0 B16R2.2832 Brc1nc(CCCc2ccccc2)co1 Amb33129301 [0,0,0,0,0,0|2,0,2]=4 1 B16R2.2832 Ic1nc(CCCc2ccccc2)co1 Amb33129302 [0,0,0,0,0,0|2,0,2]=4 2 B16R2.2832 Nc1cc(CCOc2ccccc2)no1 Amb17238019 [0,0,0,0,0,0|2,0,1]=3 3 B16R2.2832 Nc1cc(CCOc2ccccc2)on1 Amb33080543 [0,0,0,0,0,0|3,0,1]=4 4 B16R2.2832 Nc1ccn(CCCc2ccccc2)n1 Amb19018439 [0,0,0,0,0,0|3,0,1]=4 5 B16R2.2832 Nc1ccn(CCOc2ccccc2)n1 Amb20674786 [0,0,0,0,0,0|2,0,1]=3 6 B16R2.2832 Nc1ccn(CCSc2ccccc2)n1 Amb33037858 [0,0,0,0,0,0|2,1,1]=4 7 B16R2.2832 Nc1cn(CCOc2ccccc2)cn1 Amb33037850 [0,0,0,0,0,0|3,0,1]=4 8 B16R2.2832 Nc1cn(CCOc2ccccc2)nn1 Amb32708013 [0,0,0,0,0,0|4,0,0]=4 9 B16R2.2832 Nc1cnn(CCCc2ccccc2)n1 Amb32702542 [0,0,0,0,0,0|4,0,0]=4 10 B16R2.2832 Nc1cnn(CCOc2ccccc2)c1 Amb20674898 [0,0,0,0,0,0|4,0,0]=4 11 B16R2.2832 Nc1cnn(CCOc2ccccc2)n1 Amb32702545 [0,0,0,0,0,0|3,0,0]=3 12 B16R2.2832 Nc1cnn(CCSc2ccccc2)n1 Amb32702601 [0,0,0,0,0,0|3,1,0]=4 13 B16R2.2832 Nc1nc(CCCc2ccccc2)co1 Amb33129276 [0,0,0,0,0,0|1,0,2]=3 14 B16R2.2832 Nc1nc(CCCc2ccccc2)cs1 Amb33129300 [0,0,0,0,0,0|1,1,2]=4 15 B16R2.2832 Nc1nc(CCOc2ccccc2)cs1 Amb3318993 [0,0,0,0,0,0|0,1,2]=3 16 B16R2.2832 Nc1nc(COCc2ccccc2)no1 Amb27666114 [0,0,0,0,0,0|3,0,1]=4 17 B16R2.2832 Nc1ncc(CCOc2ccccc2)o1 Amb33080553 [0,0,0,0,0,0|2,0,2]=4 18 B16R2.2832 Nc1ncn(CCCc2ccccc2)n1 Amb19015585 [0,0,0,0,0,0|3,0,1]=4 19 B16R2.2832 Nc1ncn(CCOc2ccccc2)n1 Amb33037851 [0,0,0,0,0,0|2,0,1]=3 20 B16R2.2832 Nc1ncn(CCSc2ccccc2)n1 Amb33037861 [0,0,0,0,0,0|2,1,1]=4 21 B16R2.2832 Nc1nnc(CCOc2ccccc2)o1 Amb6247129 [0,0,0,0,0,0|3,0,1]=4 22 B16R2.2832 Nc1nnc(CCOc2ccccc2)s1 Amb838507 [0,0,0,0,0,0|3,0,1]=4 23 B16R2.2832 O=C1CC(CCOc2ccccc2)CN1 Amb33082681 [0,0,0,0,0,0|3,0,0]=3 24 B16R2.2832 O=C1NC(CCOc2ccccc2)CO1 Amb33080548 [0,0,0,0,0,0|1,0,1]=2 25 B16R2.2832 O=C1NC(COCc2ccccc2)CO1 Amb27646362 [0,0,0,0,0,0|3,0,1]=4 26 B16R2.2832 O=C1NCC(CCOc2ccccc2)O1 Amb33080538 [0,0,0,0,0,0|3,0,0]=3 27 B16R2.2832 O=C1OCC(COCc2ccccc2)O1 Amb10071643 [0,0,0,0,0,0|4,0,0]=4 28 B16R2.2832 Sc1nc(CCCc2ccccc2)co1 Amb33129312 [0,0,0,0,0,0|2,0,2]=4 29 B15R2.2196 c1ccc(OCCC2CCCN2)cc1 Amb17401562 [1,0,0,0,0,0|1,0,2]=4 30 B15R2.2196 c1ccc(OCCC2CCNC2)cc1 Amb21959194 [1,0,0,0,0,0|2,0,1]=4 31 B17R2.212 Cc1ccc(OCCc2cc(N)on2)cc1 Amb17243139 [0,1,0,0,0,0|2,0,1]=4 32 B17R2.212 Cc1ccc(OCCc2csc(N)n2)cc1 Amb1348585 [0,1,0,0,0,0|0,1,2]=4 33 B17R2.212 Cc1nc(CCOc2ccc(N)cc2)no1 Amb18866984 [0,1,0,0,0,0|2,0,1]=4 34 B17R2.212 Nc1cc(CCOc2ccc(Cl)cc2)no1 Amb17254437 [0,1,0,0,0,0|2,0,1]=4 35 B17R2.212 Nc1cc(CCOc2ccc(F)cc2)no1 Amb17245340 [0,1,0,0,0,0|2,0,1]=4 36 B17R2.212 Nc1ccn(CCOc2ccc(F)cc2)n1 Amb19891283 [0,1,0,0,0,0|2,0,1]=4 37 B17R2.212 Nc1nc(CCOc2ccc(Cl)cc2)cs1 Amb3318995 [0,1,0,0,0,0|0,1,2]=4 38 B17R2.212 Nc1nc(CCOc2ccc(F)cc2)cs1 Amb2575397 [0,1,0,0,0,0|0,1,2]=4 39 B17R2.2523 NCc1csc(CCOc2ccccc2)n1 Amb17318408 [0,1,0,0,0,0|2,0,1]=4 40 B17R2.2523 NCc1nc(CCCc2ccccc2)no1 Amb32454375 [0,1,0,0,0,0|2,0,1]=4 41 B17R2.3348 O=C1CC(CCOc2ccccc2)C(=O)O1 Amb33080527 [0,1,0,0,0,0|2,0,1]=4 42 B17R2.5296 Cc1cccc(OCCc2cc(N)on2)c1 Amb17243138 [0,1,0,0,0,0|2,0,1]=4 43 B17R2.5296 Cc1cccc(OCCc2csc(N)n2)c1 Amb17251608 [0,1,0,0,0,0|0,1,2]=4 44 B17R2.5296 Cc1nc(CCOc2cccc(N)c2)no1 Amb18866985 [0,1,0,0,0,0|2,0,1]=4 45 B17R2.5296 Nc1cc(CCOc2cccc(Cl)c2)no1 Amb17254436 [0,1,0,0,0,0|2,0,1]=4 46 B17R2.5296 Nc1cc(CCOc2cccc(F)c2)no1 Amb17245339 [0,1,0,0,0,0|2,0,1]=4 47 B17R2.5296 Nc1nc(CCOc2cccc(Cl)c2)cs1 Amb17264145 [0,1,0,0,0,0|0,1,2]=4 48 B17R2.5296 Nc1nc(CCOc2cccc(F)c2)cs1 Amb17254112 [0,1,0,0,0,0|0,1,2]=4 49 B17R2.5296 O=C1CC(CCOc2cccc(F)c2)CN1 Amb33416939 [0,1,0,0,0,0|3,0,0]=4 50 B17R2.5296 O=C1NC(CCOc2cccc(F)c2)CO1 Amb33416616 [0,1,0,0,0,0|1,0,1]=3 51 B17R2.5296 O=C1NCC(CCOc2cccc(F)c2)O1 Amb33416615 [0,1,0,0,0,0|3,0,0]=4 52 B17R2.18638 Cc1ccccc1OCCc2cc(N)on2 Amb17243137 [0,1,0,0,0,0|2,0,1]=4 53 B17R2.18638 Cc1ccccc1OCCc2csc(N)n2 Amb17251606 [0,1,0,0,0,0|0,1,2]=4 54 B17R2.18638 Cc1nc(CCOc2ccccc2N)no1 Amb18866986 [0,1,0,0,0,0|2,0,1]=4 55 B17R2.18638 Nc1cc(CCOc2ccccc2Cl)no1 Amb17254435 [0,1,0,0,0,0|2,0,1]=4 56 B17R2.18638 Nc1cc(CCOc2ccccc2F)no1 Amb17245338 [0,1,0,0,0,0|2,0,1]=4 57 B17R2.18638 Nc1nc(CCOc2ccccc2Cl)cs1 Amb17264143 [0,1,0,0,0,0|0,1,2]=4 58 B17R2.18638 Nc1nc(CCOc2ccccc2F)cs1 Amb17254109 [0,1,0,0,0,0|0,1,2]=4 59 B15R1.504 N=C(N)NCCCOCc1ccccc1 Amb27825528 [0,0,1,0,0,0|3,0,0]=4 60 B15R1.504 O=C(O)CCCCCOc1ccccc1 Amb21935952 [0,0,1,0,0,0|3,0,0]=4 61 B15R1.962 COC(=O)COCCOc1ccccc1 Amb9206367 [0,0,1,0,0,0|3,0,0]=4 62 B15R1.9084 CN(CCOc1ccccc1)CC(=O)O Amb9239029 [0,0,1,0,0,0|3,0,0]=4 63 B17R3.26 O=C1NC(C2CCc3ccccc32)CO1 Amb33144600 [0,0,0,1,0,0|2,0,1]=4 64 B15R2.283 NC1=NC(CSc2ccccc2)CO1 Amb27784910 [0,0,0,0,1,0|0,1,0]=2 65 B15R2.283 NC1=NCC(CCc2ccccc2)O1 Amb27746954 [0,0,0,0,1,0|2,0,0]=3 66 B15R2.283 NC1=NCC(CSc2ccccc2)O1 Amb17595588 [0,0,0,0,1,0|2,1,0]=4 67 B15R2.283 NC1=N[C@@H](CCc2ccccc2)CO1 Amb27969242 [0,0,0,0,1,0|0,0,0]=1 68 B15R2.283 NC1=N[C@H](CCc2ccccc2)CO1 Amb27879567 [0,0,0,0,1,0|0,0,0]=1 69 B15R2.283 NC1=N[C@H](CCc2ccccn2)CS1 Amb27950924 [0,0,0,0,1,0|1,1,0]=3 70 B15R2.283 NC1=N[C@H](CCc2cccnc2)CS1 Amb27868556 [0,0,0,0,1,0|1,1,0]=3 71 B15R2.283 NC1=N[C@H](COc2ccccc2)CO1 Amb27464440 [0,0,0,0,1,0|0,0,0]=1 72 B15R2.283 Nc1c[n+](CCc2ccccc2)no1 Amb19650266 [0,0,0,0,1,0|3,0,0]=4 73 B15R2.283 Nc1cc(CCc2ccccc2)no1 Amb33529147 [0,0,0,0,1,0|2,0,1]=4 74 B15R2.283 Nc1cc(COc2ccccc2)no1 Amb17234868 [0,0,0,0,1,0|2,0,1]=4 75 B15R2.283 Nc1ccn(CCc2ccccc2)n1 Amb7173304 [0,0,0,0,1,0|2,0,1]=4 76 B15R2.283 Nc1cnn(CCc2ccccc2)n1 Amb32702378 [0,0,0,0,1,0|3,0,0]=4 77 B15R2.283 Nc1csc(CCc2ccccc2)n1 Amb28341882 [0,0,0,0,1,0|2,0,1]=4 78 B15R2.283 Nc1nc(CCc2ccccc2)cs1 Amb17238165 [0,0,0,0,1,0|0,1,2]=4 79 B15R2.283 Nc1nc(CCc2ccccc2)ns1 Amb18292122 [0,0,0,0,1,0|1,1,1]=4 80 B15R2.283 Nc1nc(CCc2ccccn2)no1 Amb35722902 [0,0,0,0,1,0|2,0,1]=4 81 B15R2.283 Nc1nc(COc2ccccc2)cs1 Amb32671106 [0,0,0,0,1,0|0,1,2]=4 82 B15R2.283 Nc1nc(COc2ccccc2)cs1 Amb33526374 [0,0,0,0,1,0|0,1,2]=4 83 B15R2.283 Nc1nc(COc2ccccc2)no1 Amb18995138 [0,0,0,0,1,0|1,0,1]=3 84 B15R2.283 Nc1nc(COc2ccccc2)ns1 Amb18300287 [0,0,0,0,1,0|1,1,1]=4 85 B15R2.283 Nc1nc(NCc2ccccc2)no1 Amb27968590 [0,0,0,0,1,0|2,0,1]=4 86 B15R2.283 Nc1ncn(CCc2ccccc2)n1 Amb19747703 [0,0,0,0,1,0|2,0,1]=4 87 B15R2.283 O=C1CC(CCc2ccccc2)CN1 Amb26954493 [0,0,0,0,1,0|3,0,0]=4 88 B15R2.283 O=C1CCC(CCc2ccccc2)C1 Amb28124539 [0,0,0,0,1,0|3,0,0]=4 89 B15R2.283 O=C1CCC(CCc2ccccc2)N1 Amb27596663 [0,0,0,0,1,0|2,0,1]=4 90 B15R2.283 O=C1CC[C@@H](COc2ccccc2)N1 Amb27960874 [0,0,0,0,1,0|2,0,1]=4 91 B15R2.283 O=C1NC(CCc2ccccc2)CO1 Amb25217512 [0,0,0,0,1,0|1,0,1]=3 92 B15R2.283 O=C1NCC(CCc2ccccc2)O1 Amb27662552 [0,0,0,0,1,0|3,0,0]=4 93 B15R2.283 O=C1NCC(COc2ccccc2)O1 Amb25861694 [0,0,0,0,1,0|3,0,0]=4 94 B15R2.283 O=C1OCC(CNc2ccccc2)O1 Amb28137905 [0,0,0,0,1,0|3,0,0]=4 95 B15R2.283 O=S1OCC(COc2ccccc2)O1 Amb3483030 [0,0,0,0,1,0|3,0,0]=4 96 B15R2.283 S=C1NC(CCc2ccccc2)CO1 Amb28241411 [0,0,0,0,1,0|1,0,1]=3 97 B15R2.283 S=C1NCC(CCc2ccccc2)O1 Amb28046293 [0,0,0,0,1,0|3,0,0]=4 98 B15R2.283 Sc1nc(CCc2ccccc2)no1 Amb27419282 [0,0,0,0,1,0|2,0,1]=4 99 B15R2.283 Sc1nc(COc2ccccc2)no1 Amb27419283 [0,0,0,0,1,0|2,0,1]=4 100 B17R2.216 Nc1cnc(CCOc2ccccc2)nc1 Amb17486619 [0,0,0,0,0,1|2,0,1]=4 101 B17R2.3230 Nc1ccn(CCCOc2ccccc2)n1 Amb19890891 [0,0,0,0,0,1|2,0,1]=4 102 B17R2.3230 Nc1ccn(CCOCc2ccccc2)n1 Amb25859539 [0,0,0,0,0,1|2,0,1]=4 103 B17R2.3230 Nc1cnn(CCOCc2ccccc2)n1 Amb33165933 [0,0,0,0,0,1|3,0,0]=4 104 B17R2.3230 Nc1nc(CCOCc2ccccc2)no1 Amb28245059 [0,0,0,0,0,1|1,0,1]=3 105 B17R2.3230 Nc1ncn(CCOCc2ccccc2)n1 Amb26657257 [0,0,0,0,0,1|2,0,1]=4 106 B17R2.3230 O=C1CC(CCOCc2ccccc2)CN1 Amb27403544 [0,0,0,0,0,1|3,0,0]=4 107 B14R1.123 O=CCCCCCOc1ccccc1 Amb32410632 [1,0,1,0,0,0|2,0,0]=4 108 B14R1.422 CC(=O)OCCCOc1ccccc1 Amb24046251 [1,0,1,0,0,0|2,0,0]=4 109 B14R1.422 N=C(N)SCCCOc1ccccc1 Amb20675993 [1,0,1,0,0,0|2,0,0]=4 110 B14R1.422 O=C(O)CCCCOc1ccccc1 Amb7764633 [1,0,1,0,0,0|2,0,0]=4 111 B16R1.77 NC(=O)CCCCCOc1ccc(Cl)cc1 Amb33307130 [0,1,1,0,0,0|2,0,0]=4 112 B16R1.1607 [N-]=[N+]=NC(CO)CCOc1cccc(F)c1 Amb33417119 [0,1,1,0,0,0|1,0,1]=4 113 B16R1.82 CC(CCOc1cccc(F)c1)CC(=O)O Amb33417238 [0,1,1,0,0,0|2,0,0]=4 114 B16R2.137 O=C1NC(CCc2ccc(Br)cc2)CO1 Amb33334086 [0,1,0,0,1,0|1,0,1]=4 115 B16R2.137 O=C1NC(CCc2ccc(F)cc2)CO1 Amb33319343 [0,1,0,0,1,0|1,0,1]=4 116 B16R2.258 O=C1NC(CCc2cccc(Br)c2)CO1 Amb33433767 [0,1,0,0,1,0|1,0,1]=4 117 B16R2.2334 NCc1nc(CCc2ccccc2)no1 Amb19015873 [0,1,0,0,1,0|1,0,1]=4 118 B16R2.2334 NCc1nc(COc2ccccc2)no1 Amb10789058 [0,1,0,0,1,0|1,0,1]=4 119 B16R2.2334 NCc1nc(COc2ccccc2)no1 Amb15740915 [0,1,0,0,1,0|1,0,1]=4 120 B18R2.2741 NCc1nc(CCOCc2ccccc2)no1 Amb27785782 [0,1,0,0,0,1|1,0,1]=4 121 B18R2.3665 O=C1CC(CCOc2ccccc2)CC(=O)O1 Amb33080537 [0,1,0,0,0,1|2,0,0]=4 122 B18R2.7060 CC(N)c1nc(CCOc2ccccc2)no1 Amb6643435 [0,2,0,0,0,0|1,0,1]=4 123 B16R2.1337 O=C(O)CC1CCOc2ccccc2C1 Amb18781340 [0,0,1,1,0,0|2,0,0]=4 124 B16R3.335 O=C1C[C@@H]2CCc3ccccc3[C@H]2O1 Amb28463677 [0,0,0,1,1,0|2,0,0]=4 125 B16R3.335 [C@@H]12CCc3ccccc3[C@@H]1OC(=O)C2 Amb17778862 [0,0,0,1,1,0|2,0,0]=4 126 B16R3.2022 Nc1nc(C2Cc3ccccc32)no1 Amb27417622 [0,0,0,1,1,0|1,0,1]=4 127 B16R3.10764 O=C1NC2(CCc3ccccc32)CO1 Amb27391879 [0,0,0,1,1,0|1,0,1]=4 128 B16R3.27490 O=C1CC2(CCOc3ccccc32)N1 Amb27260821 [0,0,0,1,1,0|1,0,1]=4 129 B18R3.2942 O=C1NC(C2COc3ccccc3C2)CO1 Amb33447900 [0,1,0,1,0,0|1,0,1]=4 130 B18R3.2942 O=C1NC(C2COc3ccccc3O2)CO1 Amb33326011 [0,1,0,1,0,0|1,0,1]=4 131 B14R1.716 COC(=O)CCCCc1ccccc1 Amb8392132 [0,0,1,0,1,0|2,0,0]=4 132 B14R1.716 COC(=O)CCCSc1ccccc1 Amb8950459 [0,0,1,0,1,0|1,1,0]=4 133 B14R1.818 CC(CCc1ccccc1)CC(=O)O Amb6749216 [0,0,1,0,1,0|2,0,0]=4 134 B14R1.818 CC(CCc1ccccc1)NC(=N)N Amb19073485 [0,0,1,0,1,0|1,0,1]=4 135 B14R1.6449 CC(CCCc1ccccc1)C(=O)O Amb17235376 [0,0,1,0,1,0|2,0,0]=4 136 B14R1.6449 CC(CCOc1ccccc1)C(=O)O Amb17235913 [0,0,1,0,1,0|1,0,0]=3 137 B14R1.6449 NC(CCOc1ccccc1)C(=O)O Amb32752690 [0,0,1,0,1,0|2,0,0]=4 138 B14R1.6449 NC(CCOc1ccccc1)C(=O)O Amb33547968 [0,0,1,0,1,0|2,0,0]=4 139 B14R1.6449 N[C@@H](CCOc1ccccc1)C(=O)O Amb32667500 [0,0,1,0,1,0|2,0,0]=4 140 B14R1.6449 N[C@H](CCOc1ccccc1)C(=O)O Amb32668011 [0,0,1,0,1,0|2,0,0]=4 141 B14R1.6449 N[C@H](CCOc1ccccc1)C(=O)O Amb32668012 [0,0,1,0,1,0|2,0,0]=4 142 B14R2.101 C1=CCC(COc2ccccc2)C1 Amb35629192 [1,0,0,0,1,0|2,0,0]=4 143 B14R2.101 c1ccc(CCc2ncon2)cc1 Amb27951724 [1,0,0,0,1,0|1,0,1]=4 144 B14R2.3019 c1ccc(OCCC2CCN2)cc1 Amb33080519 [1,0,0,0,1,0|0,0,2]=4 145 B14R2.3019 c1ccc(OCCC2CNC2)cc1 Amb33481743 [1,0,0,0,1,0|1,0,1]=4 146 B14R2.19 CC1=NC(Cc2ccccc2)CO1 Amb26964500 [0,0,0,0,2,0|1,0,0]=3 147 B14R2.19 NC1=NC(Cc2ccccc2)CO1 Amb23449444 [0,0,0,0,2,0|0,0,0]=2 148 B14R2.19 NC1=NC(Cc2ccccc2)CS1 Amb27400638 [0,0,0,0,2,0|0,1,0]=3 149 B14R2.19 NC1=NCC(Cc2ccccc2)N1 Amb27800741 [0,0,0,0,2,0|1,0,1]=4 150 B14R2.19 NC1=N[C@H](Cc2ccccc2)CO1 Amb27464486 [0,0,0,0,2,0|0,0,0]=2 151 B14R2.19 Nc1nc(Cc2ccccc2)co1 Amb22499416 [0,0,0,0,2,0|0,0,2]=4 152 B14R2.19 O=C1CC(Cc2ccccc2)CO1 Amb8487117 [0,0,0,0,2,0|2,0,0]=4 153 B14R2.19 O=C1NC(Cc2ccccc2)CO1 Amb9809273 [0,0,0,0,2,0|1,0,1]=4 154 B14R2.19 O=C1N[C@@H](Cc2ccccc2)CO1 Amb2725669 [0,0,0,0,2,0|1,0,1]=4 155 B14R2.19 O=C1N[C@H](Cc2ccccc2)CO1 Amb6357181 [0,0,0,0,2,0|1,0,1]=4 156 B14R2.19 S=C1NC(Cc2ccccc2)CO1 Amb25938312 [0,0,0,0,2,0|1,0,1]=4 157 B14R2.19 S=C1N[C@@H](Cc2ccccc2)CO1 Amb8629174 [0,0,0,0,2,0|1,0,1]=4 158 B14R2.19 S=C1N[C@H](Cc2ccccc2)CO1 Amb8629175 [0,0,0,0,2,0|1,0,1]=4 159 B14R2.436 NC1CC(CCc2ccccc2)C1 Amb27415257 [0,0,0,0,2,0|1,0,1]=4 160 B14R2.436 NC1CC(COc2ccccc2)C1 Amb29890773 [0,0,0,0,2,0|1,0,1]=4 161 B14R2.436 NC1CC(COc2ccccc2)C1 Amb35752102 [0,0,0,0,2,0|1,0,1]=4 162 B14R2.436 N[C@H]1C[C@@H](COc2ccccc2)C1 Amb35751614 [0,0,0,0,2,0|1,0,1]=4 163 B14R2.436 N[C@H]1C[C@@H](COc2ccccc2)C1 Amb35753087 [0,0,0,0,2,0|1,0,1]=4 164 B14R2.436 N[C@H]1C[C@H](COc2ccccc2)C1 Amb35749919 [0,0,0,0,2,0|1,0,1]=4 165 B14R2.436 N[C@H]1C[C@H](COc2ccccc2)C1 Amb35752132 [0,0,0,0,2,0|1,0,1]=4 166 B14R2.436 O=C1CC(CCc2ccccc2)C1 Amb27235487 [0,0,0,0,2,0|2,0,0]=4 167 B14R2.436 O=C1C[C@@H](CCc2ccccc2)N1 Amb27413661 [0,0,0,0,2,0|1,0,1]=4 168 B14R2.436 O=C1C[C@H](CCc2ccccc2)N1 Amb27206618 [0,0,0,0,2,0|1,0,1]=4 169 B14R2.49 NC1CC1CCOc2ccccc2 Amb33080513 [0,0,0,0,2,0|0,0,1]=3 170 B14R2.49 N[C@@H]1C[C@H]1CCOc2ccccc2 Amb33080511 [0,0,0,0,2,0|0,0,1]=3 171 B16R1.596 N=C(N)CCCCCOCc1ccccc1 Amb27227771 [0,0,1,0,0,1|1,0,0]=3