=4 1504 B13R2.18 Brc1[n]cccc1C2CNCC2 Amb25301377 [0,1,0,0,1,0|1,0,1]=4 1505 B13R2.18 Brc1[n]cccc1[C@@H]2CCCN2 Amb25148648 [0,1,0,0,1,0|0,0,1]=3 1506 B13R2.18 Brc1[n]cccc1[C@H]2CCCN2 Amb24728230 [0,1,0,0,1,0|0,0,1]=3 1507 B13R2.18 Brc1cc[n]cc1C2CCCC2 Amb20617517 [0,1,0,0,1,0|0,0,2]=4 1508 B13R2.18 Brc1cc[n]cc1[C@@H]2CCCN2 Amb25804269 [0,1,0,0,1,0|0,0,1]=3 1509 B13R2.18 Brc1ccccc1C2CCCN2 Amb17659160 [0,1,0,0,1,0|1,0,1]=4 1510 B13R2.18 Brc1ccccc1C2CCCN2 Amb20626046 [0,1,0,0,1,0|1,0,1]=4 1511 B13R2.18 Brc1ccccc1C2CCCN2 Amb2237168 [0,1,0,0,1,0|1,0,1]=4 1512 B13R2.18 Brc1ccccc1C2NCC=N2 Amb24695264 [0,1,0,0,1,0|2,0,0]=4 1513 B13R2.18 Brc1ccccc1N2CC=CC2 Amb24063958 [0,1,0,0,1,0|2,0,0]=4 1514 B13R2.18 Cc1[n]c[n]cc1C2CCCN2 Amb18829151 [0,1,0,0,1,0|1,0,1]=4 1515 B13R2.18 Cc1[n]cc[n]c1C2CCCN2 Amb20062001 [0,1,0,0,1,0|1,0,1]=4 1516 B13R2.18 Cc1[n]cc[n]c1C2CCCN2 Amb21960457 [0,1,0,0,1,0|1,0,1]=4 1517 B13R2.18 Cc1[n]cccc1C2CNCC2 Amb23586023 [0,1,0,0,1,0|1,0,1]=4 1518 B13R2.18 Cc1cc[n]cc1-c2[nH]cc[n]2 Amb24362288 [0,1,0,0,1,0|1,0,1]=4 1519 B13R2.18 Cc1cc[n]cc1C2CCCN2 Amb18645737 [0,1,0,0,1,0|0,0,1]=3 1520 B13R2.18 Cc1cc[n]cc1C2CNCC2 Amb24471679 [0,1,0,0,1,0|1,0,1]=4 1521 B13R2.18 Cc1cc[n]cc1C2NCCS2 Amb25208252 [0,1,0,0,1,0|1,0,1]=4 1522 B13R2.18 Cc1ccccc1C2CCCN2 Amb20668068 [0,1,0,0,1,0|1,0,1]=4 1523 B13R2.18 Cc1ccccc1C2CCCN2 Amb2234653 [0,1,0,0,1,0|1,0,1]=4 1524 B13R2.18 Cc1ccccc1[C@@H]2CCCN2 Amb23440375 [0,1,0,0,1,0|1,0,1]=4 1525 B13R2.18 Cc1ccccc1[C@@H]2CCCN2 Amb24117100 [0,1,0,0,1,0|1,0,1]=4 1526 B13R2.18 Cc1ccccc1[C@H]2CCCN2 Amb24714734 [0,1,0,0,1,0|1,0,1]=4 1527 B13R2.18 Cc1ncccc1C2CCCN2 Amb15692075 [0,1,0,0,1,0|0,0,1]=3 1528 B13R2.18 Clc1[n]cccc1-c2[nH]cc[n]2 Amb25314405 [0,1,0,0,1,0|1,0,1]=4 1529 B13R2.18 Clc1[n]cccc1C2CCCC2 Amb24319281 [0,1,0,0,1,0|0,0,2]=4 1530 B13R2.18 Clc1[n]cccc1[C@@H]2CCCN2 Amb24426770 [0,1,0,0,1,0|0,0,1]=3 1531 B13R2.18 Clc1cc[n]cc1C2CCCN2 Amb24409557 [0,1,0,0,1,0|0,0,1]=3 1532 B13R2.18 Clc1cc[n]cc1C2CNCC2 Amb18823442 [0,1,0,0,1,0|1,0,1]=4 1533 B13R2.18 Clc1cc[n]cc1[C@H]2CCCN2 Amb25751425 [0,1,0,0,1,0|0,0,1]=3 1534 B13R2.18 Clc1ccccc1C2CCCN2 Amb19887240 [0,1,0,0,1,0|1,0,1]=4 1535 B13R2.18 Clc1ccccc1C2CCCN2 Amb2236611 [0,1,0,0,1,0|1,0,1]=4 1536 B13R2.18 Clc1ccccc1[C@@H]2CCCN2 Amb24062899 [0,1,0,0,1,0|1,0,1]=4 1537 B13R2.18 Clc1ccccc1[C@H]2CCCN2 Amb24078711 [0,1,0,0,1,0|1,0,1]=4 1538 B13R2.18 Fc1[n]cccc1-c2ccc[nH]2 Amb25158108 [0,1,0,0,1,0|0,0,2]=4 1539 B13R2.18 Fc1[n]cccc1C2CNCC2 Amb18827733 [0,1,0,0,1,0|1,0,1]=4 1540 B13R2.18 Fc1ccccc1C2C=CCN2 Amb24439899 [0,1,0,0,1,0|1,0,0]=3 1541 B13R2.18 Fc1ccccc1[C@@H]2CCCN2 Amb24094371 [0,1,0,0,1,0|1,0,1]=4 1542 B13R2.18 Fc1ccccc1[C@H]2CCCN2 Amb24099980 [0,1,0,0,1,0|1,0,1]=4 1543 B13R2.18 Fc1ccccc1[C@H]2CCCN2 Amb25237112 [0,1,0,0,1,0|1,0,1]=4 1544 B13R2.18 Ic1ccccc1N2CC=CC2 Amb25250658 [0,1,0,0,1,0|2,0,0]=4 1545 B13R2.18 Nc1[n]cc[n]c1N2CC=CC2 Amb25143161 [0,1,0,0,1,0|2,0,0]=4 1546 B13R2.18 Nc1[n]cccc1-c2[nH]cc[n]2 Amb18645331 [0,1,0,0,1,0|1,0,1]=4 1547 B13R2.18 Nc1[n]cccc1-c2ccc[nH]2 Amb25761407 [0,1,0,0,1,0|0,0,2]=4 1548 B13R2.18 Nc1[n]cccc1C2CCCC2 Amb18829596 [0,1,0,0,1,0|0,0,2]=4 1549 B13R2.18 Nc1[n]cccc1C2CCCN2 Amb23445310 [0,1,0,0,1,0|0,0,1]=3 1550 B13R2.18 Nc1[n]cccc1N2CC=CC2 Amb24565858 [0,1,0,0,1,0|1,0,0]=3 1551 B13R2.18 Nc1[n]cccc1[C@H]2CCCN2 Amb25320296 [0,1,0,0,1,0|0,0,1]=3 1552 B13R2.18 Nc1cc[n]cc1-c2ccc[nH]2 Amb24358429 [0,1,0,0,1,0|0,0,2]=4 1553 B13R2.18 Nc1cc[n]cc1C2CCCC2 Amb24319530 [0,1,0,0,1,0|0,0,2]=4 1554 B13R2.18 Nc1cc[n]cc1N2CC=CC2 Amb24710586 [0,1,0,0,1,0|1,0,0]=3 1555 B13R2.18 Nc1cc[n]cc1[C@H]2CCCN2 Amb24417742 [0,1,0,0,1,0|0,0,1]=3 1556 B13R2.18 Nc1ccccc1C2CCC=C2 Amb18126193 [0,1,0,0,1,0|2,0,0]=4 1557 B13R2.18 Nc1ccccc1C2CCCN2 Amb18064028 [0,1,0,0,1,0|1,0,1]=4 1558 B13R2.18 Nc1ccccc1N2CC=CC2 Amb24539214 [0,1,0,0,1,0|2,0,0]=4 1559 B13R2.18 Nc1ccccc1[C@H]2CCCN2 Amb25149804 [0,1,0,0,1,0|1,0,1]=4 1560 B13R2.18 Oc1[n]cccc1C2CCCC2 Amb24319282 [0,1,0,0,1,0|0,0,2]=4 1561 B13R2.18 Oc1[n]cccc1C2CCCN2 Amb23445241 [0,1,0,0,1,0|0,0,1]=3 1562 B13R2.18 Oc1[n]cccc1[C@@H]2CCCN2 Amb25066527 [0,1,0,0,1,0|0,0,1]=3 1563 B13R2.18 Oc1cc[n]cc1[C@H]2CCCN2 Amb24432682 [0,1,0,0,1,0|0,0,1]=3 1564 B13R2.18 Oc1ccccc1C2C=CCC2 Amb1150411 [0,1,0,0,1,0|2,0,0]=4 1565 B13R2.18 Oc1ccccc1C2C=CCO2 Amb25282851 [0,1,0,0,1,0|2,0,0]=4 1566 B13R2.18 Oc1ccccc1C2C=CCS2 Amb25373253 [0,1,0,0,1,0|2,0,0]=4 1567 B13R2.18 Oc1ccccc1C2CCCN2 Amb18560469 [0,1,0,0,1,0|1,0,1]=4 1568 B13R2.18 Oc1ccccc1[C@@H]2CCCN2 Amb24431174 [0,1,0,0,1,0|1,0,1]=4 1569 B13R2.18 Sc1[n]cccc1C2CCCN2 Amb23508034 [0,1,0,0,1,0|0,0,1]=3 1570 B13R2.18 Sc1ccccc1C2CCCN2 Amb24089709 [0,1,0,0,1,0|1,0,1]=4 1571 B13R2.18 Sc1ccccc1[C@H]2CCCN2 Amb25129494 [0,1,0,0,1,0|1,0,1]=4 1572 B13R2.223 BrC1(CC=CC1)c2ccccc2 Amb21856760 [0,1,0,0,1,0|1,0,0]=3 1573 B13R2.223 BrC1(CCC=C1)c2ccccc2 Amb21856767 [0,1,0,0,1,0|2,0,0]=4 1574 B13R2.223 CC1(CCCN1)c2c[n]cc[n]2 Amb24706263 [0,1,0,0,1,0|1,0,1]=4 1575 B13R2.223 CC1(CCCN1)c2c[n]ccc2 Amb24660358 [0,1,0,0,1,0|0,0,1]=3 1576 B13R2.223 CC1(CCCN1)c2ccccc2 Amb18829881 [0,1,0,0,1,0|1,0,1]=4 1577 B13R2.223 CC1(CNCC1)c2c[n]ccc2 Amb18947277 [0,1,0,0,1,0|1,0,1]=4 1578 B13R2.223 CC1(COCN1)c2ccccc2 Amb25311138 [0,1,0,0,1,0|2,0,0]=4 1579 B13R2.223 CC1(NCCS1)c2c[n]ccc2 Amb25730002 [0,1,0,0,1,0|1,0,1]=4 1580 B13R2.223 FC1(CNCC1)c2c[n]ccc2 Amb24366079 [0,1,0,0,1,0|1,0,1]=4 1581 B13R2.223 NC1(CC=CC1)c2c[n]ccc2 Amb18830180 [0,1,0,0,1,0|0,0,0]=2 1582 B13R2.223 NC1(CC=CC1)c2cc[n]cc2 Amb18830178 [0,1,0,0,1,0|2,0,0]=4 1583 B13R2.223 NC1(CC=CC1)c2ccccc2 Amb24593679 [0,1,0,0,1,0|1,0,0]=3 1584 B13R2.223 NC1(CCCC1)c2c[n]ccc2 Amb18944274 [0,1,0,0,1,0|0,0,2]=4 1585 B13R2.223 OC1(CCCC1)c2c[n]ccc2 Amb18792484 [0,1,0,0,1,0|0,0,2]=4 1586 B13R2.223 OC1(CNCC1)c2c[n]ccc2 Amb24063163 [0,1,0,0,1,0|1,0,1]=4 1587 B13R2.223 OC1(COCC1)c2c[n]ccc2 Amb25343096 [0,1,0,0,1,0|1,0,1]=4 1588 B13R2.223 OC1(CSCC1)c2c[n]ccc2 Amb25669503 [0,1,0,0,1,0|1,0,1]=4 1589 B15R2.29 Brc1c[n]c(c[n]1)NC2CCC=CC2 Amb24681657 [0,1,0,0,0,1|2,0,0]=4 1590 B15R2.29 Cc1ccc(NC2CCC=CC2)[n][n]1 Amb25760591 [0,1,0,0,0,1|2,0,0]=4 1591 B15R2.29 Clc1ccc(NC2CCC=CC2)[n][n]1 Amb24336113 [0,1,0,0,0,1|2,0,0]=4 1592 B15R2.29 Fc1ccc(cc1)NC2CC=CCC2 Amb25060688 [0,1,0,0,0,1|2,0,0]=4 1593 B15R2.29 O=C1CNC(Cc2ccccc2)CN1 Amb18819212 [0,1,0,0,0,1|2,0,0]=4 1594 B15R2.29 O=C1CN[C@H](Cc2ccccc2)CN1 Amb24763664 [0,1,0,0,0,1|2,0,0]=4 1595 B15R2.31 Brc1cc(CC2CCCCN2)c[n]c1 Amb25763256 [0,1,0,0,0,1|0,0,2]=4 1596 B15R2.31 Brc1cc(c[n]c1)NC2CC=CCC2 Amb25061048 [0,1,0,0,0,1|1,0,0]=3 1597 B15R2.31 C=C1CC(Cc2ccccc2)NCC1 Amb18649678 [0,1,0,0,0,1|1,0,1]=4 1598 B15R2.31 CC1CC(Cc2ccc[n]c2)NCC1 Amb24376932 [0,1,0,0,0,1|0,0,2]=4 1599 B15R2.31 CN1CC(Cc2c[n]ccc2)NCC1 Amb18565009 [0,1,0,0,0,1|1,0,1]=4 1600 B15R2.31 Cc1c[n]cc(NC2CCC=CC2)[n]1 Amb25128749 [0,1,0,0,0,1|2,0,0]=4 1601 B15R2.31 Clc1c[n]cc(NC2CCC=CC2)[n]1 Amb23663196 [0,1,0,0,0,1|2,0,0]=4 1602 B15R2.31 O=C1CC(Cc2ccc[n]c2)CCC1 Amb24645957 [0,1,0,0,0,1|1,0,1]=4 1603 B15R2.31 O=C1CC(Cc2ccccc2)NCC1 Amb22235280 [0,1,0,0,0,1|1,0,1]=4 1604 B15R2.31 O=C1C[C@@H](Cc2ccccc2)NCC1 Amb25244167 [0,1,0,0,0,1|1,0,1]=4 1605 B15R2.31 O=C1C[C@H](Cc2ccccc2)NCC1 Amb24554093 [0,1,0,0,0,1|1,0,1]=4 1606 B15R2.38 Nc1cc[n]cc1NC2CC=CCC2 Amb25170745 [0,1,0,0,0,1|1,0,0]=3 1607 B15R2.38 OC1C=CCCC1Cc2ccccc2 Amb25190712 [0,1,0,0,0,1|2,0,0]=4 1608 B15R2.38 O[C@@H]1C=CCC[C@@H]1Cc2ccccc2 Amb24632507 [0,1,0,0,0,1|2,0,0]=4 1609 B15R2.38 O[C@H]1C=CCC[C@@H]1Cc2ccccc2 Amb25333614 [0,1,0,0,0,1|2,0,0]=4 1610 B15R2.38 O[C@H]1CC=CC[C@@H]1Nc2ccccc2 Amb25270109 [0,1,0,0,0,1|2,0,0]=4 1611 B15R2.2226 O=C(C1CSCCN1)c2ccc[n]c2 Amb24676022 [0,1,0,0,0,1|1,0,1]=4 1612 B15R2.2226 OC(C1CCC=CC1)c2c[n]cc[n]2 Amb25677978 [0,1,0,0,0,1|2,0,0]=4 1613 B15R2.2226 OC(c1cccnc1)C2CCCCN2 Amb17235446 [0,1,0,0,0,1|0,0,2]=4 1614 B15R2.54 CN1CCNCCC1c2c[n]ccc2 Amb18565010 [0,1,0,0,0,1|0,0,2]=4 1615 B15R2.54 O=C1NCC=CCC1c2cc[n]cc2 Amb25033424 [0,1,0,0,0,1|2,0,0]=4 1616 B15R2.54 OC1CCC=CCC1c2ccccc2 Amb24379806 [0,1,0,0,0,1|2,0,0]=4 1617 B15R2.543 CC1CC=CCC(N1)c2ccccc2 Amb25346625 [0,1,0,0,0,1|1,0,0]=3 1618 B15R2.543 CC=1CC(NCCN1)c2ccccc2 Amb24695241 [0,1,0,0,0,1|1,0,1]=4 1619 B15R2.543 O=C1CC(NCCN1)c2ccc[n]c2 Amb18564860 [0,1,0,0,0,1|0,0,1]=3 1620 B15R2.543 O=C1CC(NCCN1)c2ccccc2 Amb22056041 [0,1,0,0,0,1|1,0,1]=4 1621 B15R2.543 O=C1CC=CCC(N1)c2ccccc2 Amb25122708 [0,1,0,0,0,1|1,0,0]=3 1622 B15R2.548 CN1CCNC(CC1)c2c[n]ccc2 Amb18565011 [0,1,0,0,0,1|0,0,2]=4 1623 B15R2.6968 Cc1ccc(c[n]1)C2CCCCCN2 Amb24402564 [0,1,0,0,0,1|0,0,2]=4 1624 B15R2.6968 Clc1ccc(cc1)C2OCC=CCO2 Amb22472186 [0,1,0,0,0,1|2,0,0]=4 1625 B15R2.7124 Brc1cc(ccc1)C2CNCC=CC2 Amb24446732 [0,1,0,0,0,1|1,0,0]=3 1626 B15R2.7124 Clc1cc(c[n]c1)C2CCCCCN2 Amb25053516 [0,1,0,0,0,1|0,0,2]=4 1627 B15R2.7124 Fc1cc(c[n]c1)C2CCCCCN2 Amb24717467 [0,1,0,0,0,1|0,0,2]=4 1628 B15R2.7960 CC1(CCCCCN1)c2c[n]ccc2 Amb24713101 [0,1,0,0,0,1|0,0,2]=4 1629 B15R2.8789 Brc1ccccc1C2CNCC=CC2 Amb25671681 [0,1,0,0,0,1|1,0,0]=3 1630 B15R2.8789 Cc1[n]cccc1C2CCCCCN2 Amb25249620 [0,1,0,0,0,1|0,0,2]=4 1631 B15R2.8789 Cc1cc[n]cc1C2CCCCCN2 Amb24521464 [0,1,0,0,0,1|0,0,2]=4 1632 B15R2.8789 Fc1ccccc1C2OCC=CCO2 Amb2406178 [0,1,0,0,0,1|2,0,0]=4 1633 B15R2.17 COc1c[n]cc(c1)C2CCCCN2 Amb24411519 [0,2,0,0,0,0|0,0,2]=4 1634 B15R2.17 COc1c[n]cc(c1)C2CNCCN2 Amb24694044 [0,2,0,0,0,0|1,0,1]=4 1635 B15R2.17 COc1c[n]cc(c1)[C@@H]2CNCCN2 Amb25213062 [0,2,0,0,0,0|1,0,1]=4 1636 B15R2.17 COc1c[n]cc(c1)[C@H]2CCCCN2 Amb25840600 [0,2,0,0,0,0|0,0,2]=4 1637 B15R2.17 COc1c[n]cc(c1)[C@H]2COCCN2 Amb24744492 [0,2,0,0,0,0|1,0,1]=4 1638 B15R2.17 N#Cc1cc(c[n]c1)C2CCCCN2 Amb24615630 [0,2,0,0,0,0|0,0,2]=4 1639 B15R2.17 N#Cc1cc(c[n]c1)C2COCCN2 Amb25759740 [0,2,0,0,0,0|1,0,1]=4 1640 B15R2.17 N#Cc1cc(c[n]c1)[C@@H]2CCCCN2 Amb25814657 [0,2,0,0,0,0|0,0,2]=4 1641 B15R2.17 N#Cc1cc(c[n]c1)[C@@H]2CNCCN2 Amb24335814 [0,2,0,0,0,0|1,0,1]=4 1642 B15R2.17 N#Cc1cc(c[n]c1)[C@@H]2COCCN2 Amb25680037 [0,2,0,0,0,0|1,0,1]=4 1643 B15R2.17 N#Cc1cc(c[n]c1)[C@H]2CCCCN2 Amb24657304 [0,2,0,0,0,0|0,0,2]=4 1644 B15R2.17 O=Cc1cc(c[n]c1)C2COCCN2 Amb24336474 [0,2,0,0,0,0|1,0,1]=4 1645 B15R2.17 O=Cc1cc(c[n]c1)[C@H]2CCCCN2 Amb25710015 [0,2,0,0,0,0|0,0,2]=4 1646 B15R2.17 OCC1C=CCC(N1)c2ccccc2 Amb25037008 [0,2,0,0,0,0|1,0,0]=3 1647 B15R2.17 OCC1CC(NCC1)c2ccc[n]c2 Amb25029083 [0,2,0,0,0,0|0,0,2]=4 1648 B15R2.17 OCC=1CCNC(C1)c2ccc[n]c2 Amb25110069 [0,2,0,0,0,0|0,0,2]=4 1649 B15R2.17 OCC=1CCN[C@@H](C1)c2ccc[n]c2 Amb24365910 [0,2,0,0,0,0|0,0,2]=4 1650 B15R2.17 OC[C@H]1C=CC[C@H](N1)c2ccccc2 Amb25195385 [0,2,0,0,0,0|1,0,0]=3 1651 B15R2.17 O\N=C\1/CC(CCC1)c2c[n]ccc2 Amb25801094 [0,2,0,0,0,0|1,0,1]=4 1652 B15R2.27 CC1=CC(=O)CC(N1)c2ccc[n]c2 Amb25804682 [0,2,0,0,0,0|0,0,1]=3 1653 B15R2.27 CC1=CC(=O)CC(N1)c2ccccc2 Amb24756480 [0,2,0,0,0,0|1,0,1]=4 1654 B15R2.27 CC1CC(=O)CC(N1)c2c[n]ccc2 Amb18819315 [0,2,0,0,0,0|0,0,1]=3 1655 B15R2.27 CC1CC(=O)CC(N1)c2ccccc2 Amb18820075 [0,2,0,0,0,0|1,0,1]=4 1656 B15R2.27 CC1NC(CC(=O)N1)c2c[n]ccc2 Amb25859286 [0,2,0,0,0,0|1,0,0]=3 1657 B15R2.27 CC=1CC(CC(Cl)C1)c2ccccc2 Amb24666724 [0,2,0,0,0,0|2,0,0]=4 1658 B15R2.27 CC=1CC(CC(O)C1)c2ccccc2 Amb25105929 [0,2,0,0,0,0|2,0,0]=4 1659 B15R2.27 CC=1CC(NC(=O)C1)c2ccccc2 Amb24506568 [0,2,0,0,0,0|1,0,1]=4 1660 B15R2.27 CC=1CC(OC(O)C1)c2ccc[n]c2 Amb24688329 [0,2,0,0,0,0|1,0,0]=3 1661 B15R2.27 CC=1CC(OC(O)C1)c2ccccc2 Amb25748813 [0,2,0,0,0,0|2,0,0]=4 1662 B15R2.27 CC=1C[C@H](C[C@H](O)C1)c2ccccc2 Amb24733360 [0,2,0,0,0,0|2,0,0]=4 1663 B15R2.27 C[C@@H]1CC(=O)C[C@@H](N1)c2ccccc2 Amb25247231 [0,2,0,0,0,0|1,0,1]=4 1664 B15R2.28 CC=1CN(CCC1)c2ccc(N)[n]c2 Amb24522749 [0,2,0,0,0,0|2,0,0]=4 1665 B15R2.28 Cc1[n]cc(c[n]1)C2CC(=O)CCN2 Amb18818395 [0,2,0,0,0,0|1,0,1]=4 1666 B15R2.28 Cc1cc(c[n]c1)C2CCC(=O)CC2 Amb25665587 [0,2,0,0,0,0|1,0,1]=4 1667 B15R2.28 Cc1ccc(c[n]1)C2CC(=O)C=CO2 Amb25094573 [0,2,0,0,0,0|1,0,1]=4 1668 B15R2.28 Cc1ccc(c[n]1)C2CC(=O)CCC2 Amb25793813 [0,2,0,0,0,0|1,0,1]=4 1669 B15R2.28 Cc1ccc(cc1)[C@@H]2CC(=O)C=CN2 Amb25778198 [0,2,0,0,0,0|1,0,1]=4 1670 B15R2.28 Nc1ccc(c[n]1)N2CCC=C(F)C2 Amb24522808 [0,2,0,0,0,0|2,0,0]=4 1671 B15R2.28 O=C1C=CCC(N1)c2ccc(F)cc2 Amb24530469 [0,2,0,0,0,0|1,0,1]=4 1672 B15R2.28 O=C1CC(NC=C1)c2ccc(Cl)cc2 Amb24682114 [0,2,0,0,0,0|1,0,1]=4 1673 B15R2.28 O=C1CC(NC=C1)c2ccc(F)cc2 Amb25779285 [0,2,0,0,0,0|1,0,1]=4 1674 B15R2.28 O=C1CC(NCC1)c2ccc(F)[n]c2 Amb18815190 [0,2,0,0,0,0|0,0,1]=3 1675 B15R2.28 O=C1CCNC(C1)c2ccc(cc2)Br Amb17263740 [0,2,0,0,0,0|1,0,1]=4 1676 B15R2.28 O=C1CCNC(C1)c2ccc(cc2)C Amb17234678 [0,2,0,0,0,0|1,0,1]=4 1677 B15R2.28 O=C1CCNC(C1)c2ccc(cc2)Cl Amb17240445 [0,2,0,0,0,0|1,0,1]=4 1678 B15R2.28 O=C1CCNC(C1)c2ccc(cc2)F Amb17235574 [0,2,0,0,0,0|1,0,1]=4 1679 B15R2.28 O=C1CNC(CN1)c2cccc(Br)c2 Amb24685332 [0,2,0,0,0,0|2,0,0]=4 1680 B15R2.28 O=C1C[C@H](NC=C1)c2ccc(F)cc2 Amb24654505 [0,2,0,0,0,0|1,0,1]=4 1681 B15R2.28 Oc1[n]cc(c[n]1)C2CC(=O)CCN2 Amb18816452 [0,2,0,0,0,0|1,0,1]=4 1682 B15R2.28 Oc1ccc(c[n]1)C2CC(=O)CCC2 Amb25842455 [0,2,0,0,0,0|1,0,1]=4 1683 B15R2.28 Oc1ccc(cc1)C2CC(=O)CCN2 Amb18818529 [0,2,0,0,0,0|1,0,1]=4 1684 B15R2.30 O=C1CC(CCC1)c2c[n]cc(Br)c2 Amb24716978 [0,2,0,0,0,0|1,0,1]=4 1685 B15R2.30 O=C1CC(CCC1)c2c[n]cc(F)c2 Amb25808326 [0,2,0,0,0,0|1,0,1]=4 1686 B15R2.30 O=C1CC(NC=C1)c2cccc(Cl)c2 Amb25292384 [0,2,0,0,0,0|1,0,1]=4 1687 B15R2.30 O=C1CC(NC=C1)c2cccc(F)c2 Amb25139506 [0,2,0,0,0,0|1,0,1]=4 1688 B15R2.30 O=C1CC(NCC1)c2cccc(F)c2 Amb18816278 [0,2,0,0,0,0|1,0,1]=4 1689 B15R2.30 O=C1CCNC(C1)c2cccc(c2)Br Amb17263738 [0,2,0,0,0,0|1,0,1]=4 1690 B15R2.30 O=C1CCNC(C1)c2cccc(c2)C Amb17234676 [0,2,0,0,0,0|1,0,1]=4 1691 B15R2.30 O=C1CCNC(C1)c2cccc(c2)Cl Amb17240443 [0,2,0,0,0,0|1,0,1]=4 1692 B15R2.30 O=C1C[C@H](NC=C1)c2cccc(F)c2 Amb25302415 [0,2,0,0,0,0|1,0,1]=4 1693 B15R2.32 CC1C(=O)CCNC1c2ccccc2 Amb1778613 [0,2,0,0,0,0|1,0,1]=4 1694 B15R2.32 CC1C(NC=CC1=O)c2ccccc2 Amb24627189 [0,2,0,0,0,0|1,0,1]=4 1695 B15R2.32 CC1C=CCC(C1N)c2ccccc2 Amb24400565 [0,2,0,0,0,0|2,0,0]=4 1696 B15R2.32 CC1CNCC(c2c[n]ccc2)N1C Amb25737824 [0,2,0,0,0,0|1,0,1]=4 1697 B15R2.32 CN1C(N)CCCC1c2ccc[n]c2 Amb25286115 [0,2,0,0,0,0|0,0,2]=4 1698 B15R2.32 C[C@@H]1CNCC(c2c[n]ccc2)N1C Amb18817990 [0,2,0,0,0,0|1,0,1]=4 1699 B15R2.32 C[C@H]1[C@@H](NC=CC1=O)c2ccccc2 Amb24686334 [0,2,0,0,0,0|1,0,1]=4 1700 B15R2.32 Cc1c(Br)c[n]cc1C2COCCN2 Amb24637938 [0,2,0,0,0,0|1,0,1]=4 1701 B15R2.32 Cc1c(Br)c[n]cc1[C@H]2COCCN2 Amb24695384 [0,2,0,0,0,0|1,0,1]=4 1702 B15R2.32 Nc1c(I)c[n]cc1C2CNCCN2 Amb25684010 [0,2,0,0,0,0|1,0,1]=4 1703 B15R2.32 Nc1c(I)c[n]cc1C2COCCN2 Amb24667770 [0,2,0,0,0,0|1,0,1]=4 1704 B15R2.32 Nc1c(I)c[n]cc1[C@@H]2CCCCN2 Amb25167992 [0,2,0,0,0,0|0,0,2]=4 1705 B15R2.32 Nc1c(I)c[n]cc1[C@H]2COCCN2 Amb24598330 [0,2,0,0,0,0|1,0,1]=4 1706 B15R2.32 Nc1c[n]cc([C@@H]2CCCCN2)c1O Amb25716349 [0,2,0,0,0,0|0,0,2]=4 1707 B15R2.32 Nc1c[n]cc([C@@H]2COCCN2)c1O Amb25724387 [0,2,0,0,0,0|1,0,1]=4 1708 B15R2.32 Oc1c(Br)c[n]cc1C2CCCCN2 Amb25047380 [0,2,0,0,0,0|0,0,2]=4 1709 B15R2.32 Oc1c(Br)c[n]cc1C2COCCN2 Amb25118713 [0,2,0,0,0,0|1,0,1]=4 1710 B15R2.32 Oc1c(Br)c[n]cc1[C@H]2CCCCN2 Amb24396346 [0,2,0,0,0,0|0,0,2]=4 1711 B15R2.32 Oc1c(Br)c[n]cc1[C@H]2COCCN2 Amb25123783 [0,2,0,0,0,0|1,0,1]=4 1712 B15R2.33 Cc1cc(C2CCCCN2)c(F)[n]c1 Amb25780129 [0,2,0,0,0,0|0,0,2]=4 1713 B15R2.33 Cc1cc(C2CCCCN2)c(O)[n]c1 Amb24374761 [0,2,0,0,0,0|0,0,2]=4 1714 B15R2.33 Cc1cc(C2CNCCN2)c(F)[n]c1 Amb25737862 [0,2,0,0,0,0|1,0,1]=4 1715 B15R2.33 Cc1cc(C2CNCCN2)c(N)[n]c1 Amb24373958 [0,2,0,0,0,0|1,0,1]=4 1716 B15R2.33 Cc1cc(C2COCCN2)c(F)[n]c1 Amb25276341 [0,2,0,0,0,0|1,0,1]=4 1717 B15R2.33 Cc1cc([C@@H]2CNCCN2)c(F)[n]c1 Amb24335817 [0,2,0,0,0,0|1,0,1]=4 1718 B15R2.33 Cc1cc([C@@H]2COCCN2)c(Br)[n]c1 Amb24695311 [0,2,0,0,0,0|1,0,1]=4 1719 B15R2.33 Cc1cc([C@@H]2COCCN2)c(N)[n]c1 Amb24670198 [0,2,0,0,0,0|1,0,1]=4 1720 B15R2.33 Cc1cc([C@H]2CCCCN2)c(Cl)[n]c1 Amb24594341 [0,2,0,0,0,0|0,0,2]=4 1721 B15R2.33 Cc1cc([C@H]2CCCCN2)c(N)[n]c1 Amb24348153 [0,2,0,0,0,0|0,0,2]=4 1722 B15R2.33 Cc1cc([C@H]2CCCCN2)c(O)[n]c1 Amb24526022 [0,2,0,0,0,0|0,0,2]=4 1723 B15R2.33 Cc1cc([C@H]2CNCCN2)c(Br)[n]c1 Amb25721603 [0,2,0,0,0,0|1,0,1]=4 1724 B15R2.33 Cc1cc([C@H]2CNCCN2)c(F)[n]c1 Amb24551031 [0,2,0,0,0,0|1,0,1]=4 1725 B15R2.33 Cc1cc([C@H]2COCCN2)c(F)[n]c1 Amb24426733 [0,2,0,0,0,0|1,0,1]=4 1726 B15R2.33 Cc1cc([C@H]2COCCN2)c(N)[n]c1 Amb24428698 [0,2,0,0,0,0|1,0,1]=4 1727 B15R2.33 Clc1[n]cc(Br)cc1C2CNCCN2 Amb25305801 [0,2,0,0,0,0|1,0,1]=4 1728 B15R2.33 Clc1[n]cc(Br)cc1C2COCCN2 Amb25290380 [0,2,0,0,0,0|1,0,1]=4 1729 B15R2.33 Clc1[n]cc(Br)cc1[C@@H]2CNCCN2 Amb25277805 [0,2,0,0,0,0|1,0,1]=4 1730 B15R2.33 Clc1[n]cc(Br)cc1[C@H]2CCCCN2 Amb25223729 [0,2,0,0,0,0|0,0,2]=4 1731 B15R2.33 Clc1[n]cc(Br)cc1[C@H]2CNCCN2 Amb25068953 [0,2,0,0,0,0|1,0,1]=4 1732 B15R2.33 Clc1[n]cc(Br)cc1[C@H]2COCCN2 Amb24382679 [0,2,0,0,0,0|1,0,1]=4 1733 B15R2.33 Clc1c[n]c(Cl)c(c1)C2COCCN2 Amb24543777 [0,2,0,0,0,0|1,0,1]=4 1734 B15R2.33 Clc1c[n]c(Cl)c(c1)[C@H]2CCCCN2 Amb24695180 [0,2,0,0,0,0|0,0,2]=4 1735 B15R2.33 Clc1c[n]c(Cl)c(c1)[C@H]2COCCN2 Amb25167962 [0,2,0,0,0,0|1,0,1]=4 1736 B15R2.33 Clc1cc(C2CCCCN2)c(Br)[n]c1 Amb25756665 [0,2,0,0,0,0|0,0,2]=4 1737 B15R2.33 Clc1cc([C@@H]2COCCN2)c(Br)[n]c1 Amb24678931 [0,2,0,0,0,0|1,0,1]=4 1738 B15R2.33 Clc1cc([C@H]2CCCCN2)c(Br)[n]c1 Amb24696480 [0,2,0,0,0,0|0,0,2]=4 1739 B15R2.33 Clc1cc([C@H]2COCCN2)c(Br)[n]c1 Amb24470549 [0,2,0,0,0,0|1,0,1]=4 1740 B15R2.33 Fc1[n]cc(Br)cc1[C@@H]2CCCCN2 Amb24410943 [0,2,0,0,0,0|0,0,2]=4 1741 B15R2.33 Fc1[n]cc(Br)cc1[C@H]2COCCN2 Amb25165207 [0,2,0,0,0,0|1,0,1]=4 1742 B15R2.33 Fc1[n]cc(Cl)cc1C2CNCCN2 Amb25665292 [0,2,0,0,0,0|1,0,1]=4 1743 B15R2.33 Fc1[n]cc(Cl)cc1[C@@H]2CNCCN2 Amb25771712 [0,2,0,0,0,0|1,0,1]=4 1744 B15R2.33 Fc1cc(C2CCCCN2)c(Cl)[n]c1 Amb25181873 [0,2,0,0,0,0|0,0,2]=4 1745 B15R2.33 Fc1cc(C2COCCN2)c(Cl)[n]c1 Amb24451648 [0,2,0,0,0,0|1,0,1]=4 1746 B15R2.33 Fc1cc([C@H]2CNCCN2)c(Cl)[n]c1 Amb24695269 [0,2,0,0,0,0|1,0,1]=4 1747 B15R2.33 Nc1[n]cc(Br)cc1C2COCCN2 Amb24451194 [0,2,0,0,0,0|1,0,1]=4 1748 B15R2.33 Nc1[n]cc(Br)cc1[C@@H]2COCCN2 Amb25743499 [0,2,0,0,0,0|1,0,1]=4 1749 B15R2.33 Nc1[n]cc(Br)cc1[C@H]2CCCCN2 Amb25828070 [0,2,0,0,0,0|0,0,2]=4 1750 B15R2.33 Nc1[n]cc(Cl)cc1C2CCCCN2 Amb25377137 [0,2,0,0,0,0|0,0,2]=4 1751 B15R2.33 Nc1[n]cc(Cl)cc1C2COCCN2 Amb25239297 [0,2,0,0,0,0|1,0,1]=4 1752 B15R2.33 Nc1[n]cc(I)cc1C2CCCCN2 Amb24641385 [0,2,0,0,0,0|0,0,2]=4 1753 B15R2.33 Nc1[n]cc(I)cc1C2CNCCN2 Amb25768779 [0,2,0,0,0,0|1,0,1]=4 1754 B15R2.33 Nc1[n]cc(I)cc1C2COCCN2 Amb25808926 [0,2,0,0,0,0|1,0,1]=4 1755 B15R2.33 Nc1[n]cc(I)cc1[C@@H]2COCCN2 Amb24366810 [0,2,0,0,0,0|1,0,1]=4 1756 B15R2.33 Nc1[n]cc(I)cc1[C@H]2CCCCN2 Amb25301446 [0,2,0,0,0,0|0,0,2]=4 1757 B15R2.33 Nc1[n]cc(I)cc1[C@H]2COCCN2 Amb25798203 [0,2,0,0,0,0|1,0,1]=4 1758 B15R2.33 Nc1cc(C2CCCCN2)c(Cl)[n]c1 Amb25305697 [0,2,0,0,0,0|0,0,2]=4 1759 B15R2.33 Nc1cc(C2CNCCN2)c(Cl)[n]c1 Amb25747547 [0,2,0,0,0,0|1,0,1]=4 1760 B15R2.33 Nc1cc([C@@H]2COCCN2)c(Cl)[n]c1 Amb25193269 [0,2,0,0,0,0|1,0,1]=4 1761 B15R2.33 Nc1cc([C@H]2CCCCN2)c(Cl)[n]c1 Amb25830641 [0,2,0,0,0,0|0,0,2]=4 1762 B15R2.33 Nc1cc([C@H]2CNCCN2)c(Cl)[n]c1 Amb25290093 [0,2,0,0,0,0|1,0,1]=4 1763 B15R2.33 OC1C=CC(O)CC1c2ccccc2 Amb24414884 [0,2,0,0,0,0|2,0,0]=4 1764 B15R2.33 Oc1[n]cc(Br)cc1C2CNCCN2 Amb24713428 [0,2,0,0,0,0|1,0,1]=4 1765 B15R2.33 Oc1[n]cc(Br)cc1C2COCCN2 Amb24697515 [0,2,0,0,0,0|1,0,1]=4 1766 B15R2.33 Oc1[n]cc(Br)cc1[C@@H]2CCCCN2 Amb25804609 [0,2,0,0,0,0|0,0,2]=4 1767 B15R2.33 Oc1[n]cc(Br)cc1[C@@H]2CNCCN2 Amb24424464 [0,2,0,0,0,0|1,0,1]=4 1768 B15R2.33 Oc1[n]cc(Br)cc1[C@@H]2COCCN2 Amb24594395 [0,2,0,0,0,0|1,0,1]=4 1769 B15R2.33 Oc1[n]cc(Br)cc1[C@H]2CNCCN2 Amb25780805 [0,2,0,0,0,0|1,0,1]=4 1770 B15R2.33 Oc1[n]cc(Cl)cc1C2COCCN2 Amb24697582 [0,2,0,0,0,0|1,0,1]=4 1771 B15R2.33 Oc1[n]cc(Cl)cc1[C@@H]2CNCCN2 Amb25112735 [0,2,0,0,0,0|1,0,1]=4 1772 B15R2.33 Oc1[n]cc(Cl)cc1[C@H]2CCCCN2 Amb25771775 [0,2,0,0,0,0|0,0,2]=4 1773 B15R2.33 Oc1[n]cc(Cl)cc1[C@H]2COCCN2 Amb24759038 [0,2,0,0,0,0|1,0,1]=4 1774 B15R2.94 Brc1cc(c[n]c1Br)[C@@H]2COCCN2 Amb25068974 [0,2,0,0,0,0|1,0,1]=4 1775 B15R2.94 Brc1cc(c[n]c1Br)[C@H]2CCCCN2 Amb25040073 [0,2,0,0,0,0|0,0,2]=4 1776 B15R2.94 Brc1cc(c[n]c1Br)[C@H]2COCCN2 Amb24695347 [0,2,0,0,0,0|1,0,1]=4 1777 B15R2.94 CC1CNC(CC1=O)c2ccccc2 Amb18650261 [0,2,0,0,0,0|1,0,1]=4 1778 B15R2.94 CC1NC(CNC1=O)c2c[n]cc[n]2 Amb25765863 [0,2,0,0,0,0|2,0,0]=4 1779 B15R2.94 CC=1CNC(CC1C)c2cccc[n]2 Amb25275080 [0,2,0,0,0,0|2,0,0]=4 1780 B15R2.94 CC=1COC(CC1C)c2ccccc2 Amb24094492 [0,2,0,0,0,0|2,0,0]=4 1781 B15R2.94 CN1CC(NCC1=O)c2ccc[n]c2 Amb24507187 [0,2,0,0,0,0|1,0,0]=3 1782 B15R2.94 CN1CC(NCC1=O)c2ccccc2 Amb24397048 [0,2,0,0,0,0|2,0,0]=4 1783 B15R2.94 C[C@@H]1NC(CNC1=O)c2c[n]c[n]c2 Amb18817298 [0,2,0,0,0,0|2,0,0]=4 1784 B15R2.94 C[C@@H]1NC(CNC1=O)c2c[n]cc[n]2 Amb18817296 [0,2,0,0,0,0|2,0,0]=4 1785 B15R2.94 C[C@@H]1N[C@@H](CSC1=O)c2ccccc2 Amb24559185 [0,2,0,0,0,0|2,0,0]=4 1786 B15R2.94 Cc1cc(c[n]c1Br)[C@@H]2CCCCN2 Amb25075177 [0,2,0,0,0,0|0,0,2]=4 1787 B15R2.94 Cc1cc(c[n]c1Br)[C@@H]2COCCN2 Amb25055121 [0,2,0,0,0,0|1,0,1]=4 1788 B15R2.94 Cc1cc(c[n]c1C)C2CCCCN2 Amb25141772 [0,2,0,0,0,0|0,0,2]=4 1789 B15R2.94 Cc1cc(c[n]c1Cl)C2CCCCN2 Amb23508432 [0,2,0,0,0,0|0,0,2]=4 1790 B15R2.94 Cc1cc(c[n]c1Cl)C2COCCN2 Amb24336051 [0,2,0,0,0,0|1,0,1]=4 1791 B15R2.94 Cc1cc(c[n]c1Cl)[C@@H]2CCCCN2 Amb24453104 [0,2,0,0,0,0|0,0,2]=4 1792 B15R2.94 Cc1cc(c[n]c1Cl)[C@@H]2COCCN2 Amb24451057 [0,2,0,0,0,0|1,0,1]=4 1793 B15R2.94 Cc1cc(c[n]c1F)C2CNCCN2 Amb24595476 [0,2,0,0,0,0|1,0,1]=4 1794 B15R2.94 Cc1cc(c[n]c1F)[C@@H]2CCCCN2 Amb24763666 [0,2,0,0,0,0|0,0,2]=4 1795 B15R2.94 Cc1cc(c[n]c1F)[C@@H]2CNCCN2 Amb24335815 [0,2,0,0,0,0|1,0,1]=4 1796 B15R2.94 Cc1cc(c[n]c1N)C2CCCCN2 Amb23508803 [0,2,0,0,0,0|0,0,2]=4 1797 B15R2.94 Cc1cc(c[n]c1N)C2CNCCN2 Amb25311080 [0,2,0,0,0,0|1,0,1]=4 1798 B15R2.94 Cc1cc(c[n]c1N)C2COCCN2 Amb25275267 [0,2,0,0,0,0|1,0,1]=4 1799 B15R2.94 Cc1cc(c[n]c1N)[C@@H]2CNCCN2 Amb24446975 [0,2,0,0,0,0|1,0,1]=4 1800 B15R2.94 Cc1cc(c[n]c1N)[C@@H]2COCCN2 Amb25789457 [0,2,0,0,0,0|1,0,1]=4 1801 B15R2.94 Cc1cc(c[n]c1O)[C@@H]2CCCCN2 Amb24377153 [0,2,0,0,0,0|0,0,2]=4 1802 B15R2.94 Cc1cc(c[n]c1O)[C@H]2CNCCN2 Amb24680883 [0,2,0,0,0,0|1,0,1]=4 1803 B15R2.94 Cc1cc(c[n]c1O)[C@H]2COCCN2 Amb24386007 [0,2,0,0,0,0|1,0,1]=4 1804 B15R2.94 Cc1cc(c[n]c1S)C2CCCCN2 Amb23508693 [0,2,0,0,0,0|0,0,2]=4 1805 B15R2.94 Clc1[n]cc(cc1Br)C2CCCCN2 Amb25096393 [0,2,0,0,0,0|0,0,2]=4 1806 B15R2.94 Clc1[n]cc(cc1Br)C2CNCCN2 Amb25277405 [0,2,0,0,0,0|1,0,1]=4 1807 B15R2.94 Clc1[n]cc(cc1Br)C2COCCN2 Amb25131199 [0,2,0,0,0,0|1,0,1]=4 1808 B15R2.94 Clc1[n]cc(cc1Br)[C@H]2COCCN2 Amb24461694 [0,2,0,0,0,0|1,0,1]=4 1809 B15R2.94 Clc1cc(c[n]c1Cl)C2CCCCN2 Amb25789665 [0,2,0,0,0,0|0,0,2]=4 1810 B15R2.94 Clc1cc(c[n]c1Cl)C2COCCN2 Amb25105035 [0,2,0,0,0,0|1,0,1]=4 1811 B15R2.94 Clc1cc(c[n]c1Cl)[C@@H]2COCCN2 Amb25301295 [0,2,0,0,0,0|1,0,1]=4 1812 B15R2.94 Clc1cc(c[n]c1Cl)[C@H]2CCCCN2 Amb25377148 [0,2,0,0,0,0|0,0,2]=4 1813 B15R2.94 Clc1cc(c[n]c1Cl)[C@H]2CNCCN2 Amb25141478 [0,2,0,0,0,0|1,0,1]=4 1814 B15R2.94 Fc1[n]cc(cc1Cl)C2CCCCN2 Amb24682620 [0,2,0,0,0,0|0,0,2]=4 1815 B15R2.94 Fc1[n]cc(cc1Cl)C2COCCN2 Amb25691589 [0,2,0,0,0,0|1,0,1]=4 1816 B15R2.94 Fc1[n]cc(cc1Cl)[C@H]2COCCN2 Amb24382620 [0,2,0,0,0,0|1,0,1]=4 1817 B15R2.94 Fc1cc(c[n]c1Cl)C2CCCCN2 Amb24673645 [0,2,0,0,0,0|0,0,2]=4 1818 B15R2.94 Fc1cc(c[n]c1Cl)[C@@H]2CCCCN2 Amb25084723 [0,2,0,0,0,0|0,0,2]=4 1819 B15R2.94 Fc1cc(c[n]c1Cl)[C@H]2CNCCN2 Amb25826687 [0,2,0,0,0,0|1,0,1]=4 1820 B15R2.94 Fc1cc(c[n]c1Cl)[C@H]2COCCN2 Amb25123459 [0,2,0,0,0,0|1,0,1]=4 1821 B15R2.94 Fc1cc(c[n]c1F)[C@@H]2CCCCN2 Amb25116632 [0,2,0,0,0,0|0,0,2]=4 1822 B15R2.94 Fc1cc(c[n]c1F)[C@@H]2COCCN2 Amb24336094 [0,2,0,0,0,0|1,0,1]=4 1823 B15R2.94 NC1CC(CNC1=O)c2c[n]ccc2 Amb24721559 [0,2,0,0,0,0|2,0,0]=4 1824 B15R2.94 Nc1[n]cc(cc1Br)C2COCCN2 Amb25033150 [0,2,0,0,0,0|1,0,1]=4 1825 B15R2.94 Nc1[n]cc(cc1Br)[C@H]2CCCCN2 Amb25841114 [0,2,0,0,0,0|0,0,2]=4 1826 B15R2.94 Nc1[n]cc(cc1I)C2CCCCN2 Amb24379075 [0,2,0,0,0,0|0,0,2]=4 1827 B15R2.94 Nc1[n]cc(cc1I)C2COCCN2 Amb25055264 [0,2,0,0,0,0|1,0,1]=4 1828 B15R2.94 Nc1[n]cc(cc1I)[C@@H]2COCCN2 Amb24728233 [0,2,0,0,0,0|1,0,1]=4 1829 B15R2.94 Nc1cc(c[n]c1Cl)C2CNCCN2 Amb25844530 [0,2,0,0,0,0|1,0,1]=4 1830 B15R2.94 Nc1cc(c[n]c1Cl)C2COCCN2 Amb25062445 [0,2,0,0,0,0|1,0,1]=4 1831 B15R2.94 Nc1cc(c[n]c1Cl)[C@@H]2CNCCN2 Amb24375471 [0,2,0,0,0,0|1,0,1]=4 1832 B15R2.94 Nc1cc(c[n]c1Cl)[C@H]2CCCCN2 Amb24336234 [0,2,0,0,0,0|0,0,2]=4 1833 B15R2.94 Nc1cc(c[n]c1Cl)[C@H]2COCCN2 Amb25805336 [0,2,0,0,0,0|1,0,1]=4 1834 B15R2.94 Nc1cc(c[n]c1F)C2CNCCN2 Amb25072589 [0,2,0,0,0,0|1,0,1]=4 1835 B15R2.94 Nc1cc(c[n]c1F)C2COCCN2 Amb25104676 [0,2,0,0,0,0|1,0,1]=4 1836 B15R2.94 Nc1cc(c[n]c1F)[C@@H]2CNCCN2 Amb25181203 [0,2,0,0,0,0|1,0,1]=4 1837 B15R2.94 Nc1cc(c[n]c1F)[C@H]2CCCCN2 Amb24378075 [0,2,0,0,0,0|0,0,2]=4 1838 B15R2.94 Nc1cc(c[n]c1F)[C@H]2CNCCN2 Amb24746699 [0,2,0,0,0,0|1,0,1]=4 1839 B15R2.94 Nc1cc(c[n]c1F)[C@H]2COCCN2 Amb24446589 [0,2,0,0,0,0|1,0,1]=4 1840 B15R2.94 Nc1cc(c[n]c1N)C2CCCCN2 Amb24351311 [0,2,0,0,0,0|0,0,2]=4 1841 B15R2.94 Nc1cc(c[n]c1N)C2COCCN2 Amb24377092 [0,2,0,0,0,0|1,0,1]=4 1842 B15R2.94 Nc1cc(c[n]c1N)[C@@H]2CCCCN2 Amb25677849 [0,2,0,0,0,0|0,0,2]=4 1843 B15R2.94 Nc1cc(c[n]c1N)[C@@H]2COCCN2 Amb25073223 [0,2,0,0,0,0|1,0,1]=4 1844 B15R2.94 Oc1[n]cc(cc1Br)C2CCCCN2 Amb25117485 [0,2,0,0,0,0|0,0,2]=4 1845 B15R2.94 Oc1[n]cc(cc1Br)[C@H]2CNCCN2 Amb24336042 [0,2,0,0,0,0|1,0,1]=4 1846 B15R2.94 Oc1[n]cc(cc1Cl)C2CNCCN2 Amb25067404 [0,2,0,0,0,0|1,0,1]=4 1847 B15R2.94 Oc1[n]cc(cc1Cl)[C@@H]2CCCCN2 Amb24444243 [0,2,0,0,0,0|0,0,2]=4 1848 B15R2.94 Oc1[n]cc(cc1Cl)[C@@H]2CNCCN2 Amb25732487 [0,2,0,0,0,0|1,0,1]=4 1849 B15R2.94 Oc1[n]cc(cc1Cl)[C@H]2CCCCN2 Amb25123383 [0,2,0,0,0,0|0,0,2]=4 1850 B15R2.94 Oc1[n]cc(cc1Cl)[C@H]2CNCCN2 Amb24453403 [0,2,0,0,0,0|1,0,1]=4 1851 B15R2.94 Oc1[n]cc(cc1Cl)[C@H]2COCCN2 Amb25731971 [0,2,0,0,0,0|1,0,1]=4 1852 B15R2.94 Oc1cc(c[n]c1O)[C@H]2CCCCN2 Amb24592600 [0,2,0,0,0,0|0,0,2]=4 1853 B15R2.332 CC=1CC(OCC1)c2ccccc2O Amb18650507 [0,2,0,0,0,0|2,0,0]=4 1854 B15R2.332 CC=1CN(CCC1)c2c[n]ccc2N Amb24626856 [0,2,0,0,0,0|2,0,0]=4 1855 B15R2.332 CC=1CN(CCC1)c2ccc[n]c2N Amb24522750 [0,2,0,0,0,0|2,0,0]=4 1856 B15R2.332 CN1CCNC(C1)c2ccc[n]c2F Amb25083284 [0,2,0,0,0,0|1,0,1]=4 1857 B15R2.332 Cc1[n]c[n]cc1C2CC(=O)CCN2 Amb18818394 [0,2,0,0,0,0|1,0,1]=4 1858 B15R2.332 Cc1[n]cccc1C2CC(=O)CCC2 Amb25847938 [0,2,0,0,0,0|1,0,1]=4 1859 B15R2.332 Cc1c[n]cc(c1)C2CCCCN2C Amb23444746 [0,2,0,0,0,0|0,0,2]=4 1860 B15R2.332 Cc1cc(c[n]c1)C2NCCCC2O Amb18817038 [0,2,0,0,0,0|0,0,2]=4 1861 B15R2.332 Cc1ccccc1C2CC(=O)C=CN2 Amb25120435 [0,2,0,0,0,0|1,0,1]=4 1862 B15R2.332 Cc1ccccc1[C@@H]2CC(=O)C=CN2 Amb25289022 [0,2,0,0,0,0|1,0,1]=4 1863 B15R2.332 Nc1cc[n]cc1C2CC(=O)CCC2 Amb24425281 [0,2,0,0,0,0|1,0,1]=4 1864 B15R2.332 Nc1cc[n]cc1N2CCC=C(F)C2 Amb24522809 [0,2,0,0,0,0|2,0,0]=4 1865 B15R2.332 O=C1CC(CCC1)c2c[n]ccc2Cl Amb25752526 [0,2,0,0,0,0|1,0,1]=4 1866 B15R2.332 O=C1CC(CCC1)c2ccc[n]c2Cl Amb25710461 [0,2,0,0,0,0|1,0,1]=4 1867 B15R2.332 O=C1CC(CCC1)c2ccc[n]c2F Amb25715498 [0,2,0,0,0,0|1,0,1]=4 1868 B15R2.332 O=C1CC(NCC1)c2c[n]ccc2Cl Amb18773260 [0,2,0,0,0,0|0,0,1]=3 1869 B15R2.332 O=C1CCNC(C1)c2ccccc2C Amb17234674 [0,2,0,0,0,0|1,0,1]=4 1870 B15R2.332 O=C1CCNC(C1)c2ccccc2Cl Amb17240441 [0,2,0,0,0,0|1,0,1]=4 1871 B15R2.332 O=C1CCNC(C1)c2ccccc2F Amb17235572 [0,2,0,0,0,0|1,0,1]=4 1872 B15R2.332 Oc1[n]cccc1C2CC(=O)CCC2 Amb25126739 [0,2,0,0,0,0|1,0,1]=4 1873 B15R2.586 CC1(C)C=CCC(N1)c2ccccc2 Amb25696490 [0,2,0,0,0,0|1,0,0]=3 1874 B15R2.586 CC1(C)CNCC(N1)c2c[n]ccc2 Amb18817994 [0,2,0,0,0,0|1,0,1]=4 1875 B15R2.586 CC1(C)COCC(N1)c2c[n]ccc2 Amb18565129 [0,2,0,0,0,0|1,0,1]=4 1876 B15R2.1113 CC1(CC(=O)CCN1)c2ccc[n]c2 Amb25184028 [0,2,0,0,0,0|0,0,1]=3 1877 B15R2.1113 CC1(CC(=O)CCN1)c2ccccc2 Amb18063211 [0,2,0,0,0,0|1,0,1]=4 1878 B15R2.21 CCN1CCCCC1c2c[n]ccc2 Amb23444568 [0,2,0,0,0,0|0,0,2]=4 1879 B15R2.21 CCN1CCNCC1c2c[n]ccc2 Amb18565008 [0,2,0,0,0,0|1,0,1]=4 1880 B15R2.21 CCc1cc[n]cc1C2CCCCN2 Amb24715771 [0,2,0,0,0,0|0,0,2]=4 1881 B15R2.21 CCc1cc[n]cc1[C@H]2CCCCN2 Amb25378781 [0,2,0,0,0,0|0,0,2]=4 1882 B15R2.21 CCc1cc[n]cc1[C@H]2COCCN2 Amb24761351 [0,2,0,0,0,0|1,0,1]=4 1883 B15R2.21 CNc1[n]cccc1C2CCCCN2 Amb23445391 [0,2,0,0,0,0|0,0,2]=4 1884 B15R2.21 CNc1[n]cccc1C2CNCCN2 Amb25671948 [0,2,0,0,0,0|1,0,1]=4 1885 B15R2.21 CNc1[n]cccc1C2COCCN2 Amb24336540 [0,2,0,0,0,0|1,0,1]=4 1886 B15R2.21 CNc1[n]cccc1[C@@H]2CNCCN2 Amb25129459 [0,2,0,0,0,0|1,0,1]=4 1887 B15R2.21 CNc1[n]cccc1[C@@H]2COCCN2 Amb25808076 [0,2,0,0,0,0|1,0,1]=4 1888 B15R2.21 COc1[n]cccc1C2CNCCN2 Amb25772873 [0,2,0,0,0,0|1,0,1]=4 1889 B15R2.21 COc1[n]cccc1[C@@H]2CCCCN2 Amb24604377 [0,2,0,0,0,0|0,0,2]=4 1890 B15R2.21 COc1[n]cccc1[C@@H]2COCCN2 Amb24351168 [0,2,0,0,0,0|1,0,1]=4 1891 B15R2.21 COc1[n]cccc1[C@H]2CCCCN2 Amb25749682 [0,2,0,0,0,0|0,0,2]=4 1892 B15R2.21 COc1cc[n]cc1C2CCCCN2 Amb25828583 [0,2,0,0,0,0|0,0,2]=4 1893 B15R2.21 COc1cc[n]cc1C2COCCN2 Amb24453335 [0,2,0,0,0,0|1,0,1]=4 1894 B15R2.21 COc1cc[n]cc1[C@H]2CNCCN2 Amb24364638 [0,2,0,0,0,0|1,0,1]=4 1895 B15R2.21 COc1cc[n]cc1[C@H]2COCCN2 Amb25167814 [0,2,0,0,0,0|1,0,1]=4 1896 B15R2.21 COc1ccccc1C2CC=CCN2 Amb25324504 [0,2,0,0,0,0|1,0,0]=3 1897 B15R2.21 COc1ccccc1[C@@H]2CC=CCN2 Amb25828485 [0,2,0,0,0,0|1,0,0]=3 1898 B15R2.21 CSc1[n]cccc1C2CCCCN2 Amb23507979 [0,2,0,0,0,0|0,0,2]=4 1899 B15R2.21 CSc1[n]cccc1C2CNCCN2 Amb25260870 [0,2,0,0,0,0|1,0,1]=4 1900 B15R2.21 CSc1[n]cccc1C2COCCN2 Amb25062504 [0,2,0,0,0,0|1,0,1]=4 1901 B15R2.21 CSc1[n]cccc1[C@@H]2CCCCN2 Amb25305670 [0,2,0,0,0,0|0,0,2]=4 1902 B15R2.21 CSc1[n]cccc1[C@@H]2CNCCN2 Amb24521669 [0,2,0,0,0,0|1,0,1]=4 1903 B15R2.21 CSc1[n]cccc1[C@@H]2COCCN2 Amb25778218 [0,2,0,0,0,0|1,0,1]=4 1904 B15R2.21 CSc1[n]cccc1[C@H]2CCCCN2 Amb25055127 [0,2,0,0,0,0|0,0,2]=4 1905 B15R2.21 N#Cc1[n]cccc1C2CCCCN2 Amb25181515 [0,2,0,0,0,0|0,0,2]=4 1906 B15R2.21 N#Cc1[n]cccc1C2CNCCN2 Amb24419766 [0,2,0,0,0,0|1,0,1]=4 1907 B15R2.21 N#Cc1[n]cccc1C2COCCN2 Amb25772995 [0,2,0,0,0,0|1,0,1]=4 1908 B15R2.21 N#Cc1[n]cccc1N2CC=CCC2 Amb24507068 [0,2,0,0,0,0|2,0,0]=4 1909 B15R2.21 N#Cc1[n]cccc1[C@H]2CCCCN2 Amb24585148 [0,2,0,0,0,0|0,0,2]=4 1910 B15R2.21 N#Cc1[n]cccc1[C@H]2CNCCN2 Amb25181202 [0,2,0,0,0,0|1,0,1]=4 1911 B15R2.21 N#Cc1[n]cccc1[C@H]2COCCN2 Amb25090348 [0,2,0,0,0,0|1,0,1]=4 1912 B15R2.21 N#Cc1cc[n]cc1C2CCCCN2 Amb24677860 [0,2,0,0,0,0|0,0,2]=4 1913 B15R2.21 NC[C@@H]1CCCN[C@H]1c2ccc[n]c2 Amb18817995 [0,2,0,0,0,0|0,0,2]=4 1914 B15R2.21 NC[C@H]1CCCN[C@@H]1c2ccc[n]c2 Amb25277388 [0,2,0,0,0,0|0,0,2]=4 1915 B15R2.21 NCc1cc[n]cc1N2CCC=CC2 Amb25118185 [0,2,0,0,0,0|2,0,0]=4 1916 B15R2.21 O=CC1CC=CCC1c2ccccc2 Amb18649408 [0,2,0,0,0,0|2,0,0]=4 1917 B15R2.21 O=C[C@@H]1CC=CC[C@H]1c2ccccc2 Amb24566217 [0,2,0,0,0,0|2,0,0]=4 1918 B15R2.21 O=NN1CC=CCC1c2cccnc2 Amb17618562 [0,2,0,0,0,0|0,0,0]=2 1919 B15R2.21 O=NN1CCCC[C@H]1c2c[n]ccc2 Amb24526110 [0,2,0,0,0,0|0,0,2]=4 1920 B15R2.21 OCC1CCCNC1c2ccc[n]c2 Amb25381292 [0,2,0,0,0,0|0,0,2]=4 1921 B15R2.21 OCc1[n]cccc1C2COCCN2 Amb24366742 [0,2,0,0,0,0|1,0,1]=4 1922 B15R2.21 OCc1[n]cccc1[C@@H]2COCCN2 Amb25167916 [0,2,0,0,0,0|1,0,1]=4 1923 B15R2.308 CC=1CCN(CC1)c2c[n]ccc2N Amb25299545 [0,2,0,0,0,0|2,0,0]=4 1924 B15R2.308 CC=1CCN(CC1)c2ccc[n]c2N Amb24602049 [0,2,0,0,0,0|2,0,0]=4 1925 B15R2.308 CN1CCCCC1c2ccc(Br)[n]c2 Amb23444863 [0,2,0,0,0,0|0,0,2]=4 1926 B15R2.308 CN1CCCCC1c2ccc(Cl)[n]c2 Amb19373873 [0,2,0,0,0,0|0,0,2]=4 1927 B15R2.308 CN1CCCCC1c2ccc(S)[n]c2 Amb23508020 [0,2,0,0,0,0|0,0,2]=4 1928 B15R2.308 CN1CCCCC1c2ccc(nc2)N Amb17595004 [0,2,0,0,0,0|0,0,2]=4 1929 B15R2.308 CN1CCCC[C@H]1c2ccc(N)[n]c2 Amb25762155 [0,2,0,0,0,0|0,0,2]=4 1930 B15R2.308 CN1CCNCC1c2ccc(Br)[n]c2 Amb25844540 [0,2,0,0,0,0|1,0,1]=4 1931 B15R2.308 CN1CCNCC1c2ccc(N)[n]c2 Amb18816954 [0,2,0,0,0,0|1,0,1]=4 1932 B15R2.308 Cc1ccc(c[n]1)C2CCCCN2C Amb23444694 [0,2,0,0,0,0|0,0,2]=4 1933 B15R2.308 Cc1ccccc1C2CNC(=O)CN2 Amb25028930 [0,2,0,0,0,0|2,0,0]=4 1934 B15R2.308 NC1CC=CCC1c2ccc(Cl)[n]c2 Amb25709678 [0,2,0,0,0,0|1,0,0]=3 1935 B15R2.308 O=C1CCC(CC1)c2ccc[n]c2F Amb24713537 [0,2,0,0,0,0|1,0,1]=4 1936 B15R2.308 Oc1cc[n]cc1C2CCC(=O)CC2 Amb24388535 [0,2,0,0,0,0|1,0,1]=4 1937 B15R2.389 Brc1ccc(C2COCCN2)c(Br)[n]1 Amb25835233 [0,2,0,0,0,0|1,0,1]=4 1938 B15R2.389 Brc1ccc([C@@H]2COCCN2)c(Br)[n]1 Amb25778150 [0,2,0,0,0,0|1,0,1]=4 1939 B15R2.389 CC=1CCC(C(Cl)C1)c2ccccc2 Amb24757642 [0,2,0,0,0,0|2,0,0]=4 1940 B15R2.389 CN1CC(=O)NCC1c2ccccc2 Amb24066170 [0,2,0,0,0,0|2,0,0]=4 1941 B15R2.389 Cc1[n]c(Cl)ccc1C2CCCCN2 Amb23508500 [0,2,0,0,0,0|0,0,2]=4 1942 B15R2.389 Cc1[n]c(F)ccc1C2CCCCN2 Amb25324209 [0,2,0,0,0,0|0,0,2]=4 1943 B15R2.389 Cc1[n]c(F)ccc1C2COCCN2 Amb25090340 [0,2,0,0,0,0|1,0,1]=4 1944 B15R2.389 Cc1[n]c(F)ccc1[C@@H]2CCCCN2 Amb25814658 [0,2,0,0,0,0|0,0,2]=4 1945 B15R2.389 Cc1[n]c(F)ccc1[C@@H]2CNCCN2 Amb25292178 [0,2,0,0,0,0|1,0,1]=4 1946 B15R2.389 Cc1[n]c(F)ccc1[C@H]2CCCCN2 Amb25814659 [0,2,0,0,0,0|0,0,2]=4 1947 B15R2.389 Cc1[n]c(F)ccc1[C@H]2CNCCN2 Amb24715873 [0,2,0,0,0,0|1,0,1]=4 1948 B15R2.389 Cc1[n]c(N)ccc1C2CCCCN2 Amb23508871 [0,2,0,0,0,0|0,0,2]=4 1949 B15R2.389 Cc1[n]c(N)ccc1C2COCCN2 Amb24392892 [0,2,0,0,0,0|1,0,1]=4 1950 B15R2.389 Cc1[n]c(N)ccc1[C@@H]2CNCCN2 Amb24436997 [0,2,0,0,0,0|1,0,1]=4 1951 B15R2.389 Cc1[n]c(N)ccc1[C@@H]2COCCN2 Amb25672473 [0,2,0,0,0,0|1,0,1]=4 1952 B15R2.389 Cc1[n]c(N)ccc1[C@H]2COCCN2 Amb24573654 [0,2,0,0,0,0|1,0,1]=4 1953 B15R2.389 Cc1[n]c(O)ccc1C2CCCCN2 Amb23508660 [0,2,0,0,0,0|0,0,2]=4 1954 B15R2.389 Cc1[n]c(O)ccc1C2COCCN2 Amb24386052 [0,2,0,0,0,0|1,0,1]=4 1955 B15R2.389 Cc1[n]c(O)ccc1[C@@H]2CCCCN2 Amb24580658 [0,2,0,0,0,0|0,0,2]=4 1956 B15R2.389 Cc1[n]c(O)ccc1[C@@H]2COCCN2 Amb24386020 [0,2,0,0,0,0|1,0,1]=4 1957 B15R2.389 Cc1[n]c(S)ccc1C2CCCCN2 Amb23508766 [0,2,0,0,0,0|0,0,2]=4 1958 B15R2.389 Cc1cc(C)[n]cc1C2CCCCN2 Amb25831698 [0,2,0,0,0,0|0,0,2]=4 1959 B15R2.389 Cc1cc(Cl)[n]cc1C2CCCCN2 Amb23508464 [0,2,0,0,0,0|0,0,2]=4 1960 B15R2.389 Cc1cc(Cl)[n]cc1C2COCCN2 Amb24375643 [0,2,0,0,0,0|1,0,1]=4 1961 B15R2.389 Cc1cc(Cl)[n]cc1[C@H]2COCCN2 Amb25669133 [0,2,0,0,0,0|1,0,1]=4 1962 B15R2.389 Cc1cc(Cl)c(c[n]1)C2CNCCN2 Amb24700383 [0,2,0,0,0,0|1,0,1]=4 1963 B15R2.389 Cc1cc(Cl)c(c[n]1)[C@H]2CNCCN2 Amb25351562 [0,2,0,0,0,0|1,0,1]=4 1964 B15R2.389 Cc1cc(F)[n]cc1C2CCCCN2 Amb25113362 [0,2,0,0,0,0|0,0,2]=4 1965 B15R2.389 Cc1cc(F)[n]cc1C2COCCN2 Amb24670182 [0,2,0,0,0,0|1,0,1]=4 1966 B15R2.389 Cc1cc(F)[n]cc1[C@@H]2CNCCN2 Amb24335818 [0,2,0,0,0,0|1,0,1]=4 1967 B15R2.389 Cc1cc(F)[n]cc1[C@@H]2COCCN2 Amb25680038 [0,2,0,0,0,0|1,0,1]=4 1968 B15R2.389 Cc1cc(F)[n]cc1[C@H]2CCCCN2 Amb25063882 [0,2,0,0,0,0|0,0,2]=4 1969 B15R2.389 Cc1cc(F)[n]cc1[C@H]2COCCN2 Amb24446591 [0,2,0,0,0,0|1,0,1]=4 1970 B15R2.389 Cc1cc(N)[n]cc1C2CCCCN2 Amb23508836 [0,2,0,0,0,0|0,0,2]=4 1971 B15R2.389 Cc1cc(N)[n]cc1C2CNCCN2 Amb25233058 [0,2,0,0,0,0|1,0,1]=4 1972 B15R2.389 Cc1cc(N)[n]cc1C2COCCN2 Amb24697598 [0,2,0,0,0,0|1,0,1]=4 1973 B15R2.389 Cc1cc(N)[n]cc1[C@@H]2COCCN2 Amb25062904 [0,2,0,0,0,0|1,0,1]=4 1974 B15R2.389 Cc1cc(N)[n]cc1[C@H]2CCCCN2 Amb25709218 [0,2,0,0,0,0|0,0,2]=4 1975 B15R2.389 Cc1cc(O)[n]cc1C2CCCCN2 Amb23508624 [0,2,0,0,0,0|0,0,2]=4 1976 B15R2.389 Cc1cc(O)c(c[n]1)C2CCCCN2 Amb24453072 [0,2,0,0,0,0|0,0,2]=4 1977 B15R2.389 Cc1cc(O)c(c[n]1)C2CNCCN2 Amb25101929 [0,2,0,0,0,0|1,0,1]=4 1978 B15R2.389 Cc1cc(O)c(c[n]1)C2COCCN2 Amb24356114 [0,2,0,0,0,0|1,0,1]=4 1979 B15R2.389 Cc1cc(O)c(c[n]1)[C@@H]2CCCCN2 Amb25349357 [0,2,0,0,0,0|0,0,2]=4 1980 B15R2.389 Cc1cc(O)c(c[n]1)[C@@H]2CNCCN2 Amb25181981 [0,2,0,0,0,0|1,0,1]=4 1981 B15R2.389 Cc1cc(O)c(c[n]1)[C@H]2CCCCN2 Amb25286803 [0,2,0,0,0,0|0,0,2]=4 1982 B15R2.389 Cc1cc(O)c(c[n]1)[C@H]2COCCN2 Amb25707924 [0,2,0,0,0,0|1,0,1]=4 1983 B15R2.389 Cc1cc(S)[n]cc1C2CCCCN2 Amb23508729 [0,2,0,0,0,0|0,0,2]=4 1984 B15R2.389 Cc1ccc(C2CCCCN2)c(C)[n]1 Amb25063781 [0,2,0,0,0,0|0,0,2]=4 1985 B15R2.389 Cc1ccc(C2CNCCN2)c(O)[n]1 Amb24694115 [0,2,0,0,0,0|1,0,1]=4 1986 B15R2.389 Cc1ccc(C2COCCN2)c(C)[n]1 Amb24715719 [0,2,0,0,0,0|1,0,1]=4 1987 B15R2.389 Cc1ccc(C2COCCN2)c(O)[n]1 Amb24743275 [0,2,0,0,0,0|1,0,1]=4 1988 B15R2.389 Cc1ccc([C@@H]2CCCCN2)c(Cl)[n]1 Amb24634910 [0,2,0,0,0,0|0,0,2]=4 1989 B15R2.389 Cc1ccc([C@@H]2CCCCN2)c(O)[n]1 Amb25167840 [0,2,0,0,0,0|0,0,2]=4 1990 B15R2.389 Cc1ccc([C@@H]2CNCCN2)c(O)[n]1 Amb25240551 [0,2,0,0,0,0|1,0,1]=4 1991 B15R2.389 Cc1ccc([C@@H]2COCCN2)c(C)[n]1 Amb25114675 [0,2,0,0,0,0|1,0,1]=4 1992 B15R2.389 Cc1ccc([C@@H]2COCCN2)c(Cl)[n]1 Amb24417929 [0,2,0,0,0,0|1,0,1]=4 1993 B15R2.389 Cc1ccc([C@H]2CCCCN2)c(O)[n]1 Amb25371973 [0,2,0,0,0,0|0,0,2]=4 1994 B15R2.389 Cc1ccc([C@H]2COCCN2)c(C)[n]1 Amb24377397 [0,2,0,0,0,0|1,0,1]=4 1995 B15R2.389 Clc1cc(Cl)[n]cc1C2CCCCN2 Amb25278406 [0,2,0,0,0,0|0,0,2]=4 1996 B15R2.389 Clc1cc(Cl)[n]cc1C2CNCCN2 Amb25081554 [0,2,0,0,0,0|1,0,1]=4 1997 B15R2.389 Clc1cc(Cl)[n]cc1C2COCCN2 Amb25679633 [0,2,0,0,0,0|1,0,1]=4 1998 B15R2.389 Clc1cc(Cl)[n]cc1[C@@H]2CNCCN2 Amb25090289 [0,2,0,0,0,0|1,0,1]=4 1999 B15R2.389 Clc1cc(Cl)[n]cc1[C@H]2CCCCN2 Amb25195762 [0,2,0,0,0,0|0,0,2]=4 2000 B15R2.389 Clc1cc(Cl)[n]cc1[C@H]2COCCN2 Amb25804901 [0,2,0,0,0,0|1,0,1]=4 2001 B15R2.389 Clc1cc(I)c(c[n]1)[C@H]2COCCN2 Amb25824852 [0,2,0,0,0,0|1,0,1]=4 2002 B15R2.389 Clc1ccc(C2COCCN2)c(Cl)[n]1 Amb24451670 [0,2,0,0,0,0|1,0,1]=4 2003 B15R2.389 Clc1ccc([C@@H]2COCCN2)c(Cl)[n]1 Amb24756467 [0,2,0,0,0,0|1,0,1]=4 2004 B15R2.389 Clc1ccc([C@H]2CCCCN2)c(Cl)[n]1 Amb24505900 [0,2,0,0,0,0|0,0,2]=4 2005 B15R2.389 Clc1ccc([C@H]2CNCCN2)c(Cl)[n]1 Amb24680146 [0,2,0,0,0,0|1,0,1]=4 2006 B15R2.389 Clc1ccc([C@H]2COCCN2)c(Cl)[n]1 Amb25738562 [0,2,0,0,0,0|1,0,1]=4 2007 B15R2.389 Fc1ccc(C2CCCCN2)c(F)[n]1 Amb24428777 [0,2,0,0,0,0|0,0,2]=4 2008 B15R2.389 Fc1ccc(C2COCCN2)c(F)[n]1 Amb25771075 [0,2,0,0,0,0|1,0,1]=4 2009 B15R2.389 Fc1ccc([C@@H]2COCCN2)c(F)[n]1 Amb25123235 [0,2,0,0,0,0|1,0,1]=4 2010 B15R2.389 Fc1ccc([C@H]2CCCCN2)c(F)[n]1 Amb25063750 [0,2,0,0,0,0|0,0,2]=4 2011 B15R2.389 Fc1ccc([C@H]2COCCN2)c(F)[n]1 Amb24367263 [0,2,0,0,0,0|1,0,1]=4 2012 B15R2.389 Nc1cc(Cl)[n]cc1C2COCCN2 Amb25817701 [0,2,0,0,0,0|1,0,1]=4 2013 B15R2.389 Nc1cc(Cl)[n]cc1[C@H]2CCCCN2 Amb25193558 [0,2,0,0,0,0|0,0,2]=4 2014 B15R2.389 Nc1cc(Cl)[n]cc1[C@H]2COCCN2 Amb25732532 [0,2,0,0,0,0|1,0,1]=4 2015 B15R2.389 Oc1cc(O)c(cc1)C2CC=CCC2 Amb18650522 [0,2,0,0,0,0|2,0,0]=4 2016 B15R2.389 Oc1ccc(C2CCCCN2)c(Cl)[n]1 Amb24681693 [0,2,0,0,0,0|0,0,2]=4 2017 B15R2.389 Oc1ccc(C2COCCN2)c(Cl)[n]1 Amb25324061 [0,2,0,0,0,0|1,0,1]=4 2018 B15R2.389 Oc1ccc([C@@H]2CNCCN2)c(Cl)[n]1 Amb25364181 [0,2,0,0,0,0|1,0,1]=4 2019 B15R2.389 Oc1ccc([C@@H]2COCCN2)c(Cl)[n]1 Amb25312243 [0,2,0,0,0,0|1,0,1]=4 2020 B15R2.389 Oc1ccc([C@H]2CNCCN2)c(Cl)[n]1 Amb25375828 [0,2,0,0,0,0|1,0,1]=4 2021 B15R2.541 CN1CCCC(N)C1c2ccc[n]c2 Amb24399779 [0,2,0,0,0,0|0,0,2]=4 2022 B15R2.541 Cc1cc[n]c(Br)c1[C@@H]2CCCCN2 Amb25063065 [0,2,0,0,0,0|0,0,2]=4 2023 B15R2.541 Cc1cc[n]c(Br)c1[C@@H]2COCCN2 Amb24376859 [0,2,0,0,0,0|1,0,1]=4 2024 B15R2.541 Cc1cc[n]c(Br)c1[C@H]2CCCCN2 Amb24606597 [0,2,0,0,0,0|0,0,2]=4 2025 B15R2.541 Clc1[n]ccc(I)c1C2COCCN2 Amb24713579 [0,2,0,0,0,0|1,0,1]=4 2026 B15R2.541 Clc1[n]ccc(I)c1[C@H]2CCCCN2 Amb24451645 [0,2,0,0,0,0|0,0,2]=4 2027 B15R2.541 Clc1[n]ccc(I)c1[C@H]2CNCCN2 Amb24701812 [0,2,0,0,0,0|1,0,1]=4 2028 B15R2.541 Clc1[n]ccc(I)c1[C@H]2COCCN2 Amb25731934 [0,2,0,0,0,0|1,0,1]=4 2029 B15R2.541 Fc1[n]ccc(I)c1[C@@H]2CCCCN2 Amb25828758 [0,2,0,0,0,0|0,0,2]=4 2030 B15R2.541 Fc1[n]ccc(I)c1[C@@H]2COCCN2 Amb25055682 [0,2,0,0,0,0|1,0,1]=4 2031 B15R2.541 Fc1[n]ccc(I)c1[C@H]2CCCCN2 Amb25243104 [0,2,0,0,0,0|0,0,2]=4 2032 B15R2.541 Nc1cc[n]c(Cl)c1C2COCCN2 Amb25835843 [0,2,0,0,0,0|1,0,1]=4 2033 B15R2.555 CN1CCCCC1c2ccc[n]c2Br Amb23444891 [0,2,0,0,0,0|0,0,2]=4 2034 B15R2.555 CN1CCCCC1c2ccc[n]c2Cl Amb23444834 [0,2,0,0,0,0|0,0,2]=4 2035 B15R2.555 CN1CCCCC1c2ccc[n]c2O Amb23445258 [0,2,0,0,0,0|0,0,2]=4 2036 B15R2.555 CN1CCCCC1c2ccc[n]c2S Amb23508054 [0,2,0,0,0,0|0,0,2]=4 2037 B15R2.555 CN1CCCC[C@H]1c2ccc[n]c2N Amb25198829 [0,2,0,0,0,0|0,0,2]=4 2038 B15R2.555 CN1CCNCC1c2ccc[n]c2Cl Amb25313285 [0,2,0,0,0,0|1,0,1]=4 2039 B15R2.555 Cc1[n]cccc1C2CCCCN2C Amb23444722 [0,2,0,0,0,0|0,0,2]=4 2040 B15R2.555 Cc1cc[n]cc1C2CCCCN2C Amb23444778 [0,2,0,0,0,0|0,0,2]=4 2041 B15R2.555 Cc1ccccc1C2CCC=CC2O Amb25806715 [0,2,0,0,0,0|2,0,0]=4 2042 B15R2.555 Cc1ccccc1[C@@H]2CC=CCC2O Amb25846229 [0,2,0,0,0,0|2,0,0]=4 2043 B15R2.555 Cc1ccccc1[C@@H]2CC=CC[C@H]2O Amb25206664 [0,2,0,0,0,0|2,0,0]=4 2044 B15R2.1 C=NC1=CCC(CC1)c2ccccc2 Amb10601672 [0,2,0,0,0,0|2,0,0]=4 2045 B15R2.1 CNc1ccc(c[n]1)C2CCCCN2 Amb23445358 [0,2,0,0,0,0|0,0,2]=4 2046 B15R2.1 COc1ccc(c[n]1)C2COCCN2 Amb25814528 [0,2,0,0,0,0|1,0,1]=4 2047 B15R2.1 COc1ccc(c[n]1)[C@@H]2CCCCN2 Amb25694343 [0,2,0,0,0,0|0,0,2]=4 2048 B15R2.1 COc1ccc(c[n]1)[C@@H]2COCCN2 Amb24415624 [0,2,0,0,0,0|1,0,1]=4 2049 B15R2.1 COc1ccc(c[n]1)[C@H]2CCCCN2 Amb25749677 [0,2,0,0,0,0|0,0,2]=4 2050 B15R2.1 COc1ccc(cn1)C2CCCCN2 Amb2235021 [0,2,0,0,0,0|0,0,2]=4 2051 B15R2.1 CSc1ccc(c[n]1)C2CCCCN2 Amb23507950 [0,2,0,0,0,0|0,0,2]=4 2052 B15R2.1 N#Cc1ccc(c[n]1)C2CCCCN2 Amb25183046 [0,2,0,0,0,0|0,0,2]=4 2053 B15R2.1 N#Cc1ccc(c[n]1)N2CC=CCC2 Amb25081616 [0,2,0,0,0,0|2,0,0]=4 2054 B15R2.1 N#Cc1ccc(c[n]1)[C@@H]2CNCCN2 Amb25727297 [0,2,0,0,0,0|1,0,1]=4 2055 B15R2.1 N#Cc1ccc(c[n]1)[C@@H]2COCCN2 Amb25836751 [0,2,0,0,0,0|1,0,1]=4 2056 B15R2.1 NCC1CCC(NC1)c2ccc[n]c2 Amb18818074 [0,2,0,0,0,0|0,0,2]=4 2057 B15R2.1 O=CC=1CCC(CC1)c2ccccc2 Amb24342731 [0,2,0,0,0,0|2,0,0]=4 2058 B15R2.1 O=Cc1ccc(c[n]1)C2CCCCN2 Amb24336412 [0,2,0,0,0,0|0,0,2]=4 2059 B15R2.1 O=Cc1ccc(c[n]1)C2CNCCN2 Amb25780071 [0,2,0,0,0,0|1,0,1]=4 2060 B15R2.1 O=Cc1ccc(c[n]1)C2COCCN2 Amb25779322 [0,2,0,0,0,0|1,0,1]=4 2061 B15R2.1 O=Cc1ccc(c[n]1)[C@@H]2CCCCN2 Amb25694431 [0,2,0,0,0,0|0,0,2]=4 2062 B15R2.1 O=Cc1ccc(c[n]1)[C@@H]2CNCCN2 Amb24460743 [0,2,0,0,0,0|1,0,1]=4 2063 B15R2.1 OCC1CCC(NC1)c2ccc[n]c2 Amb25138145 [0,2,0,0,0,0|0,0,2]=4 2064 B15R2.1 OCc1ccc(c[n]1)C2CCCCN2 Amb24453252 [0,2,0,0,0,0|0,0,2]=4 2065 B15R2.1 OCc1ccc(c[n]1)[C@@H]2CCCCN2 Amb24761448 [0,2,0,0,0,0|0,0,2]=4 2066 B15R2.1 [C-]#[N+]C=1CCC(CC1)c2ccccc2 Amb22265799 [0,2,0,0,0,0|2,0,0]=4 2067 B15R2.3 CC=1CCC(CC1)c2c[n]c(C)cc2 Amb25317760 [0,2,0,0,0,0|1,0,0]=3 2068 B15R2.3 Cc1ccc(c[n]1)C2CCC(=O)CC2 Amb25186122 [0,2,0,0,0,0|1,0,1]=4 2069 B15R2.3 Cc1ccc(cc1)C2CNC(=O)CN2 Amb24345915 [0,2,0,0,0,0|2,0,0]=4 2070 B15R2.3 Nc1ccc(c[n]1)C2CCC(=O)CC2 Amb25664322 [0,2,0,0,0,0|1,0,1]=4 2071 B15R2.3 O=C1CCC(CC1)c2ccc(F)[n]c2 Amb25329612 [0,2,0,0,0,0|1,0,1]=4 2072 B15R2.96 O=C1CCC(F)(CC1)c2ccc[n]c2 Amb25742385 [0,2,0,0,0,0|1,0,1]=4 2073 B15R2.4980 O=CC1(CC=CCO1)c2ccccc2 Amb24456623 [0,2,0,0,0,0|2,0,0]=4 2074 B15R2.4980 OCC1(CC=CCO1)c2ccccc2 Amb25813494 [0,2,0,0,0,0|2,0,0]=4 2075 B13R2.1 C=CCN1CCc2[n]cccc12 Amb25077712 [0,0,1,1,0,0|2,0,0]=4 2076 B13R2.373 CN1C(CC1=O)c2ccc[n]c2 Amb25208120 [0,0,1,1,0,0|1,0,0]=3 2077 B13R2.679 CNC(C1CC1)c2ccc[n]c2 Amb18970023 [0,0,1,1,0,0|0,0,2]=4 2078 B13R2.679 CNC(C1CC1)c2ccc[n]c2 Amb19373210 [0,0,1,1,0,0|0,0,2]=4 2079 B13R2.1613 CCC1NCCc2[n]cccc21 Amb24423421 [0,0,1,1,0,0|0,0,2]=4 2080 B13R2.1613 CCC1NCCc2cc[n]cc21 Amb25159960 [0,0,1,1,0,0|0,0,2]=4 2081 B13R2.1613 CNc1cccc2cc[n]cc21 Amb18351883 [0,0,1,1,0,0|0,0,2]=4 2082 B13R2.2931 CNC1OC(=C)c2ccccc21 Amb24739539 [0,0,1,1,0,0|2,0,0]=4 2083 B13R2.17 CC1CC1NCc2c[n]ccc2 Amb18298211 [0,0,1,1,0,0|0,0,2]=4 2084 B13R2.17 C[C@@H]1C[C@H]1NCc2c[n]ccc2 Amb24466100 [0,0,1,1,0,0|0,0,2]=4 2085 B13R2.64 C([C@H]1CCCN1)c2c[n]ccc2 Amb24567902 [0,0,1,1,0,0|0,0,2]=4 2086 B13R2.64 C1C=CC(Cc2c[n]ccc2)N1 Amb25674276 [0,0,1,1,0,0|0,0,0]=2 2087 B13R2.64 C1C=CC(Cc2ccccc2)N1 Amb25798238 [0,0,1,1,0,0|1,0,0]=3 2088 B13R2.64 C1CNC(C1)Cc2cccnc2 Amb10068752 [0,0,1,1,0,0|0,0,2]=4 2089 B13R2.64 c1ccc(cn1)Cn2cccc2 Amb1154176 [0,0,1,1,0,0|0,0,2]=4 2090 B13R2.2383 C(NC1CCC1)c2c[n]ccc2 Amb18989372 [0,0,1,1,0,0|0,0,2]=4 2091 B13R2.2383 C(NC1COC1)c2c[n]ccc2 Amb22735485 [0,0,1,1,0,0|1,0,1]=4 2092 B13R2.5252 CN1CCNCc2ccc[n]c12 Amb22174183 [0,0,1,1,0,0|1,0,1]=4 2093 B13R2.5252 NC1CCCCc2ccc[n]c21 Amb22499725 [0,0,1,1,0,0|0,0,2]=4 2094 B13R2.5252 N[C@H]1CCCCc2ccc[n]c21 Amb25320739 [0,0,1,1,0,0|0,0,2]=4 2095 B13R2.5252 O[C@@H]1C=CCCc2ccccc21 Amb24675499 [0,0,1,1,0,0|2,0,0]=4 2096 B13R2.371 CC1=CCC(N)c2ccccc21 Amb18645218 [0,0,1,1,0,0|1,0,0]=3 2097 B13R2.371 CC1CCC(=O)c2[n]cccc21 Amb25713621 [0,0,1,1,0,0|2,0,0]=4 2098 B13R2.371 CN1CCC(N)c2ccc[n]c12 Amb18829159 [0,0,1,1,0,0|1,0,1]=4 2099 B13R2.371 Cc1ccc(N)c2c[n]ccc21 Amb25774370 [0,0,1,1,0,0|0,0,2]=4 2100 B13R2.371 NC1CNC(=O)c2[n]cccc21 Amb18829367 [0,0,1,1,0,0|2,0,0]=4 2101 B13R2.371 Nc1ccc(c2c1cccn2)C Amb1119721 [0,0,1,1,0,0|0,0,2]=4 2102 B13R2.382 CC1CC1C(N)c2ccc[n]c2 Amb24350844 [0,0,1,1,0,0|0,0,2]=4 2103 B13R2.690 CC(c1cccnc1)NC2CC2 Amb1116757 [0,0,1,1,0,0|0,0,2]=4 2104 B13R2.690 NC(CC1CC1)c2ccc[n]c2 Amb18829617 [0,0,1,1,0,0|0,0,2]=4 2105 B13R2.690 N[C@@H](CC1CC1)c2ccc[n]c2 Amb25064290 [0,0,1,1,0,0|0,0,2]=4 2106 B13R2.690 N[C@H](CC1CC1)c2ccc[n]c2 Amb25328675 [0,0,1,1,0,0|0,0,2]=4 2107 B13R2.8137 CC(c1c[n]ccc1)N2CCC2 Amb25854835 [0,0,1,1,0,0|0,0,2]=4 2108 B13R2.8137 NC(C1CCC1)c2c[n]ccc2 Amb22642958 [0,0,1,1,0,0|0,0,2]=4 2109 B13R2.8137 N[C@H](C1CCC1)c2c[n]ccc2 Amb24702315 [0,0,1,1,0,0|0,0,2]=4 2110 B13R3.1962 C1=CC2NC1c3c2cccc3 Amb17593612 [0,0,0,1,1,0|1,0,0]=3 2111 B13R3.1962 C1=CC2OC1c3c2cccc3 Amb2389751 [0,0,0,1,1,0|2,0,0]=4 2112 B13R3.1962 C1C2C=CC1c3[n]cccc32 Amb25046790 [0,0,0,1,1,0|1,0,0]=3 2113 B13R3.1962 C1C2C=CC1c3cc[n]cc32 Amb24484610 [0,0,0,1,1,0|1,0,0]=3 2114 B13R3.1962 C1C2CCC1c3cc[n]cc32 Amb23536233 [0,0,0,1,1,0|0,0,2]=4 2115 B13R3.1962 C1CC2NC1c3ccccc32 Amb18124757 [0,0,0,1,1,0|1,0,1]=4 2116 B13R3.1962 C1C[C@H]2N[C@@H]1c3c2cccc3 Amb10606699 [0,0,0,1,1,0|1,0,1]=4 2117 B13R3.1962 C1NC2CC1c3ccccc32 Amb18124756 [0,0,0,1,1,0|1,0,1]=4 2118 B13R3.1962 C1N[C@@H]2C[C@H]1c3ccccc32 Amb24614643 [0,0,0,1,1,0|1,0,1]=4 2119 B13R3.1962 C1N[C@H]2C[C@@H]1c3ccccc32 Amb25174781 [0,0,0,1,1,0|1,0,1]=4 2120 B13R3.1962 C1[C@@H]2C=C[C@H]1c3ccccc32 Amb25858647 [0,0,0,1,1,0|2,0,0]=4 2121 B13R3.1962 C1[C@H]2C=C[C@@H]1c3cc[n]cc32 Amb25240555 [0,0,0,1,1,0|1,0,0]=3 2122 B13R3.1962 c1cc[n]c2C3C=CC(O3)c21 Amb25124916 [0,0,0,1,1,0|1,0,0]=3 2123 B15R3.3 C1CC=CC2C1Nc3ccccc32 Amb21953474 [0,0,0,1,0,1|2,0,0]=4 2124 B15R3.1740 C1C2CC(CCN2)c3[n]cccc31 Amb25695927 [0,0,0,1,0,1|0,0,2]=4 2125 B15R3.1740 C1C2CC=CC(N2)c3ccccc31 Amb25200081 [0,0,0,1,0,1|1,0,0]=3 2126 B15R3.1740 C1[C@H]2CC=C[C@H](N2)c3ccccc31 Amb24540345 [0,0,0,1,0,1|1,0,0]=3 2127 B15R3.4209 C1C(C2C=CC1N2)c3ccccc3 Amb24373836 [0,1,0,1,0,0|2,0,0]=4 2128 B15R3.4209 C1C2C=CC1CC2c3ccccc3 Amb20621963 [0,1,0,1,0,0|2,0,0]=4 2129 B15R3.76 OC1C=CC2CC1c3ccccc32 Amb25072476 [0,1,0,1,0,0|2,0,0]=4 2130 B15R3.76 O[C@H]1C=C[C@@H]2C[C@@H]1c3ccccc32 Amb25296268 [0,1,0,1,0,0|2,0,0]=4 2131 B15R3.76 O[C@H]1C=C[C@H]2C[C@H]1c3ccccc32 Amb24581779 [0,1,0,1,0,0|2,0,0]=4 2132 B11R1.2 C=CCC(NN)c1c[nH][n]c1 Amb24750298 [0,0,1,0,1,0|2,0,0]=4 2133 B11R1.2 C=CCC(NN)c1cc[s][n]1 Amb24762924 [0,0,1,0,1,0|2,0,0]=4 2134 B11R1.2 CNC(CC=C)c1c[nH][n]c1 Amb24750297 [0,0,1,0,1,0|1,0,0]=3 2135 B11R1.2 CNC(CC=C)c1c[s]cc1 Amb19015829 [0,0,1,0,1,0|1,0,0]=3 2136 B11R1.2 CNC(CC=C)c1cc[s][n]1 Amb25379991 [0,0,1,0,1,0|1,0,0]=3 2137 B11R1.2 CNC(CC=C)c1ccc[s]1 Amb18307132 [0,0,1,0,1,0|1,0,0]=3 2138 B11R1.2 CNC(CC=C)c1ccco1 Amb19028590 [0,0,1,0,1,0|1,0,0]=3 2139 B11R1.4 C/C=C/CNCc1ccco1 Amb17872669 [0,0,1,0,1,0|1,0,0]=3 2140 B11R1.4 C\C=C\CNCc1[nH]cc[n]1 Amb25380595 [0,0,1,0,1,0|1,0,0]=3 2141 B11R1.4 C\C=C\CNCc1[n]cc[s]1 Amb24764415 [0,0,1,0,1,0|1,0,0]=3 2142 B11R1.4 C\C=C\CNCc1c[n][s][n]1 Amb24765801 [0,0,1,0,1,0|2,0,0]=4 2143 B11R1.4 C\C=C\CNCc1c[n]c[nH]1 Amb25380597 [0,0,1,0,1,0|1,0,0]=3 2144 B11R1.4 C\C=C\CNCc1c[n]c[s]1 Amb24750405 [0,0,1,0,1,0|1,0,0]=3 2145 B11R1.4 C\C=C\CNCc1c[n]co1 Amb25380598 [0,0,1,0,1,0|1,0,0]=3 2146 B11R1.4 C\C=C\CNCc1c[s][n][n]1 Amb25380603 [0,0,1,0,1,0|2,0,0]=4 2147 B11R1.4 C\C=C\CNCc1c[s]c[n]1 Amb25380602 [0,0,1,0,1,0|1,0,0]=3 2148 B11R1.4 C\C=C\CNCc1cc[nH][n]1 Amb25380596 [0,0,1,0,1,0|1,0,0]=3 2149 B11R1.4 C\C=C\CNCc1cc[nH]c1 Amb25380594 [0,0,1,0,1,0|0,0,1]=3 2150 B11R1.4 C\C=C\CNCc1ccc[nH]1 Amb25380593 [0,0,1,0,1,0|0,0,1]=3 2151 B11R1.4 C\C=C\CNCc1ccc[s]1 Amb24750391 [0,0,1,0,1,0|1,0,0]=3 2152 B11R1.4 C\C=C\CNCc1cco[n]1 Amb24750415 [0,0,1,0,1,0|1,0,0]=3 2153 B11R1.4 C\C=C\CNCc1cocc1 Amb24750403 [0,0,1,0,1,0|1,0,0]=3 2154 B11R1.4 NC\C=C\CSc1[n]cc[s]1 Amb25380216 [0,0,1,0,1,0|2,0,0]=4 2155 B11R1.4 NC\C=C\CSc1ccc[s]1 Amb25380213 [0,0,1,0,1,0|2,0,0]=4 2156 B11R1.29 CC(NCC=C)c1[nH]cc[n]1 Amb24756095 [0,0,1,0,1,0|1,0,0]=3 2157 B11R1.29 CC(NCC=C)c1[n]co[n]1 Amb24756096 [0,0,1,0,1,0|2,0,0]=4 2158 B11R1.29 CC(NCC=C)c1c[s]cc1 Amb18805735 [0,0,1,0,1,0|1,0,0]=3 2159 B11R1.29 CC(NCC=C)c1cc[nH][n]1 Amb19006945 [0,0,1,0,1,0|1,0,0]=3 2160 B11R1.29 CC(NCC=C)c1cocc1 Amb25382003 [0,0,1,0,1,0|1,0,0]=3 2161 B11R1.29 C[C@@H](NCC=C)c1ccc[s]1 Amb24762117 [0,0,1,0,1,0|1,0,0]=3 2162 B11R1.29 C[C@@H](NCC=C)c1ccco1 Amb24762125 [0,0,1,0,1,0|1,0,0]=3 2163 B11R1.29 C[C@H](NCC=C)c1ccc[s]1 Amb24762116 [0,0,1,0,1,0|1,0,0]=3 2164 B11R1.29 C[C@H](NCC=C)c1ccco1 Amb24762126 [0,0,1,0,1,0|1,0,0]=3 2165 B11R1.29 C\C=C\CC(C)c1ccc[s]1 Amb25320532 [0,0,1,0,1,0|2,0,0]=4 2166 B11R2.2 C1C=CC(N1)c2c[s]c[n]2 Amb24662083 [0,0,0,0,2,0|1,0,0]=3 2167 B11R2.2 C1C=CC(N1)c2c[s]cc2 Amb25710010 [0,0,0,0,2,0|1,0,0]=3 2168 B11R2.2 C1C=CC(N1)c2ccc[nH]2 Amb24385754 [0,0,0,0,2,0|0,0,1]=3 2169 B11R2.2 C1C=CCC1[n]2cccc2 Amb24413404 [0,0,0,0,2,0|1,0,0]=3 2170 B11R2.2 C1C=NNC1c2c[s]cc2 Amb25187327 [0,0,0,0,2,0|2,0,0]=4 2171 B11R2.2 C1CCC(N1)c2[n]cco2 Amb18061837 [0,0,0,0,2,0|1,0,1]=4 2172 B11R2.2 C1CCC(N1)c2c[nH][n]c2 Amb18279580 [0,0,0,0,2,0|1,0,1]=4 2173 B11R2.2 C1CCC(N1)c2c[nH]cc2 Amb18063576 [0,0,0,0,2,0|0,0,2]=4 2174 B11R2.2 C1CCC(N1)c2c[n]c[nH]2 Amb25063752 [0,0,0,0,2,0|1,0,1]=4 2175 B11R2.2 C1CCC(N1)c2c[n]co2 Amb22642466 [0,0,0,0,2,0|1,0,1]=4 2176 B11R2.2 C1CCC(N1)c2c[s]c[n]2 Amb18560811 [0,0,0,0,2,0|1,0,1]=4 2177 B11R2.2 C1CCC(N1)c2cc[n][nH]2 Amb21959817 [0,0,0,0,2,0|1,0,1]=4 2178 B11R2.2 C1CCC(N1)c2cc[n]o2 Amb22411385 [0,0,0,0,2,0|1,0,1]=4 2179 B11R2.2 C1CCC(N1)c2cc[s][n]2 Amb24588559 [0,0,0,0,2,0|1,0,1]=4 2180 B11R2.2 C1CCC(N1)c2ccco2 Amb17659148 [0,0,0,0,2,0|1,0,1]=4 2181 B11R2.2 C1CCC(N1)c2cco[n]2 Amb21959834 [0,0,0,0,2,0|1,0,1]=4 2182 B11R2.2 C1CC[C@@H](N1)c2[nH]cc[n]2 Amb24739008 [0,0,0,0,2,0|1,0,1]=4 2183 B11R2.2 C1CC[C@@H](N1)c2c[n]co2 Amb25272465 [0,0,0,0,2,0|1,0,1]=4 2184 B11R2.2 C1CC[C@@H](N1)c2cc[nH][n]2 Amb18832305 [0,0,0,0,2,0|1,0,1]=4 2185 B11R2.2 C1CC[C@@H](N1)c2ccc[nH]2 Amb25703074 [0,0,0,0,2,0|0,0,2]=4 2186 B11R2.2 C1CC[C@@H](N1)c2coc[n]2 Amb18832200 [0,0,0,0,2,0|1,0,1]=4 2187 B11R2.2 C1CC[C@H](N1)c2[n]cco2 Amb24478935 [0,0,0,0,2,0|1,0,1]=4 2188 B11R2.2 C1CC[C@H](N1)c2c[s]cc2 Amb24453289 [0,0,0,0,2,0|1,0,1]=4 2189 B11R2.2 C1CC[C@H](N1)c2cc[nH][n]2 Amb25128425 [0,0,0,0,2,0|1,0,1]=4 2190 B11R2.2 C1CC[C@H](N1)c2cc[n]o2 Amb24361054 [0,0,0,0,2,0|1,0,1]=4 2191 B11R2.2 C1CNC(C1)c2ccco2 Amb10606441 [0,0,0,0,2,0|1,0,1]=4 2192 B11R2.2 C1CNC(C1)c2ccco2 Amb1839659 [0,0,0,0,2,0|1,0,1]=4 2193 B11R2.2 C1CNC(C1)c2cccs2 Amb2234469 [0,0,0,0,2,0|1,0,1]=4 2194 B11R2.2 C1CNC(C1)c2ccn[nH]2 Amb16186978 [0,0,0,0,2,0|1,0,1]=4 2195 B11R2.2 C1CNC(C1)c2nccs2 Amb2235139 [0,0,0,0,2,0|1,0,1]=4 2196 B11R2.2 C1CNC(C1)c2nocc2 Amb16187079 [0,0,0,0,2,0|1,0,1]=4 2197 B11R2.2 c1[n]cc[n]1C2NC=CO2 Amb24432608 [0,0,0,0,2,0|2,0,0]=4 2198 B11R2.239 C1CC(N1)c2ccc[n][n]2 Amb25229662 [0,0,0,0,2,0|1,0,0]=3 2199 B11R2.239 C1CC(N1)c2cccc[n]2 Amb25849292 [0,0,0,0,2,0|2,0,0]=4 2200 B11R2.239 C1CC(O1)c2ccccc2 Amb22298601 [0,0,0,0,2,0|2,0,0]=4 2201 B11R2.239 C1C[C@@H](N1)c2c[n]cc[n]2 Amb24657231 [0,0,0,0,2,0|1,0,0]=3 2202 B11R2.239 C1C[C@@H](N1)c2cc[n]cc2 Amb25761359 [0,0,0,0,2,0|2,0,0]=4 2203 B11R2.239 C1C[C@@H](O1)c2ccccc2 Amb24479262 [0,0,0,0,2,0|2,0,0]=4 2204 B11R2.239 C1C[C@H](N1)c2c[n]cc[n]2 Amb25791186 [0,0,0,0,2,0|1,0,0]=3 2205 B11R2.239 C1C[C@H](N1)c2cccc[n]2 Amb24732378 [0,0,0,0,2,0|2,0,0]=4 2206 B11R2.239 C1C[C@H](O1)c2ccccc2 Amb25721124 [0,0,0,0,2,0|2,0,0]=4 2207 B11R2.239 C1NCC1c2c[n]ccc2 Amb19516797 [0,0,0,0,2,0|1,0,0]=3 2208 B11R2.239 C1NCC1c2c[n]ccc2 Amb20620349 [0,0,0,0,2,0|1,0,0]=3 2209 B11R2.239 C1NCC1c2ccc[n][n]2 Amb25786757 [0,0,0,0,2,0|2,0,0]=4 2210 B11R2.239 C1OCC1c2c[n]c[n]c2 Amb25775651 [0,0,0,0,2,0|2,0,0]=4 2211 B11R2.239 C1OCC1c2ccccc2 Amb21963191 [0,0,0,0,2,0|2,0,0]=4 2212 B11R2.239 N1CC(C1)c2ccccc2 Amb10603719 [0,0,0,0,2,0|2,0,0]=4 2213 B13R1.79 C=CCC(Sc1ccccc1)CC Amb10565502 [0,0,1,0,0,1|2,0,0]=4 2214 B15R2.2195 C(Nc1c[n]ccc1)C2CCC=CO2 Amb18294967 [0,0,0,0,0,2|2,0,0]=4 2215 B15R2.2195 C(Nc1c[n]ccc1)[C@@H]2CCCCN2 Amb25837358 [0,0,0,0,0,2|0,0,2]=4 2216 B15R2.2195 C1C=CCCC1CNc2ccc[n][n]2 Amb24644987 [0,0,0,0,0,2|2,0,0]=4 2217 B15R2.2195 C1C=CCCC1NCc2c[n]c[n]c2 Amb25057218 [0,0,0,0,0,2|2,0,0]=4 2218 B15R2.2195 C1C=CCCC1NCc2c[n]ccc2 Amb25803229 [0,0,0,0,0,2|1,0,0]=3 2219 B15R2.2195 C1NCCN[C@H]1CCc2c[n]ccc2 Amb24753238 [0,0,0,0,0,2|1,0,1]=4 2220 B15R2.2195 C1OCCNC1CCc2c[n]ccc2 Amb18565142 [0,0,0,0,0,2|1,0,1]=4