0 B15R2.283 Brc1nc(CCc2ccccc2)ns1 Amb28045318 [0,0,0,0,0,0|2,1,1]=4 1 B15R2.283 Brc1ncn(CCc2ccccc2)n1 Amb13777488 [0,0,0,0,0,0|3,0,1]=4 2 B15R2.283 C=C1COC(CCc2ccccc2)C1 Amb25183212 [0,0,0,0,0,0|4,0,0]=4 3 B15R2.283 CC1CC(NCc2ccccc2)CO1 Amb35686686 [0,0,0,0,0,0|3,0,1]=4 4 B15R2.283 Cc1ccn(CCc2ccccc2)n1 Amb24348125 [0,0,0,0,0,0|3,0,1]=4 5 B15R2.283 Clc1nc(CCc2ccccn2)no1 Amb30007525 [0,0,0,0,0,0|3,0,1]=4 6 B15R2.283 Clc1ncn(CCc2ccccc2)n1 Amb19134567 [0,0,0,0,0,0|3,0,1]=4 7 B15R2.283 Clc1ncn(CCc2ccccc2)n1 Amb19861223 [0,0,0,0,0,0|3,0,1]=4 8 B15R2.283 Clc1nsc(CCc2ccccc2)n1 Amb27168756 [0,0,0,0,0,0|3,0,1]=4 9 B15R2.283 Ic1nc(CCc2ccccc2)ns1 Amb27413479 [0,0,0,0,0,0|2,1,1]=4 10 B15R2.283 N=C1CN(CCc2ccccc2)NO1 Amb27795767 [0,0,0,0,0,0|3,0,1]=4 11 B15R2.283 N=C1[CH-][N+](CCc2ccccc2)=NO1 Amb19775573 [0,0,0,0,0,0|3,0,1]=4 12 B15R2.283 NC1=NC(CSc2ccccc2)CO1 Amb27784910 [0,0,0,0,0,0|1,0,0]=1 13 B15R2.283 NC1=NCC(CCc2ccccc2)O1 Amb27746954 [0,0,0,0,0,0|2,0,0]=2 14 B15R2.283 NC1=NCC(CSc2ccccc2)O1 Amb17595588 [0,0,0,0,0,0|3,0,0]=3 15 B15R2.283 NC1=N[C@@H](CCc2ccccc2)CO1 Amb27969242 [0,0,0,0,0,0|0,0,0]=0 16 B15R2.283 NC1=N[C@H](CCc2ccccc2)CO1 Amb27879567 [0,0,0,0,0,0|0,0,0]=0 17 B15R2.283 NC1=N[C@H](CCc2ccccn2)CS1 Amb27950924 [0,0,0,0,0,0|1,1,0]=2 18 B15R2.283 NC1=N[C@H](CCc2cccnc2)CS1 Amb27868556 [0,0,0,0,0,0|1,1,0]=2 19 B15R2.283 NC1=N[C@H](COc2ccccc2)CO1 Amb27464440 [0,0,0,0,0,0|1,0,0]=1 20 B15R2.283 NC1C=C(CCc2ccccc2)CC1 Amb27226394 [0,0,0,0,0,0|2,0,2]=4 21 B15R2.283 NC1CCC(NCc2ccccc2)C1 Amb26368245 [0,0,0,0,0,0|3,0,1]=4 22 B15R2.283 NC1CCN(CCc2ccccc2)C1 Amb8948532 [0,0,0,0,0,0|3,0,1]=4 23 B15R2.283 NC1COC(CCc2ccccc2)C1 Amb35584887 [0,0,0,0,0,0|3,0,1]=4 24 B15R2.283 N[C@@H]1CCN(CCc2ccccc2)C1 Amb28282822 [0,0,0,0,0,0|3,0,1]=4 25 B15R2.283 N[C@@H]1CCN(CCc2ccccc2)C1 Amb34913340 [0,0,0,0,0,0|3,0,1]=4 26 B15R2.283 N[C@@H]1CC[C@H](OCc2ccccc2)C1 Amb27645298 [0,0,0,0,0,0|3,0,1]=4 27 B15R2.283 N[C@H]1CCN(CCc2ccccc2)C1 Amb27419381 [0,0,0,0,0,0|3,0,1]=4 28 B15R2.283 N[C@H]1CC[C@@H](OCc2ccccc2)C1 Amb33716086 [0,0,0,0,0,0|3,0,1]=4 29 B15R2.283 N[C@H]1CC[C@H](OCc2ccccc2)C1 Amb28321591 [0,0,0,0,0,0|3,0,1]=4 30 B15R2.283 Nc1c[n+](CCc2ccccc2)no1 Amb19650266 [0,0,0,0,0,0|3,0,0]=3 31 B15R2.283 Nc1cc(CCc2ccccc2)no1 Amb33529147 [0,0,0,0,0,0|2,0,1]=3 32 B15R2.283 Nc1cc(CCc2ccccc2)on1 Amb26420299 [0,0,0,0,0,0|3,0,1]=4 33 B15R2.283 Nc1cc(CCc2cccnc2)no1 Amb17234650 [0,0,0,0,0,0|3,0,1]=4 34 B15R2.283 Nc1cc(COc2ccccc2)no1 Amb17234868 [0,0,0,0,0,0|3,0,1]=4 35 B15R2.283 Nc1ccn(CCc2ccccc2)n1 Amb7173304 [0,0,0,0,0,0|2,0,1]=3 36 B15R2.283 Nc1ccn(CCc2ccccn2)n1 Amb13951771 [0,0,0,0,0,0|3,0,1]=4 37 B15R2.283 Nc1ccn(CCc2cccnc2)n1 Amb25282154 [0,0,0,0,0,0|3,0,1]=4 38 B15R2.283 Nc1ccn(CCc2ccncc2)n1 Amb13951916 [0,0,0,0,0,0|3,0,1]=4 39 B15R2.283 Nc1cn(CCc2ccccc2)cn1 Amb18821444 [0,0,0,0,0,0|3,0,1]=4 40 B15R2.283 Nc1cn(CCc2ccccc2)nn1 Amb26377437 [0,0,0,0,0,0|4,0,0]=4 41 B15R2.283 Nc1cnc(CCc2ccccc2)o1 Amb18564480 [0,0,0,0,0,0|3,0,1]=4 42 B15R2.283 Nc1cnn(CCc2ccccc2)c1 Amb6667049 [0,0,0,0,0,0|4,0,0]=4 43 B15R2.283 Nc1cnn(CCc2ccccc2)n1 Amb32702378 [0,0,0,0,0,0|3,0,0]=3 44 B15R2.283 Nc1cnn(CCc2ccccn2)n1 Amb32702360 [0,0,0,0,0,0|4,0,0]=4 45 B15R2.283 Nc1cnn(CCc2cccnc2)n1 Amb32702346 [0,0,0,0,0,0|4,0,0]=4 46 B15R2.283 Nc1cnn(CCc2ccncc2)n1 Amb32702278 [0,0,0,0,0,0|4,0,0]=4 47 B15R2.283 Nc1csc(CCc2ccccc2)n1 Amb28341882 [0,0,0,0,0,0|2,0,1]=3 48 B15R2.283 Nc1csc(CCc2ccccn2)n1 Amb35723208 [0,0,0,0,0,0|3,0,1]=4 49 B15R2.283 Nc1nc(CCc2ccccc2)cs1 Amb17238165 [0,0,0,0,0,0|0,1,2]=3 50 B15R2.283 Nc1nc(CCc2ccccc2)ns1 Amb18292122 [0,0,0,0,0,0|1,1,1]=3 51 B15R2.283 Nc1nc(CCc2ccccn2)cs1 Amb28204026 [0,0,0,0,0,0|1,1,2]=4 52 B15R2.283 Nc1nc(CCc2ccccn2)no1 Amb35722902 [0,0,0,0,0,0|2,0,1]=3 53 B15R2.283 Nc1nc(CCc2ccccn2)ns1 Amb35723101 [0,0,0,0,0,0|2,1,1]=4 54 B15R2.283 Nc1nc(CCc2cccnc2)cs1 Amb17238469 [0,0,0,0,0,0|1,1,2]=4 55 B15R2.283 Nc1nc(CNc2ccccc2)cs1 Amb18865210 [0,0,0,0,0,0|1,1,2]=4 56 B15R2.283 Nc1nc(COc2ccccc2)cs1 Amb32671106 [0,0,0,0,0,0|1,1,2]=4 57 B15R2.283 Nc1nc(COc2ccccc2)cs1 Amb33526374 [0,0,0,0,0,0|1,1,2]=4 58 B15R2.283 Nc1nc(COc2ccccc2)no1 Amb18995138 [0,0,0,0,0,0|2,0,1]=3 59 B15R2.283 Nc1nc(COc2ccccc2)ns1 Amb18300287 [0,0,0,0,0,0|2,1,1]=4 60 B15R2.283 Nc1nc(CSc2ccccc2)cs1 Amb8830551 [0,0,0,0,0,0|1,1,2]=4 61 B15R2.283 Nc1nc(NCc2ccccc2)no1 Amb27968590 [0,0,0,0,0,0|2,0,1]=3 62 B15R2.283 Nc1nc(OCc2ccccc2)ns1 Amb27827438 [0,0,0,0,0,0|2,1,1]=4 63 B15R2.283 Nc1nc(SCc2ccccc2)ns1 Amb6356913 [0,0,0,0,0,0|2,1,1]=4 64 B15R2.283 Nc1ncc(CCc2ccccc2)o1 Amb27645227 [0,0,0,0,0,0|2,0,2]=4 65 B15R2.283 Nc1ncn(CCc2ccccc2)n1 Amb19747703 [0,0,0,0,0,0|2,0,1]=3 66 B15R2.283 Nc1ncn(CCc2ccccn2)n1 Amb18289543 [0,0,0,0,0,0|3,0,1]=4 67 B15R2.283 Nc1ncn(CCc2cccnc2)n1 Amb25850614 [0,0,0,0,0,0|3,0,1]=4 68 B15R2.283 Nc1ncn(CCc2ccncc2)n1 Amb18969779 [0,0,0,0,0,0|3,0,1]=4 69 B15R2.283 Nc1nnc(CCc2ccccc2)o1 Amb6247414 [0,0,0,0,0,0|3,0,1]=4 70 B15R2.283 Nc1nnc(CCc2ccccc2)s1 Amb1802863 [0,0,0,0,0,0|3,0,1]=4 71 B15R2.283 Nc1noc(NCc2ccccc2)n1 Amb27478077 [0,0,0,0,0,0|3,0,1]=4 72 B15R2.283 Nc1nsc(CCc2ccncc2)n1 Amb27879322 [0,0,0,0,0,0|3,0,1]=4 73 B15R2.283 Nc1nsc(OCc2ccccc2)n1 Amb27428940 [0,0,0,0,0,0|3,0,1]=4 74 B15R2.283 Nc1nsc(SCc2ccccc2)n1 Amb2684329 [0,0,0,0,0,0|3,0,1]=4 75 B15R2.283 O=C1C=C(NCc2ccccc2)CO1 Amb23562822 [0,0,0,0,0,0|3,0,1]=4 76 B15R2.283 O=C1CC(CCc2ccccc2)CN1 Amb26954493 [0,0,0,0,0,0|3,0,0]=3 77 B15R2.283 O=C1CC(CCc2ccccc2)NN1 Amb29862137 [0,0,0,0,0,0|4,0,0]=4 78 B15R2.283 O=C1CC(NCc2ccccc2)CN1 Amb27824136 [0,0,0,0,0,0|4,0,0]=4 79 B15R2.283 O=C1CC(SCc2ccccc2)CN1 Amb28408803 [0,0,0,0,0,0|4,0,0]=4 80 B15R2.283 O=C1CCC(CCc2ccccc2)C1 Amb28124539 [0,0,0,0,0,0|3,0,0]=3 81 B15R2.283 O=C1CCC(CCc2ccccc2)N1 Amb27596663 [0,0,0,0,0,0|2,0,1]=3 82 B15R2.283 O=C1CCC(OCc2ccccc2)C1 Amb27465409 [0,0,0,0,0,0|4,0,0]=4 83 B15R2.283 O=C1CCN(CCc2ccccc2)C1 Amb8947966 [0,0,0,0,0,0|4,0,0]=4 84 B15R2.283 O=C1CC[C@@H](COc2ccccc2)N1 Amb27960874 [0,0,0,0,0,0|3,0,1]=4 85 B15R2.283 O=C1COC(CCc2ccccc2)C1 Amb35722230 [0,0,0,0,0,0|4,0,0]=4 86 B15R2.283 O=C1CSC(CCc2ccccc2)=N1 Amb4381581 [0,0,0,0,0,0|3,0,1]=4 87 B15R2.283 O=C1NC(CCc2ccccc2)CO1 Amb25217512 [0,0,0,0,0,0|1,0,1]=2 88 B15R2.283 O=C1NC(\C=C\c2ccccc2)CO1 Amb33081796 [0,0,0,0,0,0|1,0,3]=4 89 B15R2.283 O=C1NCC(CCc2ccccc2)O1 Amb27662552 [0,0,0,0,0,0|3,0,0]=3 90 B15R2.283 O=C1NCC(CNc2ccccc2)O1 Amb25082861 [0,0,0,0,0,0|4,0,0]=4 91 B15R2.283 O=C1NCC(COc2ccccc2)O1 Amb25861694 [0,0,0,0,0,0|4,0,0]=4 92 B15R2.283 O=C1NCC(CSc2ccccc2)O1 Amb25756159 [0,0,0,0,0,0|4,0,0]=4 93 B15R2.283 O=C1N[C@@H](C#Cc2ccccc2)CO1 Amb27849997 [0,0,0,0,0,0|1,0,3]=4 94 B15R2.283 O=C1OCC(CNc2ccccc2)O1 Amb28137905 [0,0,0,0,0,0|3,0,0]=3 95 B15R2.283 O=S1OCC(COc2ccccc2)O1 Amb3483030 [0,0,0,0,0,0|4,0,0]=4 96 B15R2.283 OC1CCC(CCc2ccccc2)O1 Amb22752565 [0,0,0,0,0,0|3,0,1]=4 97 B15R2.283 OC1CC[C@@H](CCc2ccccc2)O1 Amb28190302 [0,0,0,0,0,0|3,0,1]=4 98 B15R2.283 Oc1csc(CCc2ccccc2)n1 Amb27418813 [0,0,0,0,0,0|3,0,1]=4 99 B15R2.283 S=C1NC(CCc2ccccc2)CO1 Amb28241411 [0,0,0,0,0,0|1,0,1]=2 100 B15R2.283 S=C1NCC(CCc2ccccc2)O1 Amb28046293 [0,0,0,0,0,0|3,0,0]=3 101 B15R2.283 Sc1nc(CCc2ccccc2)no1 Amb27419282 [0,0,0,0,0,0|2,0,1]=3 102 B15R2.283 Sc1nc(CCc2ccccn2)no1 Amb35723065 [0,0,0,0,0,0|3,0,1]=4 103 B15R2.283 Sc1nc(COc2ccccc2)no1 Amb27419283 [0,0,0,0,0,0|3,0,1]=4 104 B14R2.101 C1=CC(CCc2ccccc2)NC1 Amb27493633 [1,0,0,0,0,0|3,0,0]=4 105 B14R2.101 C1=CCC(CCc2ccccn2)C1 Amb29888612 [1,0,0,0,0,0|3,0,0]=4 106 B14R2.101 C1=CCC(CCc2cccnc2)C1 Amb29888610 [1,0,0,0,0,0|3,0,0]=4 107 B14R2.101 C1=CCC(CCc2ccncc2)C1 Amb29888611 [1,0,0,0,0,0|3,0,0]=4 108 B14R2.101 C1=CCC(COc2ccccc2)C1 Amb35629192 [1,0,0,0,0,0|3,0,0]=4 109 B14R2.101 C1=CCC(NCc2ccccc2)C1 Amb27414910 [1,0,0,0,0,0|3,0,0]=4 110 B14R2.101 C1=CCC(OCc2ccccc2)C1 Amb25786312 [1,0,0,0,0,0|3,0,0]=4 111 B14R2.101 C1=C[C@H](NCc2ccccc2)CC1 Amb27608598 [1,0,0,0,0,0|3,0,0]=4 112 B14R2.101 c1ccc(CCC2=NCCC2)cc1 Amb17619263 [1,0,0,0,0,0|1,0,2]=4 113 B14R2.101 c1ccc(CCC2CCCN2)cc1 Amb10609225 [1,0,0,0,0,0|1,0,2]=4 114 B14R2.101 c1ccc(CCC2CCCN2)cc1 Amb3788238 [1,0,0,0,0,0|1,0,2]=4 115 B14R2.101 c1ccc(CCC2CCNC2)cc1 Amb3940961 [1,0,0,0,0,0|2,0,1]=4 116 B14R2.101 c1ccc(CC[C@@H]2CCCN2)cc1 Amb27647579 [1,0,0,0,0,0|1,0,2]=4 117 B14R2.101 c1ccc(CC[C@@H]2CCNC2)cc1 Amb27607109 [1,0,0,0,0,0|2,0,1]=4 118 B14R2.101 c1ccc(CC[C@H]2CCNC2)cc1 Amb28243392 [1,0,0,0,0,0|2,0,1]=4 119 B14R2.101 c1ccc(CCc2nccs2)cc1 Amb28122204 [1,0,0,0,0,0|2,0,1]=4 120 B14R2.101 c1ccc(CCc2ncon2)cc1 Amb27951724 [1,0,0,0,0,0|1,0,1]=3 121 B14R2.101 c1ccc(CCn2cccn2)cc1 Amb20622458 [1,0,0,0,0,0|2,0,1]=4 122 B14R2.101 c1ccc(CCn2cncn2)cc1 Amb20622454 [1,0,0,0,0,0|2,0,1]=4 123 B14R2.101 c1ccc(CNC2CCOC2)cc1 Amb22490250 [1,0,0,0,0,0|2,0,1]=4 124 B14R2.101 c1ccc(CSC2CCOC2)cc1 Amb27586140 [1,0,0,0,0,0|2,0,1]=4 125 B14R2.101 c1ccc(NCC2CCOC2)cc1 Amb9739162 [1,0,0,0,0,0|2,0,1]=4 126 B16R2.137 Cc1ccc(CCc2cc(N)on2)cc1 Amb17237461 [0,1,0,0,0,0|2,0,1]=4 127 B16R2.137 Cc1ccc(CCc2csc(N)n2)cc1 Amb17243354 [0,1,0,0,0,0|0,1,2]=4 128 B16R2.137 Cc1nc(CCc2ccc(Br)cc2)no1 Amb18884756 [0,1,0,0,0,0|2,0,1]=4 129 B16R2.137 Cc1nc(CCc2ccc(N)cc2)no1 Amb18864795 [0,1,0,0,0,0|2,0,1]=4 130 B16R2.137 Nc1cc(CCc2ccc(Br)cc2)no1 Amb17272559 [0,1,0,0,0,0|2,0,1]=4 131 B16R2.137 Nc1cc(CCc2ccc(Cl)cc2)no1 Amb17245904 [0,1,0,0,0,0|2,0,1]=4 132 B16R2.137 Nc1cc(CCc2ccc(F)cc2)no1 Amb17238772 [0,1,0,0,0,0|2,0,1]=4 133 B16R2.137 Nc1cc(CCc2ccc(O)cc2)no1 Amb15694904 [0,1,0,0,0,0|2,0,1]=4 134 B16R2.137 Nc1ccn(CCc2ccc(Cl)cc2)n1 Amb32705551 [0,1,0,0,0,0|2,0,1]=4 135 B16R2.137 Nc1cnn(CCc2ccc(Cl)cc2)n1 Amb32702706 [0,1,0,0,0,0|3,0,0]=4 136 B16R2.137 Nc1nc(CCc2ccc(Br)cc2)cs1 Amb17283819 [0,1,0,0,0,0|0,1,2]=4 137 B16R2.137 Nc1nc(CCc2ccc(Cl)cc2)cs1 Amb17254504 [0,1,0,0,0,0|0,1,2]=4 138 B16R2.137 Nc1nc(CCc2ccc(F)cc2)cs1 Amb17245424 [0,1,0,0,0,0|0,1,2]=4 139 B16R2.137 Nc1ncn(CCc2ccc(Cl)cc2)n1 Amb32705552 [0,1,0,0,0,0|2,0,1]=4 140 B16R2.137 O=C1CC(CCc2ccc(Br)cc2)CN1 Amb33331659 [0,1,0,0,0,0|3,0,0]=4 141 B16R2.137 O=C1CC(CCc2ccc(F)cc2)CN1 Amb33171835 [0,1,0,0,0,0|3,0,0]=4 142 B16R2.137 O=C1NC(CCc2ccc(Br)cc2)CO1 Amb33334086 [0,1,0,0,0,0|1,0,1]=3 143 B16R2.137 O=C1NC(CCc2ccc(F)cc2)CO1 Amb33319343 [0,1,0,0,0,0|1,0,1]=3 144 B16R2.137 O=C1NCC(CCc2ccc(Br)cc2)O1 Amb33334087 [0,1,0,0,0,0|3,0,0]=4 145 B16R2.137 O=C1NCC(CCc2ccc(F)cc2)O1 Amb33319342 [0,1,0,0,0,0|3,0,0]=4 146 B16R2.258 Cc1cccc(CCc2cc(N)on2)c1 Amb17237459 [0,1,0,0,0,0|2,0,1]=4 147 B16R2.258 Cc1cccc(CCc2csc(N)n2)c1 Amb17243353 [0,1,0,0,0,0|0,1,2]=4 148 B16R2.258 Cc1nc(CCc2cccc(Br)c2)no1 Amb18884753 [0,1,0,0,0,0|2,0,1]=4 149 B16R2.258 Cc1nc(CCc2cccc(N)c2)no1 Amb18864792 [0,1,0,0,0,0|2,0,1]=4 150 B16R2.258 Nc1cc(CCc2cccc(Br)c2)no1 Amb17272557 [0,1,0,0,0,0|2,0,1]=4 151 B16R2.258 Nc1cc(CCc2cccc(Cl)c2)no1 Amb17245902 [0,1,0,0,0,0|2,0,1]=4 152 B16R2.258 Nc1nc(CCc2cccc(Br)c2)cs1 Amb17283818 [0,1,0,0,0,0|0,1,2]=4 153 B16R2.258 Nc1nc(CCc2cccc(Cl)c2)cs1 Amb17254503 [0,1,0,0,0,0|0,1,2]=4 154 B16R2.258 O=C1CC(CCc2cccc(Br)c2)CN1 Amb33433771 [0,1,0,0,0,0|3,0,0]=4 155 B16R2.258 O=C1NC(CCc2cccc(Br)c2)CO1 Amb33433767 [0,1,0,0,0,0|1,0,1]=3 156 B16R2.258 O=C1NCC(CCc2cccc(Br)c2)O1 Amb33433778 [0,1,0,0,0,0|3,0,0]=4 157 B16R2.2334 ClCc1nc(CCc2ccccc2)no1 Amb20623100 [0,1,0,0,0,0|2,0,1]=4 158 B16R2.2334 NCc1csc(CCc2ccccc2)n1 Amb19015877 [0,1,0,0,0,0|2,0,1]=4 159 B16R2.2334 NCc1nc(CCc2ccccc2)cs1 Amb17243350 [0,1,0,0,0,0|0,1,2]=4 160 B16R2.2334 NCc1nc(CCc2ccccc2)cs1 Amb22035164 [0,1,0,0,0,0|0,1,2]=4 161 B16R2.2334 NCc1nc(CCc2ccccc2)no1 Amb19015873 [0,1,0,0,0,0|1,0,1]=3 162 B16R2.2334 NCc1nc(COc2ccccc2)no1 Amb10789058 [0,1,0,0,0,0|2,0,1]=4 163 B16R2.2334 NCc1nc(COc2ccccc2)no1 Amb15740915 [0,1,0,0,0,0|2,0,1]=4 164 B16R2.2334 NCc1noc(CCc2ccccc2)n1 Amb9173381 [0,1,0,0,0,0|2,0,1]=4 165 B16R2.2829 CC(Cn1ccc(N)n1)c2ccccc2 Amb20674793 [0,1,0,0,0,0|2,0,1]=4 166 B16R2.2829 CC(Cn1cnc(N)n1)c2ccccc2 Amb32704319 [0,1,0,0,0,0|2,0,1]=4 167 B16R2.2829 CC(Cn1ncc(N)n1)c2ccccc2 Amb32702666 [0,1,0,0,0,0|3,0,0]=4 168 B16R2.2843 CC(Cc1ccccc1)N2C=C(N)O[NH2+]2 Amb19959996 [0,1,0,0,0,0|3,0,0]=4 169 B16R2.2884 Cc1cn(CCc2ccccc2)nc1N Amb32701789 [0,1,0,0,0,0|2,0,1]=4 170 B16R2.2884 Nc1nn(CCc2ccccc2)cc1Br Amb32701790 [0,1,0,0,0,0|2,0,1]=4 171 B16R2.2884 Nc1nn(CCc2ccccc2)cc1Cl Amb32701786 [0,1,0,0,0,0|2,0,1]=4 172 B16R2.2904 Cc1cc(N)nn1CCc2ccccc2 Amb32701788 [0,1,0,0,0,0|2,0,1]=4 173 B16R2.2904 Nc1nc(Br)n(CCc2ccccc2)n1 Amb32701791 [0,1,0,0,0,0|2,0,1]=4 174 B16R2.2904 O=C1CC(CCc2ccccc2)C(=O)O1 Amb32951852 [0,1,0,0,0,0|2,0,1]=4 175 B16R2.2904 O=C1N[C@H](CCc2ccccc2)C(=O)O1 Amb33625043 [0,1,0,0,0,0|1,0,2]=4 176 B16R2.5952 CC1C(=O)OC[C@@H]1NCc2ccccc2 Amb27254279 [0,1,0,0,0,0|3,0,0]=4 177 B16R2.11414 Cc1ccccc1CCc2cc(N)on2 Amb17237457 [0,1,0,0,0,0|2,0,1]=4 178 B16R2.11414 Cc1ccccc1CCc2csc(N)n2 Amb17243352 [0,1,0,0,0,0|0,1,2]=4 179 B16R2.11414 Cc1nc(CCc2ccccc2Br)no1 Amb18884750 [0,1,0,0,0,0|2,0,1]=4 180 B16R2.11414 Cc1nc(CCc2ccccc2N)no1 Amb18864788 [0,1,0,0,0,0|2,0,1]=4 181 B16R2.11414 Nc1cc(CCc2ccccc2Cl)no1 Amb17245900 [0,1,0,0,0,0|2,0,1]=4 182 B16R2.11414 Nc1cc(CCc2ccccc2F)no1 Amb17238770 [0,1,0,0,0,0|2,0,1]=4 183 B16R2.11414 Nc1nc(CCc2ccccc2Cl)cs1 Amb17254502 [0,1,0,0,0,0|0,1,2]=4 184 B16R2.11414 Nc1nc(CCc2ccccc2F)cs1 Amb17245423 [0,1,0,0,0,0|0,1,2]=4 185 B14R1.422 CC(=N)NCCOCc1ccccc1 Amb27428538 [0,0,1,0,0,0|3,0,0]=4 186 B14R1.422 CC(=O)OCCCOc1ccccc1 Amb24046251 [0,0,1,0,0,0|3,0,0]=4 187 B14R1.422 CC(=O)OCCNCc1ccccc1 Amb18929298 [0,0,1,0,0,0|3,0,0]=4 188 B14R1.422 N=C(N)NCCCCc1ccccc1 Amb32412066 [0,0,1,0,0,0|1,0,0]=2 189 B14R1.422 N=C(N)NCCOCc1ccccc1 Amb28255031 [0,0,1,0,0,0|2,0,0]=3 190 B14R1.422 N=C(N)NNCCCc1ccccc1 Amb24064219 [0,0,1,0,0,0|2,0,0]=3 191 B14R1.422 N=C(N)SCCCOc1ccccc1 Amb20675993 [0,0,1,0,0,0|1,1,0]=3 192 B14R1.422 N=C(N)SCCNCc1ccccc1 Amb27446566 [0,0,1,0,0,0|1,1,0]=3 193 B14R1.422 NC(=O)CCCOCc1ccccc1 Amb25073445 [0,0,1,0,0,0|3,0,0]=4 194 B14R1.422 NC(=O)CCNCCc1ccccc1 Amb22587630 [0,0,1,0,0,0|3,0,0]=4 195 B14R1.422 NC(=O)CCNCCc1ccccc1 Amb8511712 [0,0,1,0,0,0|3,0,0]=4 196 B14R1.422 NC(=O)CNCCCc1ccccc1 Amb6714614 [0,0,1,0,0,0|3,0,0]=4 197 B14R1.422 NC(=O)OCCC#Cc1ccccc1 Amb27975850 [0,0,1,0,0,0|1,0,2]=4 198 B14R1.422 NC(=O)OCCNCc1ccccc1 Amb28145444 [0,0,1,0,0,0|2,0,0]=3 199 B14R1.422 NC(N)=NCCNCc1ccccc1 Amb26938735 [0,0,1,0,0,0|2,0,1]=4 200 B14R1.422 O=C(O)CCCCCc1ccccc1 Amb6357124 [0,0,1,0,0,0|3,0,0]=4 201 B14R1.716 COC(=N)CCOCc1ccccc1 Amb27444424 [0,0,1,0,0,0|2,0,1]=4 202 B14R1.716 COC(=O)CCCCc1ccccc1 Amb8392132 [0,0,1,0,0,0|2,0,0]=3 203 B14R1.716 COC(=O)CCCCc1ccccn1 Amb24113266 [0,0,1,0,0,0|3,0,0]=4 204 B14R1.716 COC(=O)CCCSc1ccccc1 Amb8950459 [0,0,1,0,0,0|3,0,0]=4 205 B14R1.716 COC(=O)CCNCc1ccccc1 Amb288483 [0,0,1,0,0,0|3,0,0]=4 206 B14R1.716 COC(=O)CCNCc1ccccc1 Amb996333 [0,0,1,0,0,0|3,0,0]=4 207 B14R1.716 COC(=O)CCOCc1ccccc1 Amb7773811 [0,0,1,0,0,0|3,0,0]=4 208 B14R1.716 COC(=O)CNCCc1ccccc1 Amb6686977 [0,0,1,0,0,0|3,0,0]=4 209 B14R1.818 CC(=O)OC(C)CCc1ccccc1 Amb4034624 [0,0,1,0,0,0|2,0,1]=4 210 B14R1.818 CC(CC(=O)O)NCc1ccccc1 Amb6357298 [0,0,1,0,0,0|3,0,0]=4 211 B14R1.818 CC(CCc1ccccc1)CC(=O)O Amb6749216 [0,0,1,0,0,0|2,0,0]=3 212 B14R1.818 CC(CCc1ccccc1)NC(=N)N Amb19073485 [0,0,1,0,0,0|1,0,1]=3 213 B14R1.818 CC(CNc1ccccc1)NC(N)=O Amb28122040 [0,0,1,0,0,0|1,0,2]=4 214 B14R1.818 CN(CCc1ccccc1)CC(=O)O Amb28653100 [0,0,1,0,0,0|3,0,0]=4 215 B14R1.818 CN(CCc1ccccc1)CC(=O)O Amb9301012 [0,0,1,0,0,0|3,0,0]=4 216 B14R1.818 C[C@@H](CC(=O)O)NCc1ccccc1 Amb25124067 [0,0,1,0,0,0|3,0,0]=4 217 B14R1.818 C[C@@H](CC(=O)O)OCc1ccccc1 Amb24335959 [0,0,1,0,0,0|3,0,0]=4 218 B14R1.818 C[C@H](CC(N)=O)OCc1ccccc1 Amb27817889 [0,0,1,0,0,0|2,0,1]=4 219 B14R1.818 C\C(=C/C(=O)O)CCc1ccccc1 Amb6749184 [0,0,1,0,0,0|2,0,1]=4 220 B14R1.818 NC(CCc1ccccc1)CC(=O)O Amb1993736 [0,0,1,0,0,0|3,0,0]=4 221 B14R1.818 NC(CCc1ccccc1)CC(=O)O Amb30117911 [0,0,1,0,0,0|3,0,0]=4 222 B14R1.818 N[C@@H](CCc1ccccc1)CC(=O)O Amb19887670 [0,0,1,0,0,0|3,0,0]=4 223 B14R1.818 N[C@@H](CCc1ccccc1)CC(=O)O Amb22746249 [0,0,1,0,0,0|3,0,0]=4 224 B14R1.818 N[C@H](CCc1ccccc1)CC(=O)O Amb16231748 [0,0,1,0,0,0|3,0,0]=4 225 B14R1.818 N[C@H](CCc1ccccc1)CC(=O)O Amb19888418 [0,0,1,0,0,0|3,0,0]=4 226 B14R1.979 C=CCC(CO)NCc1ccccc1 Amb27974205 [0,0,1,0,0,0|3,0,0]=4 227 B14R1.979 C=CC[C@@H](CO)OCc1ccccc1 Amb27457713 [0,0,1,0,0,0|3,0,0]=4 228 B14R1.979 O=CCC(CO)OCc1ccccc1 Amb27388283 [0,0,1,0,0,0|3,0,0]=4 229 B16R3.335 CC1CC2CCc3ccccc3C2O1 Amb27759473 [0,0,0,1,0,0|2,0,1]=4 230 B16R3.335 N=C1NC2c3ccccc3CCC2O1 Amb27234696 [0,0,0,1,0,0|2,0,1]=4 231 B16R3.335 Nc1nc-2n(n1)CCc3ccccc32 Amb28385733 [0,0,0,1,0,0|2,0,1]=4 232 B16R3.335 Nc1nc2c(s1)-c3ccccc3CC2 Amb8564018 [0,0,0,1,0,0|0,1,2]=4 233 B16R3.335 O=C1C[C@@H]2CCc3ccccc3[C@H]2N1 Amb28435678 [0,0,0,1,0,0|3,0,0]=4 234 B16R3.335 O=C1C[C@@H]2CCc3ccccc3[C@H]2O1 Amb28463677 [0,0,0,1,0,0|2,0,0]=3 235 B16R3.335 S=C1NC2CCc3ccccc3C2N1 Amb27234676 [0,0,0,1,0,0|2,0,1]=4 236 B16R3.335 S=C1NC2c3ccccc3CCC2O1 Amb28364985 [0,0,0,1,0,0|3,0,0]=4 237 B16R3.335 S=C1N[C@H]2c3ccccc3CC[C@H]2N1 Amb27879542 [0,0,0,1,0,0|2,0,1]=4 238 B16R3.335 [C@@H]12CCc3ccccc3[C@@H]1OC(=O)C2 Amb17778862 [0,0,0,1,0,0|2,0,0]=3 239 B16R3.2022 Clc1nc(C2Cc3ccccc32)no1 Amb27250513 [0,0,0,1,0,0|2,0,1]=4 240 B16R3.2022 Nc1nc(C2Cc3ccccc32)no1 Amb27417622 [0,0,0,1,0,0|1,0,1]=3 241 B16R3.6018 c1ccc(CC2NC3CCC2C3)cc1 Amb18821343 [0,0,0,1,0,0|2,0,1]=4 242 B16R3.10764 O=C1CC2(CCc3ccccc32)CN1 Amb27784092 [0,0,0,1,0,0|3,0,0]=4 243 B16R3.10764 O=C1NC2(CCc3ccccc32)CO1 Amb27391879 [0,0,0,1,0,0|1,0,1]=3 244 B16R3.10764 O=C1NCC2(CCc3ccccc32)O1 Amb27594579 [0,0,0,1,0,0|3,0,0]=4 245 B16R3.17392 O=C1NC[C@@H]2CCc3ccccc3[C@H]12 Amb28321280 [0,0,0,1,0,0|3,0,0]=4 246 B16R3.17392 O=C1OCC2CNc3ccccc3N12 Amb27481854 [0,0,0,1,0,0|2,0,1]=4 247 B14R2.19 CC1=NC(Cc2ccccc2)CO1 Amb26964500 [0,0,0,0,1,0|1,0,0]=2 248 B14R2.19 Cc1nc(Cc2ccccc2)no1 Amb25760165 [0,0,0,0,1,0|2,0,1]=4 249 B14R2.19 NC1=NC(Cc2ccccc2)CO1 Amb23449444 [0,0,0,0,1,0|0,0,0]=1 250 B14R2.19 NC1=NC(Cc2ccccc2)CS1 Amb27400638 [0,0,0,0,1,0|0,1,0]=2 251 B14R2.19 NC1=NCC(Cc2ccccc2)N1 Amb27800741 [0,0,0,0,1,0|1,0,1]=3 252 B14R2.19 NC1=N[C@H](Cc2ccccc2)CO1 Amb27464486 [0,0,0,0,1,0|0,0,0]=1 253 B14R2.19 NC1CCC(Cc2ccccc2)C1 Amb25337996 [0,0,0,0,1,0|2,0,1]=4 254 B14R2.19 Nc1c[n+](Cc2ccccc2)no1 Amb19650260 [0,0,0,0,1,0|3,0,0]=4 255 B14R2.19 Nc1cc(Cc2ccccc2)no1 Amb17233004 [0,0,0,0,1,0|2,0,1]=4 256 B14R2.19 Nc1ccn(Cc2ccccc2)n1 Amb33527734 [0,0,0,0,1,0|2,0,1]=4 257 B14R2.19 Nc1ccn(Cc2ccccc2)n1 Amb33548704 [0,0,0,0,1,0|2,0,1]=4 258 B14R2.19 Nc1cnn(Cc2ccccc2)n1 Amb18197582 [0,0,0,0,1,0|3,0,0]=4 259 B14R2.19 Nc1nc(Cc2ccccc2)co1 Amb22499416 [0,0,0,0,1,0|0,0,2]=3 260 B14R2.19 Nc1nc(Cc2ccccc2)cs1 Amb1264076 [0,0,0,0,1,0|0,1,2]=4 261 B14R2.19 Nc1nc(Cc2ccccc2)ns1 Amb33531825 [0,0,0,0,1,0|1,1,1]=4 262 B14R2.19 Nc1nc(Cc2ccncc2)no1 Amb18962280 [0,0,0,0,1,0|2,0,1]=4 263 B14R2.19 Nc1ncn(Cc2ccccc2)n1 Amb1946393 [0,0,0,0,1,0|2,0,1]=4 264 B14R2.19 Nc1nnn(Cc2ccccc2)n1 Amb358621 [0,0,0,0,1,0|3,0,0]=4 265 B14R2.19 Nc1noc(Cc2ccccc2)n1 Amb33541789 [0,0,0,0,1,0|2,0,1]=4 266 B14R2.19 O=C1CC(Cc2ccccc2)CN1 Amb10608007 [0,0,0,0,1,0|3,0,0]=4 267 B14R2.19 O=C1CC(Cc2ccccc2)CO1 Amb8487117 [0,0,0,0,1,0|2,0,0]=3 268 B14R2.19 O=C1CC(Nc2ccccc2)CO1 Amb27415556 [0,0,0,0,1,0|3,0,0]=4 269 B14R2.19 O=C1CCC(Cc2ccccc2)C1 Amb24455173 [0,0,0,0,1,0|3,0,0]=4 270 B14R2.19 O=C1CCC(Cc2ccccc2)N1 Amb6404055 [0,0,0,0,1,0|2,0,1]=4 271 B14R2.19 O=C1CCC(Cc2ccccc2)O1 Amb20669272 [0,0,0,0,1,0|3,0,0]=4 272 B14R2.19 O=C1CN(Cc2ccccc2)CO1 Amb27861590 [0,0,0,0,1,0|3,0,0]=4 273 B14R2.19 O=C1C[C@@H](Cc2ccccc2)CN1 Amb27777300 [0,0,0,0,1,0|3,0,0]=4 274 B14R2.19 O=C1NC(Cc2ccccc2)CO1 Amb9809273 [0,0,0,0,1,0|1,0,1]=3 275 B14R2.19 O=C1NC(Cc2ccccc2)CS1 Amb27618346 [0,0,0,0,1,0|1,1,1]=4 276 B14R2.19 O=C1NC(Cc2ccncc2)CO1 Amb27607810 [0,0,0,0,1,0|2,0,1]=4 277 B14R2.19 O=C1NCC(Cc2ccccc2)N1 Amb18061673 [0,0,0,0,1,0|2,0,1]=4 278 B14R2.19 O=C1NCC(Cc2ccccc2)O1 Amb18061675 [0,0,0,0,1,0|3,0,0]=4 279 B14R2.19 O=C1NC[C@H](Cc2ccccc2)N1 Amb27772403 [0,0,0,0,1,0|2,0,1]=4 280 B14R2.19 O=C1N[C@@H](Cc2ccccc2)CO1 Amb2725669 [0,0,0,0,1,0|1,0,1]=3 281 B14R2.19 O=C1N[C@@H](Cc2ccccc2)CS1 Amb19887642 [0,0,0,0,1,0|1,1,1]=4 282 B14R2.19 O=C1N[C@H](Cc2ccccc2)CO1 Amb6357181 [0,0,0,0,1,0|1,0,1]=3 283 B14R2.19 O=C1N[C@H](Cc2ccccc2)CS1 Amb19888420 [0,0,0,0,1,0|1,1,1]=4 284 B14R2.19 OC1CC(Cc2ccccc2)CO1 Amb22752560 [0,0,0,0,1,0|2,0,1]=4 285 B14R2.19 S=C1N=C(Cc2ccccc2)CS1 Amb19888437 [0,0,0,0,1,0|1,1,1]=4 286 B14R2.19 S=C1NC(Cc2ccccc2)CO1 Amb25938312 [0,0,0,0,1,0|1,0,1]=3 287 B14R2.19 S=C1NC(Cc2ccccc2)CS1 Amb24079058 [0,0,0,0,1,0|1,1,1]=4 288 B14R2.19 S=C1NCC(Cc2ccccc2)S1 Amb27798328 [0,0,0,0,1,0|3,0,0]=4 289 B14R2.19 S=C1N[C@@H](Cc2ccccc2)CO1 Amb8629174 [0,0,0,0,1,0|1,0,1]=3 290 B14R2.19 S=C1N[C@@H](Cc2ccccc2)CS1 Amb8629263 [0,0,0,0,1,0|1,1,1]=4 291 B14R2.19 S=C1N[C@H](Cc2ccccc2)CO1 Amb8629175 [0,0,0,0,1,0|1,0,1]=3 292 B14R2.19 S=C1N[C@H](Cc2ccccc2)CS1 Amb8629264 [0,0,0,0,1,0|1,1,1]=4 293 B14R2.19 Sc1nc(Cc2ccccc2)no1 Amb18317690 [0,0,0,0,1,0|2,0,1]=4 294 B14R2.31 NC1CCC1OCc2ccccc2 Amb25139601 [0,0,0,0,1,0|2,0,1]=4 295 B14R2.31 NC1CCC1OCc2ccccc2 Amb32666027 [0,0,0,0,1,0|2,0,1]=4 296 B14R2.31 N[C@@H]1CC[C@@H]1OCc2ccccc2 Amb25934784 [0,0,0,0,1,0|2,0,1]=4 297 B14R2.31 N[C@@H]1CC[C@@H]1OCc2ccccc2 Amb32663801 [0,0,0,0,1,0|2,0,1]=4 298 B14R2.31 N[C@@H]1CC[C@H]1OCc2ccccc2 Amb26582792 [0,0,0,0,1,0|2,0,1]=4 299 B14R2.31 N[C@@H]1CC[C@H]1OCc2ccccc2 Amb32663871 [0,0,0,0,1,0|2,0,1]=4 300 B14R2.31 O=C1CCC1OCc2ccccc2 Amb22896544 [0,0,0,0,1,0|3,0,0]=4 301 B14R2.31 O=C1CC[C@@H]1OCc2ccccc2 Amb24494962 [0,0,0,0,1,0|3,0,0]=4 302 B14R2.31 O=C1CC[C@H]1OCc2ccccc2 Amb27972934 [0,0,0,0,1,0|3,0,0]=4 303 B14R2.31 O=C1NCC1OCc2ccccc2 Amb27969209 [0,0,0,0,1,0|3,0,0]=4 304 B14R2.31 OC1CCC1CCc2ccccc2 Amb32944290 [0,0,0,0,1,0|2,0,1]=4 305 B14R2.252 O=C1NC(CCc2ccco2)CO1 Amb28068858 [0,0,0,0,1,0|2,0,1]=4 306 B14R2.252 O=C1NC(CCc2ccsc2)CO1 Amb33320873 [0,0,0,0,1,0|2,0,1]=4 307 B14R2.436 C=C1CC(OCc2ccccc2)C1 Amb25911266 [0,0,0,0,1,0|3,0,0]=4 308 B14R2.436 NC1CC(CCc2ccccc2)C1 Amb27415257 [0,0,0,0,1,0|1,0,1]=3 309 B14R2.436 NC1CC(CNc2ccccc2)C1 Amb35644417 [0,0,0,0,1,0|2,0,1]=4 310 B14R2.436 NC1CC(COc2ccccc2)C1 Amb29890773 [0,0,0,0,1,0|2,0,1]=4 311 B14R2.436 NC1CC(COc2ccccc2)C1 Amb35752102 [0,0,0,0,1,0|2,0,1]=4 312 B14R2.436 NC1CC(CSc2ccccc2)C1 Amb29892547 [0,0,0,0,1,0|2,0,1]=4 313 B14R2.436 NC1CC(NCc2ccccc2)C1 Amb27609504 [0,0,0,0,1,0|2,0,1]=4 314 B14R2.436 NC1CC(OCc2ccccc2)C1 Amb20242212 [0,0,0,0,1,0|2,0,1]=4 315 B14R2.436 NC1CC(OCc2ccccc2)C1 Amb33156925 [0,0,0,0,1,0|2,0,1]=4 316 B14R2.436 NC1CN(CCc2ccccc2)C1 Amb28318498 [0,0,0,0,1,0|2,0,1]=4 317 B14R2.436 N[C@H]1C[C@@H](CNc2ccccc2)C1 Amb30040082 [0,0,0,0,1,0|2,0,1]=4 318 B14R2.436 N[C@H]1C[C@@H](COc2ccccc2)C1 Amb35751614 [0,0,0,0,1,0|2,0,1]=4 319 B14R2.436 N[C@H]1C[C@@H](COc2ccccc2)C1 Amb35753087 [0,0,0,0,1,0|2,0,1]=4 320 B14R2.436 N[C@H]1C[C@@H](OCc2ccccc2)C1 Amb22746995 [0,0,0,0,1,0|2,0,1]=4 321 B14R2.436 N[C@H]1C[C@@H](OCc2ccccc2)C1 Amb30526921 [0,0,0,0,1,0|2,0,1]=4 322 B14R2.436 N[C@H]1C[C@H](CNc2ccccc2)C1 Amb29880060 [0,0,0,0,1,0|2,0,1]=4 323 B14R2.436 N[C@H]1C[C@H](COc2ccccc2)C1 Amb35749919 [0,0,0,0,1,0|2,0,1]=4 324 B14R2.436 N[C@H]1C[C@H](COc2ccccc2)C1 Amb35752132 [0,0,0,0,1,0|2,0,1]=4 325 B14R2.436 N[C@H]1C[C@H](OCc2ccccc2)C1 Amb22746997 [0,0,0,0,1,0|2,0,1]=4 326 B14R2.436 N[C@H]1C[C@H](OCc2ccccc2)C1 Amb22746998 [0,0,0,0,1,0|2,0,1]=4 327 B14R2.436 O=C1CC(CCc2ccccc2)C1 Amb27235487 [0,0,0,0,1,0|2,0,0]=3 328 B14R2.436 O=C1CC(OCc2ccccc2)C1 Amb10844904 [0,0,0,0,1,0|3,0,0]=4 329 B14R2.436 O=C1C[C@@H](CCc2ccccc2)N1 Amb27413661 [0,0,0,0,1,0|1,0,1]=3 330 B14R2.436 O=C1C[C@H](CCc2ccccc2)N1 Amb27206618 [0,0,0,0,1,0|1,0,1]=3 331 B16R2.132 NC1=NNC(CCc2ccccc2)=NN1 Amb20414087 [0,0,0,0,0,1|2,0,1]=4 332 B16R2.132 NN1CCC(CCc2ccccc2)CC1 Amb31129306 [0,0,0,0,0,1|3,0,0]=4 333 B16R2.132 Nc1cnc(CCc2ccccc2)nc1 Amb17486617 [0,0,0,0,0,1|2,0,1]=4 334 B16R2.132 SC1=NCN(CCc2ccccc2)CN1 Amb9833293 [0,0,0,0,0,1|3,0,0]=4 335 B16R2.252 O=C1CCNC(CCc2ccccc2)C1 Amb18785348 [0,0,0,0,0,1|3,0,0]=4 336 B16R2.252 O=C1CCOC(CCc2ccccc2)C1 Amb27809160 [0,0,0,0,0,1|3,0,0]=4 337 B16R2.252 O=C1COCC(CCc2ccncc2)N1 Amb33035794 [0,0,0,0,0,1|2,0,1]=4 338 B16R2.2832 Brc1nc(CCCc2ccccc2)co1 Amb33129301 [0,0,0,0,0,1|1,0,2]=4 339 B16R2.2832 Ic1nc(CCCc2ccccc2)co1 Amb33129302 [0,0,0,0,0,1|1,0,2]=4 340 B16R2.2832 NC1CCC(COCc2ccccc2)C1 Amb27767204 [0,0,0,0,0,1|2,0,1]=4 341 B16R2.2832 N[C@H]1CC[C@@H](CNCc2ccccc2)C1 Amb33071898 [0,0,0,0,0,1|2,0,1]=4 342 B16R2.2832 N[C@H]1CC[C@@H](COCc2ccccc2)C1 Amb28204069 [0,0,0,0,0,1|2,0,1]=4 343 B16R2.2832 Nc1cc(CCOc2ccccc2)no1 Amb17238019 [0,0,0,0,0,1|2,0,1]=4 344 B16R2.2832 Nc1ccn(CCCc2ccccc2)n1 Amb19018439 [0,0,0,0,0,1|2,0,1]=4 345 B16R2.2832 Nc1ccn(CCOc2ccccc2)n1 Amb20674786 [0,0,0,0,0,1|2,0,1]=4 346 B16R2.2832 Nc1ccn(CCSc2ccccc2)n1 Amb33037858 [0,0,0,0,0,1|2,0,1]=4 347 B16R2.2832 Nc1ccn(COCc2ccccc2)n1 Amb18654274 [0,0,0,0,0,1|2,0,1]=4 348 B16R2.2832 Nc1cnn(CCCc2ccccc2)n1 Amb32702542 [0,0,0,0,0,1|3,0,0]=4 349 B16R2.2832 Nc1cnn(CCOc2ccccc2)n1 Amb32702545 [0,0,0,0,0,1|3,0,0]=4 350 B16R2.2832 Nc1cnn(CCSc2ccccc2)n1 Amb32702601 [0,0,0,0,0,1|3,0,0]=4 351 B16R2.2832 Nc1cnn(COCc2ccccc2)n1 Amb33165974 [0,0,0,0,0,1|3,0,0]=4 352 B16R2.2832 Nc1csc(COCc2ccccc2)n1 Amb27955721 [0,0,0,0,0,1|2,0,1]=4 353 B16R2.2832 Nc1nc(CCCc2ccccc2)co1 Amb33129276 [0,0,0,0,0,1|0,0,2]=3 354 B16R2.2832 Nc1nc(CCCc2ccccc2)cs1 Amb33129300 [0,0,0,0,0,1|0,1,2]=4 355 B16R2.2832 Nc1nc(CCOc2ccccc2)cs1 Amb3318993 [0,0,0,0,0,1|0,1,2]=4 356 B16R2.2832 Nc1nc(CNCc2ccccc2)cs1 Amb18866843 [0,0,0,0,0,1|0,1,2]=4 357 B16R2.2832 Nc1nc(COCc2ccccc2)no1 Amb27666114 [0,0,0,0,0,1|1,0,1]=3 358 B16R2.2832 Nc1nc(COCc2ccccc2)ns1 Amb27862699 [0,0,0,0,0,1|1,1,1]=4 359 B16R2.2832 Nc1ncn(CCCc2ccccc2)n1 Amb19015585 [0,0,0,0,0,1|2,0,1]=4 360 B16R2.2832 Nc1ncn(CCOc2ccccc2)n1 Amb33037851 [0,0,0,0,0,1|2,0,1]=4 361 B16R2.2832 Nc1ncn(CCSc2ccccc2)n1 Amb33037861 [0,0,0,0,0,1|2,0,1]=4 362 B16R2.2832 Nc1ncn(COCc2ccccc2)n1 Amb25848339 [0,0,0,0,0,1|2,0,1]=4 363 B16R2.2832 O=C1CC(CCOc2ccccc2)CN1 Amb33082681 [0,0,0,0,0,1|3,0,0]=4 364 B16R2.2832 O=C1CCC(CNCc2ccccc2)N1 Amb10607307 [0,0,0,0,0,1|2,0,1]=4 365 B16R2.2832 O=C1CC[C@@H](CNCc2ccccc2)N1 Amb22586685 [0,0,0,0,0,1|2,0,1]=4 366 B16R2.2832 O=C1CC[C@H](CNCc2ccccc2)N1 Amb27201411 [0,0,0,0,0,1|2,0,1]=4 367 B16R2.2832 O=C1CC[C@H](COCc2ccccc2)N1 Amb27599959 [0,0,0,0,0,1|2,0,1]=4 368 B16R2.2832 O=C1NC(CCOc2ccccc2)CO1 Amb33080548 [0,0,0,0,0,1|1,0,1]=3 369 B16R2.2832 O=C1NC(COCc2ccccc2)CO1 Amb27646362 [0,0,0,0,0,1|1,0,1]=3 370 B16R2.2832 O=C1NCC(CCOc2ccccc2)O1 Amb33080538 [0,0,0,0,0,1|3,0,0]=4 371 B16R2.2832 O=C1NCC(COCc2ccccc2)O1 Amb534370 [0,0,0,0,0,1|3,0,0]=4 372 B16R2.2832 O=C1NC[C@@H](COCc2ccccc2)O1 Amb28068763 [0,0,0,0,0,1|3,0,0]=4 373 B16R2.2832 O=C1OCC(COCc2ccccc2)O1 Amb10071643 [0,0,0,0,0,1|2,0,0]=3 374 B16R2.2832 Sc1nc(CCCc2ccccc2)co1 Amb33129312 [0,0,0,0,0,1|1,0,2]=4 375 B13R1.28 NCCCCCCc1ccccc1 Amb17233312 [1,0,1,0,0,0|1,0,1]=4 376 B13R1.42 C=CCC(O)CCc1ccccc1 Amb8392369 [1,0,1,0,0,0|2,0,0]=4 377 B13R1.42 CC(CCO)CCc1ccccc1 Amb533017 [1,0,1,0,0,0|1,0,1]=4 378 B13R1.42 CC(CCc1ccccc1)N=C=O Amb33081222 [1,0,1,0,0,0|0,0,2]=4 379 B13R1.42 NCCC(O)CCc1ccccc1 Amb17233561 [1,0,1,0,0,0|1,0,1]=4 380 B13R1.42 NOCC(O)COc1ccccc1 Amb17104957 [1,0,1,0,0,0|2,0,0]=4 381 B13R1.337 CC(=O)CCCCc1ccccc1 Amb8392140 [1,0,1,0,0,0|2,0,0]=4 382 B13R1.337 N=C(N)NCCCc1ccccc1 Amb838721 [1,0,1,0,0,0|1,0,1]=4 383 B13R1.337 N=C(N)SCCCc1ccccc1 Amb20676023 [1,0,1,0,0,0|2,0,0]=4 384 B13R1.337 NC(=O)NCCCc1ccccc1 Amb19514748 [1,0,1,0,0,0|0,0,2]=4 385 B13R1.337 NC(=O)OCCCc1ccccc1 Amb8629108 [1,0,1,0,0,0|1,0,1]=4 386 B13R1.337 NC(=S)NCCCc1ccccc1 Amb2690319 [1,0,1,0,0,0|0,1,1]=4 387 B13R1.337 O=C(O)CCCCc1ccccc1 Amb3940028 [1,0,1,0,0,0|2,0,0]=4 388 B13R1.417 NCC(CO)NCc1ccccc1 Amb26033284 [1,0,1,0,0,0|1,0,1]=4 389 B13R1.417 NC[C@@H](CO)NCc1ccccc1 Amb22754573 [1,0,1,0,0,0|1,0,1]=4 390 B13R1.417 NC[C@H](CO)NCc1ccccc1 Amb28457218 [1,0,1,0,0,0|1,0,1]=4 391 B13R1.417 NC[C@H](CO)OCc1ccccc1 Amb28123441 [1,0,1,0,0,0|1,0,1]=4 392 B13R1.417 O=CC(CO)NCc1ccccc1 Amb27794409 [1,0,1,0,0,0|2,0,0]=4 393 B13R1.417 O=CC(CO)OCc1ccccc1 Amb16231873 [1,0,1,0,0,0|2,0,0]=4 394 B13R1.417 O=C[C@H](CO)OCc1ccccc1 Amb19930161 [1,0,1,0,0,0|2,0,0]=4 395 B15R1.962 CNC(=N)NCCOCc1ccccc1 Amb27200914 [0,1,1,0,0,0|2,0,0]=4 396 B15R1.962 N\C(CCCNCc1ccccc1)=N\O Amb27232522 [0,1,1,0,0,0|2,0,0]=4 397 B15R1.962 N\N=C(\N)SCCOCc1ccccc1 Amb28323810 [0,1,1,0,0,0|1,1,0]=4 398 B15R1.1081 CN(CCNC(=N)N)Cc1ccccc1 Amb18567807 [0,1,1,0,0,0|2,0,0]=4 399 B15R1.3664 CN(CCOCc1ccccc1)C(=N)N Amb27477002 [0,1,1,0,0,0|2,0,0]=4 400 B15R1.9084 CC(COCc1ccccc1)CC(=N)N Amb28204126 [0,1,1,0,0,0|2,0,0]=4 401 B15R1.9084 C[C@@H](COCc1ccccc1)CC(=N)N Amb27960369 [0,1,1,0,0,0|2,0,0]=4 402 B15R1.9084 C[C@H](COCc1ccccc1)CC(=N)N Amb27174327 [0,1,1,0,0,0|2,0,0]=4 403 B15R1.959 COC(=O)CCCC(N)c1ccccc1 Amb32653382 [0,1,1,0,0,0|2,0,0]=4 404 B15R1.959 COC(=O)CCCC(N)c1ccccc1 Amb33552526 [0,1,1,0,0,0|2,0,0]=4 405 B15R1.959 COC(=O)CCCC(O)c1ccccc1 Amb18627401 [0,1,1,0,0,0|2,0,0]=4 406 B15R1.964 COC(=O)CCC(N)Cc1ccccc1 Amb22059181 [0,1,1,0,0,0|2,0,0]=4 407 B15R1.964 COC(=O)CCC(N)Cc1ccccc1 Amb28872538 [0,1,1,0,0,0|2,0,0]=4 408 B15R1.1321 COC(=O)C(C)CCCc1ccccc1 Amb8392134 [0,1,1,0,0,0|2,0,0]=4 409 B15R1.1321 COC(=O)C(N)CCCc1ccccc1 Amb34912861 [0,1,1,0,0,0|2,0,0]=4 410 B15R1.1321 COC(=O)C(O)CCCc1ccccc1 Amb28963669 [0,1,1,0,0,0|2,0,0]=4 411 B15R1.1321 COC(=O)[C@H](N)CCCc1ccccc1 Amb34912871 [0,1,1,0,0,0|2,0,0]=4 412 B15R1.870 CC(CCc1ccc(Br)cc1)CC(=O)O Amb28963535 [0,1,1,0,0,0|2,0,0]=4 413 B15R1.870 CC(CCc1ccc(F)cc1)CC(=O)O Amb32954330 [0,1,1,0,0,0|2,0,0]=4 414 B15R1.870 CC(CCc1ccc(I)cc1)CC(=O)O Amb28963534 [0,1,1,0,0,0|2,0,0]=4 415 B15R1.8263 CC(CCc1cccc(Br)c1)CC(=O)O Amb33006703 [0,1,1,0,0,0|2,0,0]=4 416 B15R1.12240 CC(C)(CCc1ccccc1)CC(=O)O Amb32413149 [0,1,1,0,0,0|2,0,0]=4 417 B15R1.1285 [N-]=[N+]=NC(CO)CCc1ccc(Br)cc1 Amb33006261 [0,1,1,0,0,0|1,0,1]=4 418 B15R1.1285 [N-]=[N+]=NC(CO)CCc1ccc(F)cc1 Amb33319648 [0,1,1,0,0,0|1,0,1]=4 419 B15R1.1307 [N-]=[N+]=NC(CO)CCc1cccc(Br)c1 Amb33006677 [0,1,1,0,0,0|1,0,1]=4 420 B15R2.55 BrC1COCC1CCc2ccccc2 Amb35590030 [1,1,0,0,0,0|1,0,1]=4 421 B15R2.55 ClC1COCC1CCc2ccccc2 Amb35589945 [1,1,0,0,0,0|1,0,1]=4 422 B15R2.55 NC1COCC1CCc2ccccc2 Amb29882724 [1,1,0,0,0,0|1,0,1]=4 423 B15R2.55 O=C1COCC1CCc2ccccc2 Amb35608085 [1,1,0,0,0,0|1,0,1]=4 424 B15R2.55 OC1CC=CC1CCc2ccccc2 Amb27206492 [1,1,0,0,0,0|2,0,0]=4 425 B15R2.55 OC1COCC1CCc2ccccc2 Amb35646933 [1,1,0,0,0,0|1,0,1]=4 426 B15R2.55 O[C@H]1CC=C[C@@H]1CCc2ccccc2 Amb27197583 [1,1,0,0,0,0|2,0,0]=4 427 B15R2.64 NC(Cc1ccccc1)c2ncon2 Amb28600461 [1,1,0,0,0,0|1,0,1]=4 428 B15R2.64 NC(Cc1ccccc1)c2ncon2 Amb9421871 [1,1,0,0,0,0|1,0,1]=4 429 B15R2.64 OC(Cc1ccccc1)C2C=CCC2 Amb27594770 [1,1,0,0,0,0|2,0,0]=4 430 B15R2.100 Brc1ccc(CCC2CC=CC2)cc1 Amb35594433 [1,1,0,0,0,0|2,0,0]=4 431 B15R2.100 Cc1ccc(CCC2CC=CC2)cc1 Amb35594411 [1,1,0,0,0,0|2,0,0]=4 432 B15R2.100 Cc1ccc(OCC2CNC=N2)cc1 Amb28048703 [1,1,0,0,0,0|2,0,0]=4 433 B15R2.100 Clc1ccc(CCC2CC=CC2)cc1 Amb35644879 [1,1,0,0,0,0|2,0,0]=4 434 B15R2.100 Fc1ccc(CCC2CC=CC2)cc1 Amb29886133 [1,1,0,0,0,0|2,0,0]=4 435 B15R2.100 Ic1ccc(CCC2CC=CC2)cc1 Amb35594477 [1,1,0,0,0,0|2,0,0]=4 436 B15R2.100 Oc1ccc(CCC2CC=CC2)cc1 Amb29886118 [1,1,0,0,0,0|2,0,0]=4 437 B15R2.562 Brc1ccccc1CCC2CC=CC2 Amb35594434 [1,1,0,0,0,0|2,0,0]=4 438 B15R2.562 Cc1ccccc1CCC2CC=CC2 Amb35594403 [1,1,0,0,0,0|2,0,0]=4 439 B15R2.562 Clc1ccccc1CCC2CC=CC2 Amb35644612 [1,1,0,0,0,0|2,0,0]=4 440 B15R2.562 Fc1ccccc1CCC2CC=CC2 Amb29886135 [1,1,0,0,0,0|2,0,0]=4 441 B15R2.1117 Brc1cccc(CCC2CC=CC2)c1 Amb35594435 [1,1,0,0,0,0|2,0,0]=4 442 B15R2.1117 Cc1cccc(CCC2CC=CC2)c1 Amb35594412 [1,1,0,0,0,0|2,0,0]=4 443 B15R2.1117 Clc1cccc(CCC2CC=CC2)c1 Amb35644880 [1,1,0,0,0,0|2,0,0]=4 444 B15R2.1117 Fc1cccc(CCC2CC=CC2)c1 Amb29886131 [1,1,0,0,0,0|2,0,0]=4 445 B15R2.1117 Oc1cccc(CCC2CC=CC2)c1 Amb29886119 [1,1,0,0,0,0|2,0,0]=4 446 B15R2.1259 ClC(CC1CCOC1)c2ccccc2 Amb27960036 [1,1,0,0,0,0|1,0,1]=4 447 B15R2.1259 NC(CC1CC=CC1)c2ccccc2 Amb35645234 [1,1,0,0,0,0|2,0,0]=4 448 B15R2.1259 NC(CC1CCOC1)c2ccccc2 Amb18995894 [1,1,0,0,0,0|1,0,1]=4 449 B15R2.1259 OC(CC1CC=CC1)c2ccccc2 Amb35609856 [1,1,0,0,0,0|2,0,0]=4 450 B15R2.1259 OC(CC1CCOC1)c2ccccc2 Amb33541936 [1,1,0,0,0,0|1,0,1]=4 451 B15R2.8863 NC1(CCc2ccccc2)CC=CC1 Amb30029524 [1,1,0,0,0,0|2,0,0]=4 452 B15R2.8863 OC1(CCc2ccccc2)CCOC1 Amb20667819 [1,1,0,0,0,0|1,0,1]=4 453 B15R2.15 C=CC1=N[C@@H](Cc2ccccc2)CO1 Amb22747341 [0,1,0,0,1,0|1,0,0]=3 454 B15R2.15 COC1=NC(Cc2ccccc2)CO1 Amb22549387 [0,1,0,0,1,0|1,0,0]=3 455 B15R2.15 NCc1nc(Cc2ccccc2)no1 Amb1094153 [0,1,0,0,1,0|1,0,1]=4 456 B15R2.15 NCc1nc(Cc2ccccc2)no1 Amb13951236 [0,1,0,0,1,0|1,0,1]=4 457 B15R2.98 Cc1ccc(CC2COC(N)=N2)cc1 Amb27413652 [0,1,0,0,1,0|0,0,0]=2 458 B15R2.98 NC1=NC(Cc2ccc(F)cc2)CO1 Amb27169139 [0,1,0,0,1,0|0,0,0]=2 459 B15R2.98 NC1=NC(Cc2ccc(O)cc2)CS1 Amb28118481 [0,1,0,0,1,0|0,1,0]=3 460 B15R2.98 NC1=N[C@@H](Cc2ccc(F)cc2)CO1 Amb28204006 [0,1,0,0,1,0|0,0,0]=2 461 B15R2.98 NC1=N[C@H](Cc2ccc(O)cc2)CS1 Amb27248430 [0,1,0,0,1,0|0,1,0]=3 462 B15R2.98 Nc1ccc(CC2COC(=O)N2)cc1 Amb2613740 [0,1,0,0,1,0|1,0,1]=4 463 B15R2.98 Nc1ccc(C[C@@H]2COC(=O)N2)cc1 Amb19130394 [0,1,0,0,1,0|1,0,1]=4 464 B15R2.98 Nc1ccc(C[C@H]2COC(=O)N2)cc1 Amb8392894 [0,1,0,0,1,0|1,0,1]=4 465 B15R2.98 Nc1nc(Cc2ccc(F)cc2)no1 Amb33530581 [0,1,0,0,1,0|1,0,1]=4 466 B15R2.98 O=C1NC(Cc2ccc(Cl)cc2)CO1 Amb27166135 [0,1,0,0,1,0|1,0,1]=4 467 B15R2.98 O=C1NC(Cc2ccc(O)cc2)CO1 Amb28399035 [0,1,0,0,1,0|1,0,1]=4 468 B15R2.98 O=C1N[C@@H](Cc2ccc(O)cc2)CO1 Amb27760747 [0,1,0,0,1,0|1,0,1]=4 469 B15R2.297 CC(c1ccccc1)C2COC(=O)N2 Amb26311941 [0,1,0,0,1,0|1,0,1]=4 470 B15R2.297 CC(c1ccccc1)C2COC(N)=N2 Amb27747068 [0,1,0,0,1,0|0,0,0]=2 471 B15R2.297 CC(c1ccccc1)c2noc(N)n2 Amb35715678 [0,1,0,0,1,0|1,0,1]=4 472 B15R2.297 N[C@@H](c1ccccc1)[C@@H]2COC(=O)N2 Amb27419865 [0,1,0,0,1,0|1,0,1]=4 473 B15R2.297 N[C@H](c1ccccc1)[C@@H]2COC(=O)N2 Amb27419863 [0,1,0,0,1,0|1,0,1]=4 474 B15R2.297 O=C1NC(C(Cl)c2ccccc2)CO1 Amb28068885 [0,1,0,0,1,0|1,0,1]=4 475 B15R2.297 O=C1N[C@H](C(O)c2ccccc2)CO1 Amb28408797 [0,1,0,0,1,0|1,0,1]=4 476 B15R2.297 O=C1N[C@H]([C@@H](Cl)c2ccccc2)CO1 Amb27636941 [0,1,0,0,1,0|1,0,1]=4 477 B15R2.297 O=C1N[C@H]([C@H](Cl)c2ccccc2)CO1 Amb28053687 [0,1,0,0,1,0|1,0,1]=4 478 B15R2.305 Cc1ccccc1CN2CCC(N)=N2 Amb27479793 [0,1,0,0,1,0|2,0,0]=4 479 B15R2.305 NC1=N[C@@H](Cc2ccccc2Cl)CO1 Amb27464390 [0,1,0,0,1,0|0,0,0]=2 480 B15R2.305 Nc1nc(Cc2ccccc2Br)no1 Amb27636779 [0,1,0,0,1,0|1,0,1]=4 481 B15R2.305 Nc1nc(Cc2ccccc2F)no1 Amb18961697 [0,1,0,0,1,0|1,0,1]=4 482 B15R2.314 CC1CN(Cc2ccccc2)N=C1N Amb27469334 [0,1,0,0,1,0|2,0,0]=4 483 B15R2.325 CC1CC(N)=NN1Cc2ccccc2 Amb24696327 [0,1,0,0,1,0|2,0,0]=4 484 B15R2.325 CC1OC(N)=NC1Cc2ccccc2 Amb27226049 [0,1,0,0,1,0|0,0,0]=2 485 B15R2.325 C[C@@H]1OC(=O)N[C@H]1Cc2ccccc2 Amb27970872 [0,1,0,0,1,0|1,0,1]=4 486 B15R2.325 C[C@@H]1SC(N)=N[C@H]1Cc2ccccc2 Amb27789932 [0,1,0,0,1,0|0,1,0]=3 487 B15R2.325 C[C@H]1OC(=O)N[C@@H]1Cc2ccccc2 Amb27841327 [0,1,0,0,1,0|1,0,1]=4 488 B15R2.325 C[C@H]1OC(=O)N[C@H]1Cc2ccccc2 Amb27816387 [0,1,0,0,1,0|1,0,1]=4 489 B15R2.1115 Cc1cccc(CN2CCC(N)=N2)c1 Amb27772166 [0,1,0,0,1,0|2,0,0]=4 490 B15R2.1115 NC1=NC(Cc2cccc(Cl)c2)CO1 Amb27856140 [0,1,0,0,1,0|0,0,0]=2 491 B15R2.1115 NC1=NC(Cc2cccc(F)c2)CO1 Amb27174275 [0,1,0,0,1,0|0,0,0]=2 492 B15R2.1115 Nc1nc(Cc2cccc(Br)c2)no1 Amb28203123 [0,1,0,0,1,0|1,0,1]=4 493 B15R2.4083 CN1C(=O)OCC1Cc2ccccc2 Amb18559293 [0,1,0,0,1,0|1,0,1]=4 494 B15R2.4083 O=C1OC[C@@H](Cc2ccccc2)[C@H]1O Amb27184414 [0,1,0,0,1,0|2,0,0]=4 495 B15R2.4086 CC1(Cc2ccccc2)CN=C(N)N1 Amb27871879 [0,1,0,0,1,0|1,0,1]=4 496 B15R2.4086 C[C@@]1(Cc2ccccc2)COC(=O)N1 Amb27841747 [0,1,0,0,1,0|1,0,1]=4 497 B15R2.4086 C[N+]1(Cc2ccccc2)CCC(N)=N1 Amb27484868 [0,1,0,0,1,0|2,0,0]=4 498 B15R2.4086 NC1=NP(=O)(Oc2ccccc2)CO1 Amb27631326 [0,1,0,0,1,0|2,0,0]=4 499 B15R2.1130 CC(CC1CCC1N)c2ccccc2 Amb27422699 [0,1,0,0,1,0|1,0,1]=4 500 B15R2.596 NC1CC(C(O)Cc2ccccc2)C1 Amb35625197 [0,1,0,0,1,0|1,0,1]=4 501 B17R2.3212 O=C1CC(CCc2ccccc2)CC(=O)O1 Amb32951893 [0,1,0,0,0,1|2,0,0]=4 502 B17R2.2523 NCc1nc(CCCc2ccccc2)no1 Amb32454375 [0,1,0,0,0,1|1,0,1]=4 503 B17R2.2523 NCc1nc(COCc2ccccc2)no1 Amb25856419 [0,1,0,0,0,1|1,0,1]=4 504 B17R2.5296 O=C1NC(CCOc2cccc(F)c2)CO1 Amb33416616 [0,1,0,0,0,1|1,0,1]=4 505 B17R2.4579 CCNC1=NC(OCc2ccccc2)CN1 Amb27788806 [0,2,0,0,0,0|2,0,0]=4 506 B17R2.6039 CCN(C[C@H]1COC(N)=N1)c2ccccc2 Amb33863359 [0,2,0,0,0,0|1,0,0]=3 507 B15R2.355 NC1COC(=O)C1Cc2ccccc2 Amb27640196 [0,0,1,1,0,0|1,0,1]=4 508 B15R2.355 N[C@H]1COC(=O)[C@@H]1Cc2ccccc2 Amb28252308 [0,0,1,1,0,0|1,0,1]=4 509 B15R2.355 O=C1OCC(O)C1Cc2ccccc2 Amb27662267 [0,0,1,1,0,0|2,0,0]=4 510 B15R2.355 O=C1OC[C@@H](O)[C@@H]1Cc2ccccc2 Amb28287695 [0,0,1,1,0,0|2,0,0]=4 511 B15R2.355 O=C1OC[C@@H](O)[C@H]1Cc2ccccc2 Amb28079119 [0,0,1,1,0,0|2,0,0]=4 512 B15R2.355 O=C1OC[C@H](O)[C@H]1Cc2ccccc2 Amb28079150 [0,0,1,1,0,0|2,0,0]=4 513 B15R2.6 N=C(N)CCN1CCc2ccccc21 Amb6265807 [0,0,1,1,0,0|2,0,0]=4 514 B15R2.6 N=C(N)SCC1COc2ccccc21 Amb27652043 [0,0,1,1,0,0|1,1,0]=4 515 B15R2.6 N=C(N)SCC1CSc2ccccc21 Amb27425619 [0,0,1,1,0,0|1,1,0]=4 516 B15R2.31 CC1NC(Cc2ccccc2)CCO1 Amb33193767 [0,0,1,1,0,0|1,0,1]=4 517 B15R2.31 N=C1CCCC(Cc2ccccc2)N1 Amb27746856 [0,0,1,1,0,0|1,0,0]=3 518 B15R2.31 NC1=NC(Cc2ccccc2)CCS1 Amb28074102 [0,0,1,1,0,0|0,1,0]=3 519 B15R2.31 O=C1CC(Cc2ccccc2)CCO1 Amb27963030 [0,0,1,1,0,0|2,0,0]=4 520 B15R2.31 O=C1NC(Cc2ccccc2)CCO1 Amb8392176 [0,0,1,1,0,0|1,0,0]=3 521 B15R2.1226 N=C(N)NCC1CC1c2ccccc2 Amb26989586 [0,0,1,1,0,0|1,0,0]=3 522 B15R2.1226 N=C(N)NC[C@H]1C[C@@H]1c2ccccc2 Amb27818151 [0,0,1,1,0,0|1,0,0]=3 523 B15R2.68122 CC(=O)OC1CCCc2ccccc21 Amb22170321 [0,0,1,1,0,0|2,0,0]=4 524 B15R2.68122 N=C(N)CC1CCCc2ccccc21 Amb22123119 [0,0,1,1,0,0|1,0,0]=3 525 B15R2.68122 N=C(N)CC1CCCc2ccccc21 Amb25785261 [0,0,1,1,0,0|1,0,0]=3 526 B15R2.68122 N=C(N)CC1CCOc2ccccc21 Amb27668674 [0,0,1,1,0,0|2,0,0]=4 527 B15R2.68122 N=C(N)CC1OCCc2ccccc21 Amb27232475 [0,0,1,1,0,0|2,0,0]=4 528 B15R2.68122 N=C(N)NC1CCCc2ccccc21 Amb19072435 [0,0,1,1,0,0|1,0,0]=3 529 B15R2.68122 NC(=O)CC1CCCc2ccccc21 Amb17234746 [0,0,1,1,0,0|2,0,0]=4 530 B15R2.68122 NC(=O)NC1CCCc2ccccc21 Amb9267863 [0,0,1,1,0,0|2,0,0]=4 531 B15R2.68122 NC(=O)N[C@@H]1CCCc2ccccc21 Amb32414133 [0,0,1,1,0,0|2,0,0]=4 532 B15R2.68122 NC(=S)CC1CCCc2ccccc21 Amb24758785 [0,0,1,1,0,0|2,0,0]=4 533 B15R2.68122 NC(=S)NC1CCCc2ccccc21 Amb9516853 [0,0,1,1,0,0|2,0,0]=4 534 B15R2.69183 N=C(N)N1CCCCc2ccccc21 Amb27746942 [0,0,1,1,0,0|1,0,0]=3 535 B15R2.69183 NC(=O)N1CCCCc2ccccc21 Amb28135311 [0,0,1,1,0,0|2,0,0]=4 536 B15R2.4 COC(=O)NC1CCc2ccccc21 Amb27588053 [0,0,1,1,0,0|1,0,1]=4 537 B15R2.17 COC1=NN=CC(c2ccccc2)N1 Amb27784920 [0,0,1,1,0,0|1,0,1]=4 538 B15R2.29 O=C1NCC(Cc2ccccc2)CO1 Amb28346309 [0,0,1,1,0,0|1,0,1]=4 539 B15R2.1600 COC(=O)C1CCC1c2ccccc2 Amb23453479 [0,0,1,1,0,0|2,0,0]=4 540 B15R2.1621 COC(=O)NC1CC1c2ccccc2 Amb27982550 [0,0,1,1,0,0|1,0,1]=4 541 B15R2.1621 CO\C(C)=N/C1CC1c2ccccc2 Amb22356821 [0,0,1,1,0,0|1,0,0]=3 542 B15R2.79765 COC(=N)C1CCCc2ccccc21 Amb27647437 [0,0,1,1,0,0|1,0,1]=4 543 B15R2.79765 COC(=O)C1CCCc2ccccc21 Amb8331050 [0,0,1,1,0,0|2,0,0]=4 544 B15R2.79765 COC(=O)[C@H]1CCCc2ccccc21 Amb28192440 [0,0,1,1,0,0|2,0,0]=4 545 B15R2.27 CC1=NC(=O)NC(c2ccccc2)C1 Amb28252409 [0,0,1,1,0,0|0,0,2]=4 546 B15R2.27 CC1CC(=O)NC(c2ccccc2)C1 Amb27852382 [0,0,1,1,0,0|1,0,1]=4 547 B15R2.27 CC1CC(c2ccccc2)NC(=S)N1 Amb27169067 [0,0,1,1,0,0|0,1,1]=4 548 B15R2.27 CC1C[C@@H](c2ccccc2)NC(=O)O1 Amb27387860 [0,0,1,1,0,0|1,0,1]=4 549 B15R2.27 C[C@@H]1C[C@@H](c2ccccc2)NC(=O)O1 Amb27978460 [0,0,1,1,0,0|1,0,1]=4 550 B15R2.27 C[C@H]1C[C@@H](c2ccccc2)NC(=O)O1 Amb27623873 [0,0,1,1,0,0|1,0,1]=4 551 B15R2.27 C[C@H]1C[C@@H](c2ccccc2)NC(=S)N1 Amb27852448 [0,0,1,1,0,0|0,1,1]=4 552 B15R2.27 C[C@H]1C[C@@H](c2ccccc2)OC(=O)N1 Amb27841052 [0,0,1,1,0,0|1,0,1]=4 553 B15R2.1162 CC1CCc2ccccc2C1C(=O)O Amb28128899 [0,0,1,1,0,0|2,0,0]=4 554 B15R2.1162 C[C@H]1CCc2ccccc2[C@@H]1C(=O)O Amb27791834 [0,0,1,1,0,0|2,0,0]=4 555 B15R2.1224 N=C(N)NC1CC(c2ccccc2)C1 Amb29850054 [0,0,1,1,0,0|1,0,1]=4 556 B15R2.1224 NC(=O)NC1CC(c2ccccc2)C1 Amb35735926 [0,0,1,1,0,0|0,0,2]=4 557 B15R2.1224 NC(=S)NC1CC(c2ccccc2)C1 Amb29860313 [0,0,1,1,0,0|0,1,1]=4 558 B15R2.1224 O=C(O)CC1CC(c2ccccc2)C1 Amb25211758 [0,0,1,1,0,0|2,0,0]=4 559 B15R2.1668 NC(=O)OC1CCc2ccccc2C1 Amb27747124 [0,0,1,1,0,0|1,0,1]=4 560 B15R2.1668 NC(=S)NC1CCc2ccccc2C1 Amb27644328 [0,0,1,1,0,0|0,1,1]=4 561 B15R2.1668 NC(=S)N[C@@H]1CCc2ccccc2C1 Amb27841694 [0,0,1,1,0,0|0,1,1]=4 562 B15R2.1668 O=C(O)CC1CCc2ccccc2C1 Amb17940131 [0,0,1,1,0,0|2,0,0]=4 563 B15R2.19829 CC1(CC(=O)O)CCc2ccccc21 Amb17470747 [0,0,1,1,0,0|2,0,0]=4 564 B15R2.1682 O=C1NC(CO)CC1c2ccccc2 Amb22749928 [0,0,1,1,0,0|1,0,1]=4 565 B15R2.1682 O=C1OC(CO)CC1c2ccccc2 Amb27980581 [0,0,1,1,0,0|2,0,0]=4 566 B15R2.2220 C=CC[C@H]1CCc2ccccc2[C@H]1O Amb28206020 [0,0,1,1,0,0|2,0,0]=4 567 B15R2.2220 NCCC1CCc2ccccc2C1O Amb18818193 [0,0,1,1,0,0|1,0,1]=4 568 B15R2.2220 [N-]=[N+]=NC1CCc2ccccc2C1O Amb27791902 [0,0,1,1,0,0|1,0,1]=4 569 B15R2.16920 C\C=C\C1(CO)CC1c2ccccc2 Amb28294187 [0,0,1,1,0,0|2,0,0]=4 570 B15R3.1739 c1ccc2c(c1)CCC3COCN23 Amb28066666 [1,0,0,1,0,0|0,0,2]=4 571 B15R3.4209 C1=C[C@@H]2C[C@H]1CC2c3ccccc3 Amb28399549 [1,0,0,1,0,0|2,0,0]=4 572 B15R3.2009 NC1=NC2Cc3ccccc3C2O1 Amb28396548 [0,0,0,1,1,0|0,0,0]=2 573 B15R3.2009 O=C1CC2Cc3ccccc3C2O1 Amb7090692 [0,0,0,1,1,0|2,0,0]=4 574 B15R3.485 NC1CC2c3ccccc3CCC12 Amb24609804 [0,0,0,1,1,0|1,0,1]=4 575 B15R3.485 NC1CC2c3ccccc3CCC12 Amb32667450 [0,0,0,1,1,0|1,0,1]=4 576 B15R3.485 O=C1CC2c3ccccc3CCC12 Amb26413742 [0,0,0,1,1,0|2,0,0]=4 577 B15R3.485 O=C1C[C@H]2c3ccccc3CC[C@@H]12 Amb24629252 [0,0,0,1,1,0|2,0,0]=4 578 B15R3.485 O=C1NC2c3ccccc3CCC12 Amb25926830 [0,0,0,1,1,0|2,0,0]=4 579 B15R3.485 O=C1N[C@@H]2c3ccccc3CC[C@H]12 Amb1994021 [0,0,0,1,1,0|2,0,0]=4 580 B15R3.485 O=C1N[C@H]2c3ccccc3CC[C@@H]12 Amb1994019 [0,0,0,1,1,0|2,0,0]=4 581 B15R3.520 O=C1CC2(CCc3ccccc32)N1 Amb27198396 [0,0,0,1,1,0|1,0,1]=4 582 B17R3.26 O=C1NC(C2CCc3ccccc32)CO1 Amb33144600 [0,0,0,1,0,1|1,0,1]=4 583 B17R3.1667 NCc1nc2c(o1)-c3ccccc3CC2 Amb32582728 [0,1,0,1,0,0|0,0,2]=4 584 B17R3.17530 O=C1NC(C2Cc3ccccc3C2)CO1 Amb33342512 [0,1,0,1,0,0|1,0,1]=4 585 B13R1.718 CNC(=O)CCCc1ccccc1 Amb3886751 [0,0,1,0,1,0|2,0,0]=4 586 B13R1.718 COC(=O)CCCc1ccccc1 Amb2720838 [0,0,1,0,1,0|1,0,0]=3 587 B13R1.718 COC(=O)CCCc1cccnc1 Amb24066737 [0,0,1,0,1,0|2,0,0]=4 588 B13R1.718 COC(=O)CCCc1ccncc1 Amb19888651 [0,0,1,0,1,0|2,0,0]=4 589 B13R1.718 COC(=O)CCNc1ccccc1 Amb1930724 [0,0,1,0,1,0|2,0,0]=4 590 B13R1.718 COC(=O)CNCc1ccccc1 Amb21929289 [0,0,1,0,1,0|2,0,0]=4 591 B13R1.718 COC(=O)CNCc1ccccc1 Amb6687129 [0,0,1,0,1,0|2,0,0]=4 592 B13R1.718 COC(=O)COCc1ccccc1 Amb7755418 [0,0,1,0,1,0|2,0,0]=4 593 B13R1.718 N\C(CCCc1ccccc1)=N/O Amb9714178 [0,0,1,0,1,0|2,0,0]=4 594 B13R1.718 N\C(CCCc1ccccc1)=N\O Amb22551827 [0,0,1,0,1,0|2,0,0]=4 595 B13R1.718 O=C(CCCc1ccccc1)O[Na] Amb8393622 [0,0,1,0,1,0|2,0,0]=4 596 B13R1.348 CC(CC(=O)O)Cc1ccccc1 Amb17233403 [0,0,1,0,1,0|2,0,0]=4 597 B13R1.348 CC(Cc1ccccc1)NC(N)=S Amb4430630 [0,0,1,0,1,0|0,1,1]=4 598 B13R1.348 C[C@H](Cc1ccccc1)NC(N)=O Amb25766034 [0,0,1,0,1,0|0,0,2]=4 599 B13R1.351 CC(CCc1ccccc1)C(=O)O Amb4011190 [0,0,1,0,1,0|1,0,0]=3 600 B13R1.351 CC(CCc1ccccn1)C(=O)O Amb17335286 [0,0,1,0,1,0|2,0,0]=4 601 B13R1.351 CC(CCc1cccnc1)C(=O)O Amb17233532 [0,0,1,0,1,0|2,0,0]=4 602 B13R1.351 CC(CCc1ccncc1)C(=O)O Amb17335289 [0,0,1,0,1,0|2,0,0]=4 603 B13R1.351 CC(CNc1ccccc1)C(=O)O Amb9400301 [0,0,1,0,1,0|2,0,0]=4 604 B13R1.351 CC(CNc1ccccc1)C(N)=O Amb8944556 [0,0,1,0,1,0|1,0,1]=4 605 B13R1.351 CC(COc1ccccc1)C(=O)O Amb9394526 [0,0,1,0,1,0|2,0,0]=4 606 B13R1.351 CC(COc1ccccc1)C(N)=O Amb17233540 [0,0,1,0,1,0|1,0,1]=4 607 B13R1.351 CC(CSc1ccccc1)C(=O)O Amb9400034 [0,0,1,0,1,0|2,0,0]=4 608 B13R1.351 CC(NCc1ccccc1)C(=O)O Amb10199880 [0,0,1,0,1,0|2,0,0]=4 609 B13R1.351 CC(NCc1ccccc1)C(=O)O Amb9704488 [0,0,1,0,1,0|2,0,0]=4 610 B13R1.351 CC(O)C(C)CCc1ccccc1 Amb32944830 [0,0,1,0,1,0|1,0,1]=4 611 B13R1.351 CC(OCc1ccccc1)C(=O)O Amb6280663 [0,0,1,0,1,0|2,0,0]=4 612 B13R1.351 CC(OCc1ccccc1)C(N)=O Amb9004024 [0,0,1,0,1,0|1,0,1]=4 613 B13R1.351 CC(SCc1ccccc1)C(=O)O Amb9710523 [0,0,1,0,1,0|2,0,0]=4 614 B13R1.351 C[C@@H](NCc1ccccc1)C(=O)O Amb16185448 [0,0,1,0,1,0|2,0,0]=4 615 B13R1.351 C[C@@H](OCc1ccccc1)C(=O)O Amb6357814 [0,0,1,0,1,0|2,0,0]=4 616 B13R1.351 C[C@H](NCc1ccccc1)C(=O)O Amb26326642 [0,0,1,0,1,0|2,0,0]=4 617 B13R1.351 C[C@H](OCc1ccccc1)C(=O)O Amb25072743 [0,0,1,0,1,0|2,0,0]=4 618 B13R1.351 C[C@H](OCc1ccccc1)C(N)=O Amb27411933 [0,0,1,0,1,0|1,0,1]=4 619 B13R1.351 NC(=O)C(N)CCc1ccccc1 Amb19035976 [0,0,1,0,1,0|1,0,1]=4 620 B13R1.351 NC(CCc1ccccc1)C(=O)O Amb33309501 [0,0,1,0,1,0|2,0,0]=4 621 B13R1.351 NC(CCc1ccccc1)C(=O)O Amb4134816 [0,0,1,0,1,0|2,0,0]=4 622 B13R1.351 N[C@@H](CCc1ccccc1)C(=O)O Amb6295860 [0,0,1,0,1,0|2,0,0]=4 623 B13R1.351 N[C@@H](CCc1ccccc1)C(=O)O Amb8393714 [0,0,1,0,1,0|2,0,0]=4 624 B13R1.351 N[C@H](CCc1ccccc1)C(=O)O Amb6357139 [0,0,1,0,1,0|2,0,0]=4 625 B13R1.351 O=C(O)C(Br)CCc1ccccc1 Amb18662872 [0,0,1,0,1,0|2,0,0]=4 626 B13R1.351 O=C(O)C(O)CCc1ccccc1 Amb2718777 [0,0,1,0,1,0|2,0,0]=4 627 B13R1.351 O=C(O)[C@@H](O)CCc1ccccc1 Amb10603260 [0,0,1,0,1,0|2,0,0]=4 628 B13R1.351 O=C(O)[C@H](O)CCc1ccccc1 Amb8628145 [0,0,1,0,1,0|2,0,0]=4 629 B13R1.79 [N-]=[N+]=NC(CO)Cc1ccccc1 Amb32954081 [0,0,1,0,1,0|1,0,1]=4 630 B13R2.64 C1=CCC(Cc2ccccc2)C1 Amb29888235 [1,0,0,0,1,0|2,0,0]=4 631 B13R2.64 C1=NN(Cc2ccccc2)CC1 Amb8391964 [1,0,0,0,1,0|2,0,0]=4 632 B13R2.64 C1=N[C@@H](Cc2ccccc2)CN1 Amb27475965 [1,0,0,0,1,0|1,0,0]=3 633 B13R2.64 C1=N[C@H](Cc2ccccc2)CN1 Amb27834345 [1,0,0,0,1,0|1,0,0]=3 634 B13R2.64 c1ccc(CC2CCOC2)cc1 Amb27770987 [1,0,0,0,1,0|1,0,1]=4 635 B13R2.64 c1ccc(CC2COCN2)cc1 Amb18563410 [1,0,0,0,1,0|0,0,2]=4 636 B13R2.64 c1ccc(C[C@H]2COCN2)cc1 Amb27634861 [1,0,0,0,1,0|0,0,2]=4 637 B13R2.64 c1ccc(Cc2ncon2)cc1 Amb27395776 [1,0,0,0,1,0|1,0,1]=4 638 B13R2.2383 c1ccc(CCC2CCN2)cc1 Amb26353890 [1,0,0,0,1,0|0,0,2]=4 639 B13R2.2383 c1ccc(CCC2CNC2)cc1 Amb25266065 [1,0,0,0,1,0|1,0,1]=4 640 B13R2.2383 c1ccc(CNC2COC2)cc1 Amb22586474 [1,0,0,0,1,0|1,0,1]=4 641 B13R2.2383 c1ccc(CNC2COC2)cc1 Amb22899641 [1,0,0,0,1,0|1,0,1]=4 642 B13R2.2383 c1ccc(COC2COC2)cc1 Amb27616758 [1,0,0,0,1,0|1,0,1]=4 643 B13R2.2383 c1ccc(CSC2COC2)cc1 Amb27198300 [1,0,0,0,1,0|1,0,1]=4 644 B13R2.10 CC1=NC(c2ccccc2)CN1 Amb28071281 [0,0,0,0,2,0|2,0,0]=4 645 B13R2.10 N=C1N[C@@H](c2ccccc2)CO1 Amb25326051 [0,0,0,0,2,0|0,0,2]=4 646 B13R2.10 NC1=NC(c2ccccc2)CO1 Amb33548336 [0,0,0,0,2,0|0,0,0]=2 647 B13R2.10 NC1=NC(c2ccccc2)CS1 Amb5539536 [0,0,0,0,2,0|0,1,0]=3 648 B13R2.10 NC1=NC(c2ccccc2)N=C1 Amb33718551 [0,0,0,0,2,0|2,0,0]=4 649 B13R2.10 NC1=NC(c2cccnc2)CO1 Amb28249320 [0,0,0,0,2,0|1,0,0]=3 650 B13R2.10 NC1=NCC(c2ccccc2)N1 Amb27644507 [0,0,0,0,2,0|1,0,1]=4 651 B13R2.10 NC1=NCC(c2ccccc2)O1 Amb17608294 [0,0,0,0,2,0|2,0,0]=4 652 B13R2.10 NC1=NN(c2ccccc2)CC1 Amb6317925 [0,0,0,0,2,0|2,0,0]=4 653 B13R2.10 NC1=N[C@H](c2ccccc2)CO1 Amb26946059 [0,0,0,0,2,0|0,0,0]=2 654 B13R2.10 NC1=N[C@H](c2ccccc2)CS1 Amb27389470 [0,0,0,0,2,0|0,1,0]=3 655 B13R2.10 Nc1nc(-c2ccccc2)co1 Amb33529509 [0,0,0,0,2,0|0,0,2]=4 656 B13R2.10 Nc1nc(-c2ccccc2)no1 Amb6439807 [0,0,0,0,2,0|1,0,1]=4 657 B13R2.10 O=C1CC(c2ccccc2)CO1 Amb28280068 [0,0,0,0,2,0|2,0,0]=4 658 B13R2.10 O=C1C[C@@H](c2ccccc2)CO1 Amb27451585 [0,0,0,0,2,0|2,0,0]=4 659 B13R2.10 O=C1NC(c2ccccc2)CO1 Amb6346517 [0,0,0,0,2,0|1,0,1]=4 660 B13R2.10 O=C1N[C@@H](c2ccccc2)CO1 Amb6295901 [0,0,0,0,2,0|1,0,1]=4 661 B13R2.10 O=C1N[C@H](c2ccccc2)CO1 Amb6295900 [0,0,0,0,2,0|1,0,1]=4 662 B13R2.10 O=C1OCC(c2ccccc2)O1 Amb27790954 [0,0,0,0,2,0|2,0,0]=4 663 B13R2.10 S=C1NC(c2ccccc2)CO1 Amb26880718 [0,0,0,0,2,0|1,0,1]=4 664 B13R2.27 O=C1CCC1Cc2ccccc2 Amb27177755 [0,0,0,0,2,0|2,0,0]=4 665 B13R2.27 O=C1NCC1Cc2ccccc2 Amb27855620 [0,0,0,0,2,0|2,0,0]=4 666 B13R2.31 NC1CC(Cc2ccccc2)C1 Amb23401475 [0,0,0,0,2,0|1,0,1]=4 667 B13R2.31 NC1CC(Cc2ccccc2)C1 Amb27237117 [0,0,0,0,2,0|1,0,1]=4 668 B13R2.31 O=C1CC(Cc2ccccc2)C1 Amb23401474 [0,0,0,0,2,0|2,0,0]=4 669 B13R2.31 O=C1CC(Cc2ccccc2)N1 Amb27468739 [0,0,0,0,2,0|1,0,1]=4 670 B13R2.31 O=C1C[C@@H](Cc2ccccc2)N1 Amb28243189 [0,0,0,0,2,0|1,0,1]=4 671 B13R2.142 NC1=N[C@H](Cc2cccs2)CS1 Amb27389460 [0,0,0,0,2,0|1,1,0]=4 672 B13R2.17 NC1CC1CCc2ccccc2 Amb25106873 [0,0,0,0,2,0|0,0,1]=3 673 B13R2.17 N[C@@H]1C[C@H]1CCc2ccccc2 Amb26443446 [0,0,0,0,2,0|0,0,1]=3 674 B13R2.17 N[C@@H]1C[C@H]1COc2ccccc2 Amb28436810 [0,0,0,0,2,0|1,0,1]=4 675 B15R1.504 CC(=O)OCCCNCc1ccccc1 Amb18266489 [0,0,1,0,0,1|2,0,0]=4 676 B15R1.504 N=C(N)CCCOCCc1ccccn1 Amb9208849 [0,0,1,0,0,1|2,0,0]=4 677 B15R1.504 N=C(N)NCCCOCc1ccccc1 Amb27825528 [0,0,1,0,0,1|1,0,0]=3 678 B15R1.504 NC(=S)CCCOCCc1ccccc1 Amb9208594 [0,0,1,0,0,1|2,0,0]=4 679 B15R1.504 NC(=S)COCCOCc1ccccc1 Amb27751946 [0,0,1,0,0,1|2,0,0]=4 680 B15R1.1306 C=CCC(CO)CNCc1ccccc1 Amb27854462 [0,0,1,0,0,1|2,0,0]=4 681 B15R1.1306 [N-]=[N+]=N[C@@H](CO)COCc1ccccc1 Amb27597063 [0,0,1,0,0,1|1,0,1]=4 682 B15R2.2196 C1=CC(CNCc2ccccc2)CC1 Amb27425634 [1,0,0,0,0,1|2,0,0]=4 683 B15R2.2196 C1=CCC(COCc2ccccc2)C1 Amb27249539 [1,0,0,0,0,1|2,0,0]=4 684 B15R2.2196 c1ccc(CCNC2CCOC2)cc1 Amb20667617 [1,0,0,0,0,1|1,0,1]=4 685 B15R2.2196 c1ccc(CCNC2CCOC2)cc1 Amb22059244 [1,0,0,0,0,1|1,0,1]=4 686 B15R2.2196 c1ccc(CNCC2CCOC2)cc1 Amb32410100 [1,0,0,0,0,1|1,0,1]=4 687 B15R2.2196 c1ccc(CNCC2COCO2)cc1 Amb27962885 [1,0,0,0,0,1|1,0,1]=4 688 B17R2.5301 O=C1COCC(COCc2ccccc2)N1 Amb27972850 [0,0,0,0,0,2|1,0,1]=4 689 B17R2.5301 O=C1COC[C@H](COCc2ccccc2)N1 Amb27255359 [0,0,0,0,0,2|1,0,1]=4 690 B17R2.3230 Nc1nc(CCOCc2ccccc2)no1 Amb28245059 [0,0,0,0,0,2|1,0,1]=4