0 B15R1.1035 CCCCC\C(\CO)=C\c1ccccc1 Amb22002472 [0,0,0,0,0,0|0,0,0]=0 1 B15R1.1035 CCCNCC(CC)Oc1ccccc1 Amb20172682 [0,0,0,0,0,0|3,0,1]=4 2 B15R1.1035 CCN(CCCCBr)Cc1ccccc1 Amb25727835 [0,0,0,0,0,0|3,0,1]=4 3 B15R1.1035 CCN(CCCCS)Cc1ccccc1 Amb25846631 [0,0,0,0,0,0|3,0,1]=4 4 B15R1.1035 CCN(Cc1ccccc1)CCNCC Amb24508167 [0,0,0,0,0,0|3,0,1]=4 5 B15R1.1035 CCN(Cc1ccccc1)CCOCC Amb21173275 [0,0,0,0,0,0|3,0,1]=4 6 B15R1.1035 ClCCCCN(Cc1ccccc1)CC Amb17343514 [0,0,0,0,0,0|3,0,1]=4 7 B14R1.158 BrCCCCC(=O)Nc1ccccc1 Amb17264932 [1,0,0,0,0,0|2,0,1]=4 8 B14R1.158 CCCCCC(=O)Cc1ccccc1 Amb19061100 [1,0,0,0,0,0|0,0,2]=3 9 B14R1.158 CCCCNC(=N)Nc1ccccc1 Amb19073543 [1,0,0,0,0,0|3,0,0]=4 10 B14R1.158 CCCCNC(=S)Cc1ccccc1 Amb10561700 [1,0,0,0,0,0|1,1,1]=4 11 B14R1.158 CCCCNC(=S)Nc1ccccc1 Amb1804766 [1,0,0,0,0,0|2,1,0]=4 12 B14R1.158 CCCCNC(C)Cc1ccccc1 Amb19041462 [1,0,0,0,0,0|1,0,2]=4 13 B14R1.158 CCCNCC(C)Oc1ccccc1 Amb19079694 [1,0,0,0,0,0|2,0,1]=4 14 B14R1.158 CCCSCC(=O)Nc1ccccc1 Amb2556744 [1,0,0,0,0,0|2,0,1]=4 15 B14R1.158 CCNCCN(C)Cc1ccccc1 Amb19041873 [1,0,0,0,0,0|2,0,1]=4 16 B14R1.158 CN(CCCCBr)Cc1ccccc1 Amb25043982 [1,0,0,0,0,0|2,0,1]=4 17 B14R1.158 COCCCN(Cc1ccccc1)C Amb17235703 [1,0,0,0,0,0|2,0,1]=4 18 B14R1.158 C\C(\CNCC=C)=C/c1ccccc1 Amb20673614 [1,0,0,0,0,0|1,0,2]=4 19 B14R1.158 C\C(\CNCC=C)=C/c1ccccc1 Amb20673617 [1,0,0,0,0,0|1,0,2]=4 20 B14R1.158 C\C(\CNCCC)=C/c1ccccc1 Amb19890261 [1,0,0,0,0,0|1,0,0]=2 21 B14R1.158 C\C(\CNCCC)=C/c1ccccc1 Amb20673527 [1,0,0,0,0,0|1,0,0]=2 22 B14R1.158 ClCCCCN(Cc1ccccc1)C Amb17339782 [1,0,0,0,0,0|2,0,1]=4 23 B14R1.467 CCCC\C(\C=O)=C\c1ccccc1 Amb22732853 [1,0,0,0,0,0|0,0,2]=3 24 B14R1.467 CCCC\C(\Nc1ccccc1)=N/N Amb19041345 [1,0,0,0,0,0|3,0,0]=4 25 B14R1.467 NCCCN(CO)Cc1ccccc1 Amb24739707 [1,0,0,0,0,0|2,0,1]=4 26 B16R1.126 CC\C(=C/c1ccccc1)\C(=O)NCCC Amb16799199 [0,1,0,0,0,0|2,0,1]=4 27 B16R1.936 CCC[C@@H](N)CN(Cc1ccccc1)CC Amb25186779 [0,1,0,0,0,0|2,0,1]=4 28 B16R1.1407 CCCCCC\C(\CO)=C/c1ccccc1 Amb22007934 [0,1,0,0,0,0|0,0,0]=1 29 B16R1.1407 CCCCNCC(CC)Oc1ccccc1 Amb20077851 [0,1,0,0,0,0|2,0,1]=4 30 B16R1.1407 CCN(CCCCCCl)Cc1ccccc1 Amb24728007 [0,1,0,0,0,0|2,0,1]=4 31 B16R1.1407 CCN(Cc1ccccc1)CCCNCC Amb24504038 [0,1,0,0,0,0|2,0,1]=4 32 B16R1.1407 NCCCCCN(Cc1ccccc1)CC Amb17505158 [0,1,0,0,0,0|2,0,1]=4 33 B16R1.1407 OCCCCCN(Cc1ccccc1)CC Amb17342261 [0,1,0,0,0,0|2,0,1]=4 34 B16R1.1438 CCNCCN(CCO)Cc1ccccc1 Amb25754938 [0,1,0,0,0,0|2,0,1]=4 35 B16R1.1438 CNCCCN(CCO)Cc1ccccc1 Amb25826892 [0,1,0,0,0,0|2,0,1]=4 36 B16R1.1438 OCCN(CCCCCl)Cc1ccccc1 Amb24442384 [0,1,0,0,0,0|2,0,1]=4 37 B16R1.3379 CCN(Cc1ccccc1)CCCC(C)O Amb24438332 [0,1,0,0,0,0|2,0,1]=4 38 B16R2.69 BrC1CCCCCC1Cc2ccccc2 Amb25750821 [0,0,0,1,0,0|1,0,2]=4 39 B16R2.69 ClC1CCCCCC1Cc2ccccc2 Amb24415939 [0,0,0,1,0,0|1,0,2]=4 40 B16R2.69 N[C@@H]1CCCCC[C@@H]1Oc2ccccc2 Amb23536482 [0,0,0,1,0,0|2,0,1]=4 41 B16R2.112 CCCCn1c(CC)nc2c1cccc2 Amb10563565 [0,0,0,1,0,0|3,0,0]=4 42 B16R2.112 CCCCn1c(CC)nc2c1cccc2 Amb1746131 [0,0,0,1,0,0|3,0,0]=4 43 B16R2.112 CCCCn1c(CN)nc2c1cccc2 Amb10976439 [0,0,0,1,0,0|3,0,0]=4 44 B16R2.112 CCCCn1c(CO)nc2c1cccc2 Amb1045718 [0,0,0,1,0,0|2,0,0]=3 45 B16R2.112 COCCn1c(CO)nc2c1cccc2 Amb1156280 [0,0,0,1,0,0|3,0,0]=4 46 B16R2.112 OCCCn1c(CO)nc2c1cccc2 Amb10978823 [0,0,0,1,0,0|3,0,0]=4 47 B16R2.2272 C[n]1c(CCCCN)cc2ccccc12 Amb18786374 [0,0,0,1,0,0|3,0,0]=4 48 B16R2.2441 CCCC\N=C\1/CCc2ccccc2N1 Amb21997348 [0,0,0,1,0,0|3,0,0]=4 49 B16R2.2441 CCCNCC1COc2c(O1)cccc2 Amb22023 [0,0,0,1,0,0|2,0,1]=4 50 B16R2.2441 NCCCCc1cc2ccccc2cc1 Amb18049792 [0,0,0,1,0,0|2,0,1]=4 51 B16R2.3258 CC1CC\C(=C/c2cccc[n]2)\NCC1 Amb24078429 [0,0,0,1,0,0|3,0,0]=4 52 B16R2.7942 BrCC1(Cc2ccccc2)CCCCC1 Amb25688265 [0,0,0,1,0,0|1,0,2]=4 53 B16R2.7942 NCC1(CCCCC1)Nc2ccccc2 Amb208333 [0,0,0,1,0,0|2,0,1]=4 54 B16R2.7942 NCC1(CCCCC1)Oc2ccccc2 Amb17403131 [0,0,0,1,0,0|2,0,1]=4 55 B16R2.7942 OCC1(CCCCC1)Oc2ccccc2 Amb17403293 [0,0,0,1,0,0|1,0,1]=3 56 B16R2.7942 OCC1(CNCCC1)Cc2ccccc2 Amb19614132 [0,0,0,1,0,0|1,0,2]=4 57 B16R2.11171 OCc1nnn(c1c2ccccc2)CC Amb17537287 [0,0,0,1,0,0|3,0,0]=4 58 B16R2.51757 CCOc1cc(CO)cc2ccccc21 Amb23570403 [0,0,0,1,0,0|1,0,2]=4 59 B14R1.121 CCN(CCNCC)c1ccccc1 Amb19041872 [0,0,0,0,1,0|3,0,0]=4 60 B14R1.121 COCCCN(c1ccccc1)CC Amb17235712 [0,0,0,0,1,0|3,0,0]=4 61 B14R1.121 ClCCCCN(c1ccccc1)CC Amb17339784 [0,0,0,0,1,0|3,0,0]=4 62 B16R1.1758 CCCCCC(CC)NCc1ccccc1 Amb18118586 [0,0,0,0,0,1|1,0,2]=4 63 B16R1.1758 CCCCCC(CN)NCc1ccccc1 Amb25347875 [0,0,0,0,0,1|1,0,2]=4 64 B13R0.338 C\C=C\C=C\C=C\C(O)CCCCC Amb22546607 [1,0,1,0,0,0|0,0,2]=4 65 B13R1.28 BrCCOC\C=C\c1ccccc1 Amb24113552 [2,0,0,0,0,0|2,0,0]=4 66 B13R1.28 CCCNC\C=C\c1ccccc1 Amb20673523 [2,0,0,0,0,0|1,0,0]=3 67 B13R1.28 CCNCC\C=C/c1ccccc1 Amb17142949 [2,0,0,0,0,0|1,0,0]=3 68 B13R1.28 NCCNC\C=C\c1ccccc1 Amb23595759 [2,0,0,0,0,0|2,0,0]=4 69 B13R1.28 OCCNC\C=C\c1ccccc1 Amb1926880 [2,0,0,0,0,0|2,0,0]=4 70 B13R1.28 OOCCC\C=C\c1ccccc1 Amb22231681 [2,0,0,0,0,0|2,0,0]=4 71 B13R1.44 CCCCC(=N)Nc1ccccc1 Amb25192472 [2,0,0,0,0,0|2,0,0]=4 72 B13R1.44 CCCCC(=S)Nc1ccccc1 Amb25785161 [2,0,0,0,0,0|1,1,0]=4 73 B13R1.44 CCCCN(Cc1ccccc1)C Amb1828371 [2,0,0,0,0,0|1,0,1]=4 74 B13R1.79 C\C=C\C(CO)=Cc1ccccc1 Amb24462042 [2,0,0,0,0,0|0,0,2]=4 75 B15R1.83 CCCCCCC(C)Sc1ccccc1 Amb22359390 [1,1,0,0,0,0|1,0,1]=4 76 B15R1.83 CCCCCNC(=S)Nc1ccccc1 Amb2458950 [1,1,0,0,0,0|1,1,0]=4 77 B15R1.83 CCCCCNC(C)Cc1ccccc1 Amb20222579 [1,1,0,0,0,0|0,0,2]=4 78 B15R1.83 CCCCNCC(C)Oc1ccccc1 Amb20077841 [1,1,0,0,0,0|1,0,1]=4 79 B15R1.83 CCCCOCC(=O)Nc1ccccc1 Amb22229721 [1,1,0,0,0,0|1,0,1]=4 80 B15R1.83 CCCCSCC(=O)Nc1ccccc1 Amb22275688 [1,1,0,0,0,0|1,0,1]=4 81 B15R1.83 CCCNCCC(=O)Nc1ccccc1 Amb24116205 [1,1,0,0,0,0|1,0,1]=4 82 B15R1.83 CCCNCCN(C)Cc1ccccc1 Amb20080433 [1,1,0,0,0,0|1,0,1]=4 83 B15R1.83 CNCCCCN(C)Cc1ccccc1 Amb24430854 [1,1,0,0,0,0|1,0,1]=4 84 B15R1.83 C\C(\CNCCCC)=C/c1ccccc1 Amb20673564 [1,1,0,0,0,0|0,0,0]=2 85 B15R1.83 C\C(\CNCCCC)=C/c1ccccc1 Amb20673566 [1,1,0,0,0,0|0,0,0]=2 86 B15R1.83 C\C(\CNCCCO)=C\c1ccccc1 Amb25389587 [1,1,0,0,0,0|1,0,0]=3 87 B15R1.83 OCCCCCN(Cc1ccccc1)C Amb17338912 [1,1,0,0,0,0|1,0,1]=4 88 B15R1.93 CCCCCC(=O)C(c1ccccc1)O Amb10565423 [1,1,0,0,0,0|0,0,2]=4 89 B15R1.93 CN(CCCNC)C(=O)c1ccccc1 Amb24105323 [1,1,0,0,0,0|2,0,0]=4 90 B15R1.128 CCCCCN(C)Cc1ccc(Cl)cc1 Amb20784250 [1,1,0,0,0,0|1,0,1]=4 91 B15R1.129 CCCCCC(=O)Nc1cccc(F)c1 Amb17786077 [1,1,0,0,0,0|1,0,1]=4 92 B15R1.129 CCCCCC(=O)Nc1cccc(I)c1 Amb22269096 [1,1,0,0,0,0|1,0,1]=4 93 B15R1.551 CCCNC(=O)\C(=C\c1ccccc1)\C Amb1853628 [1,1,0,0,0,0|1,0,1]=4 94 B15R1.809 CCCC(O)CN(C)Cc1ccccc1 Amb25051630 [1,1,0,0,0,0|1,0,1]=4 95 B15R1.964 C\C(\CNC(C)CC)=C/c1ccccc1 Amb19891306 [1,1,0,0,0,0|1,0,0]=3 96 B15R1.964 C\C(\CNC(C)CC)=C/c1ccccc1 Amb20673630 [1,1,0,0,0,0|1,0,0]=3 97 B15R1.1081 CC(N)CCCN(C)Cc1ccccc1 Amb24443668 [1,1,0,0,0,0|1,0,1]=4 98 B15R1.1081 CC(O)CCCN(C)Cc1ccccc1 Amb25367114 [1,1,0,0,0,0|1,0,1]=4 99 B15R1.1081 C\C(\CNCC(C)C)=C/c1ccccc1 Amb20673696 [1,1,0,0,0,0|1,0,0]=3 100 B15R1.1081 C\C(\CNCC(C)C)=C/c1ccccc1 Amb20673697 [1,1,0,0,0,0|1,0,0]=3 101 B15R1.1409 CCCCCC(=O)Nc1ccccc1F Amb17698022 [1,1,0,0,0,0|1,0,1]=4 102 B15R1.1409 CCCCCC(=O)Nc1ccccc1N Amb25388890 [1,1,0,0,0,0|1,0,1]=4 103 B15R1.1409 CCCCCC(=O)Nc1ccccc1O Amb21445664 [1,1,0,0,0,0|1,0,1]=4 104 B15R1.1409 CCCCCN(C)Cc1ccccc1F Amb20784249 [1,1,0,0,0,0|1,0,1]=4 105 B15R1.1409 Cc1ccccc1CN(C)CCCCC Amb20783759 [1,1,0,0,0,0|1,0,1]=4 106 B15R1.33 CCCNCCN(CC)c1ccccc1 Amb20080352 [0,1,0,0,1,0|2,0,0]=4 107 B15R1.33 NCCCCC\C(=N\O)\c1ccccn1 Amb10606931 [0,1,0,0,1,0|2,0,0]=4 108 B15R1.33 NCCCCC\C(=N\O)\c1cccnc1 Amb10606955 [0,1,0,0,1,0|2,0,0]=4 109 B15R1.33 NCCCCC\C(=N\O)\c1ccncc1 Amb10606930 [0,1,0,0,1,0|2,0,0]=4 110 B15R1.101 CCCCCC(CC)c1ccc(O)cc1 Amb24066875 [0,1,0,0,1,0|1,0,1]=4 111 B15R1.1412 CCNCCC(CCO)c1ccccc1 Amb23453561 [0,1,0,0,1,0|1,0,1]=4 112 B17R1.4026 CCCCNC(=O)\C(=C\c1ccccc1)\CC Amb16799203 [0,2,0,0,0,0|1,0,1]=4 113 B17R1.1563 OCC(CS(=O)CCCC)Sc1ccccc1 Amb2446460 [0,2,0,0,0,0|1,0,1]=4 114 B17R1.1681 CCCC(C)CN(CCO)Cc1ccccc1 Amb25746894 [0,2,0,0,0,0|1,0,1]=4 115 B17R1.335 CCCCCCN(CCO)Cc1ccccc1 Amb25024476 [0,2,0,0,0,0|1,0,1]=4 116 B17R1.335 CCCNCCN(CCO)Cc1ccccc1 Amb25025791 [0,2,0,0,0,0|1,0,1]=4 117 B17R1.335 CCNCCCN(CCO)Cc1ccccc1 Amb24679834 [0,2,0,0,0,0|1,0,1]=4 118 B17R1.335 CCOCCCN(CCO)Cc1ccccc1 Amb25077352 [0,2,0,0,0,0|1,0,1]=4 119 B17R1.335 COCCCCN(CCO)Cc1ccccc1 Amb25304925 [0,2,0,0,0,0|1,0,1]=4 120 B17R1.335 NCCCCCN(CCO)Cc1ccccc1 Amb24379170 [0,2,0,0,0,0|1,0,1]=4 121 B17R1.335 OCCN(CCCCCCl)Cc1ccccc1 Amb24683489 [0,2,0,0,0,0|1,0,1]=4 122 B17R1.5129 CCCCCC\C(=C/c1ccccc1)\C(O)=O Amb22007935 [0,2,0,0,0,0|0,0,1]=3 123 B17R1.19358 CC(C)CCCN(CCO)Cc1ccccc1 Amb24603711 [0,2,0,0,0,0|1,0,1]=4 124 B15R2.15 CC[C@@H]1CN(Cc2ccccc2)CC1 Amb24535886 [1,0,0,1,0,0|1,0,1]=4 125 B15R2.15 OCC1CC\C(=N\c2ccccc2)\O1 Amb24407574 [1,0,0,1,0,0|2,0,0]=4 126 B15R2.31 CC1CCN\C(=N\c2ccccc2)\O1 Amb25246662 [1,0,0,1,0,0|2,0,0]=4 127 B15R2.54 O=C1CCCCCN1c2ccccc2 Amb17844181 [1,0,0,1,0,0|1,0,1]=4 128 B15R2.54 O[C@@H]1CCCCC[C@H]1c2ccccc2 Amb25284409 [1,0,0,1,0,0|0,0,2]=4 129 B15R2.54 O[C@H]1CCCCC[C@H]1c2ccccc2 Amb24519915 [1,0,0,1,0,0|0,0,2]=4 130 B15R2.64 CC(Nc1ccccc1)C2CCCC2 Amb19072722 [1,0,0,1,0,0|1,0,1]=4 131 B15R2.64 C\C(=C\c1ccccc1)\C2CNCC2 Amb24654977 [1,0,0,1,0,0|1,0,0]=3 132 B15R2.64 C\C(=C\c1ccccc1)\N2CCCC2 Amb24410545 [1,0,0,1,0,0|1,0,0]=3 133 B15R2.64 O=C(C1CCCC1)Cc2ccccc2 Amb17139197 [1,0,0,1,0,0|0,0,2]=4 134 B15R2.64 OC(C1CCCC1)Cc2ccccc2 Amb17139284 [1,0,0,1,0,0|0,0,2]=4 135 B15R2.541 CC1CCCN(C)C1c2ccccc2 Amb25242710 [1,0,0,1,0,0|1,0,1]=4 136 B15R2.569 O=C1CCCCCc2ccccc2N1 Amb25782148 [1,0,0,1,0,0|1,0,1]=4 137 B15R2.1256 O=C(CCC1CC1)Nc2ccccc2 Amb25243741 [1,0,0,1,0,0|1,0,1]=4 138 B15R2.1435 CCCCC1C(=O)Nc2ccccc21 Amb24682707 [1,0,0,1,0,0|1,0,1]=4 139 B15R2.1435 CCCC[n+]1c(C)sc2c1cccc2 Amb1145302 [1,0,0,1,0,0|2,0,0]=4 140 B15R2.1435 CCCCn1c(C)nc2c1cccc2 Amb10561017 [1,0,0,1,0,0|2,0,0]=4 141 B15R2.1435 CCCCn1c(C)nc2c1cccc2 Amb1663306 [1,0,0,1,0,0|2,0,0]=4 142 B15R2.1435 C[C@@H]1Nc2ccccc2[C@@H]1CCCC Amb25194703 [1,0,0,1,0,0|1,0,1]=4 143 B15R2.1435 Cc1[nH]c2ccccc2c1CCCC Amb24741896 [1,0,0,1,0,0|1,0,1]=4 144 B15R2.1435 Cc1cc2ccccc2[n]1CCCBr Amb25083686 [1,0,0,1,0,0|2,0,0]=4 145 B15R2.1435 Cc1cc2ccccc2[n]1CCCF Amb25705379 [1,0,0,1,0,0|2,0,0]=4 146 B15R2.1435 Cc1cc2ccccc2[n]1CCNC Amb18299529 [1,0,0,1,0,0|2,0,0]=4 147 B15R2.1435 Cc1cc2ccccc2[n]1CCOC Amb24377773 [1,0,0,1,0,0|2,0,0]=4 148 B15R2.1435 Cc1cc2ccccc2[n]1CCSC Amb25836483 [1,0,0,1,0,0|2,0,0]=4 149 B15R2.1690 C\C(=C/c1ccccc1)\[C@H]2C[C@@H]2C=O Amb25218855 [1,0,0,1,0,0|1,0,1]=4 150 B15R2.1690 C\C(=C/c1ccccc1)\[C@H]2C[C@H]2C=O Amb25229092 [1,0,0,1,0,0|1,0,1]=4 151 B15R2.2167 C1CCC=C(CC1)Sc2ccccc2 Amb10573698 [1,0,0,1,0,0|1,0,1]=4 152 B15R2.2167 C1CCCCC(=Cc2ccccc2)C1 Amb10606580 [1,0,0,1,0,0|0,0,0]=2 153 B15R2.2167 C1CCCCC=C1Nc2ccccc2 Amb25075601 [1,0,0,1,0,0|1,0,1]=4 154 B15R2.2167 C1CCCCN(C1)Cc2ccccc2 Amb1925686 [1,0,0,1,0,0|1,0,1]=4 155 B15R2.2167 C1CCCCN=C1Nc2ccccc2 Amb22549304 [1,0,0,1,0,0|2,0,0]=4 156 B15R2.2203 CCCCCC=1Cc2ccccc2C1 Amb20242621 [1,0,0,1,0,0|0,0,0]=2 157 B15R2.2203 CCCCCc1[n]c2ccccc2[s]1 Amb24084928 [1,0,0,1,0,0|1,1,0]=4 158 B15R2.2203 CCCCCc1cc2c([nH]1)cccc2 Amb10068533 [1,0,0,1,0,0|1,0,0]=3 159 B15R2.2203 CCCCNc1[n]c2ccccc2o1 Amb19007690 [1,0,0,1,0,0|2,0,0]=4 160 B15R2.2203 CCCCNc1cc2ccccc2[nH]1 Amb25364014 [1,0,0,1,0,0|2,0,0]=4 161 B15R2.2203 CCNCCc1cc2ccccc2[s]1 Amb19649532 [1,0,0,1,0,0|1,1,0]=4 162 B15R2.2203 NCCCCc1cc2ccccc2[s]1 Amb18782051 [1,0,0,1,0,0|1,1,0]=4 163 B15R2.2203 NCCCCc1cc2ccccc2o1 Amb18820049 [1,0,0,1,0,0|1,0,0]=3 164 B15R2.4392 CC1CC(CCC)c2ccccc2N1 Amb25124542 [1,0,0,1,0,0|1,0,1]=4 165 B15R2.4392 CCCc1cc(O)cc2ccccc21 Amb24612675 [1,0,0,1,0,0|0,0,2]=4 166 B15R2.7956 C[N+]1(CCCCC1)Cc2ccccc2 Amb15690857 [1,0,0,1,0,0|1,0,1]=4 167 B15R2.16446 CC(CC1CCC1)Nc2ccccc2 Amb25717869 [1,0,0,1,0,0|1,0,1]=4 168 B15R2.21 ClCC=1CCCCC1c2ccccc2 Amb25779211 [1,0,0,1,0,0|1,0,0]=3 169 B15R2.21 OCC1=CCCCC1c2ccccc2 Amb25681398 [1,0,0,1,0,0|0,0,2]=4 170 B15R2.21 OCC1=CCCC[C@H]1c2ccccc2 Amb25734385 [1,0,0,1,0,0|0,0,2]=4 171 B15R2.21 OCC1CCCCN1c2ccccc2 Amb21857290 [1,0,0,1,0,0|1,0,1]=4 172 B15R2.21 OCC=1CCCOC1c2ccccc2 Amb24620793 [1,0,0,1,0,0|1,0,0]=3 173 B15R2.29 CC1CC\C(\CN1)=C\c2ccccc2 Amb25200558 [1,0,0,1,0,0|1,0,0]=3 174 B15R2.29 OC1CCC(CC1)=Cc2ccccc2 Amb25285629 [1,0,0,1,0,0|2,0,0]=4 175 B15R2.38 CC/1NCCC\C1=C/c2ccccc2 Amb25377978 [1,0,0,1,0,0|2,0,0]=4 176 B15R2.38 ClC/1CCCC\C1=N/c2ccccc2 Amb24682699 [1,0,0,1,0,0|2,0,0]=4 177 B15R2.38 NC/1CCCC\C1=C/c2ccccc2 Amb18129720 [1,0,0,1,0,0|1,0,0]=3 178 B15R2.38 OC1CCCCC1Cc2ccccc2 Amb17508845 [1,0,0,1,0,0|0,0,2]=4 179 B15R2.38 OC1CCCCC1Nc2ccccc2 Amb18950305 [1,0,0,1,0,0|1,0,1]=4 180 B15R2.38 OC1CCCCC1Oc2ccccc2 Amb19050564 [1,0,0,1,0,0|1,0,1]=4 181 B15R2.38 OC1CCCCC1Sc2ccccc2 Amb23450385 [1,0,0,1,0,0|1,0,1]=4 182 B15R2.38 O[C@@H]1CCCC[C@H]1Cc2ccccc2 Amb24559918 [1,0,0,1,0,0|0,0,2]=4 183 B15R2.38 O[C@H]/1CCCC\C1=C/c2ccccc2 Amb25283236 [1,0,0,1,0,0|0,0,0]=2 184 B15R2.38 O[C@H]1CCCC[C@@H]1Cc2ccccc2 Amb24671502 [1,0,0,1,0,0|0,0,2]=4 185 B15R2.38 O[C@H]1CCCC[C@@H]1Sc2ccccc2 Amb24516132 [1,0,0,1,0,0|1,0,1]=4 186 B15R2.38 O[C@H]1CCCC[C@H]1Nc2ccccc2 Amb25179360 [1,0,0,1,0,0|1,0,1]=4 187 B15R2.44 CCC[n]1c2ccccc2cc1CN Amb25359567 [1,0,0,1,0,0|2,0,0]=4 188 B15R2.44 CCCn1c(CO)nc2c1cccc2 Amb1099125 [1,0,0,1,0,0|2,0,0]=4 189 B15R2.44 NCC[n]1c2ccccc2cc1CO Amb25178638 [1,0,0,1,0,0|2,0,0]=4 190 B15R2.89 CCCCC1=Cc2ccccc2C1O Amb25333734 [1,0,0,1,0,0|0,0,0]=2 191 B15R2.89 CCCCC1Cc2ccccc2C1O Amb19078366 [1,0,0,1,0,0|0,0,2]=4 192 B15R2.352 CCCCC1=Cc2ccccc2CO1 Amb24350496 [1,0,0,1,0,0|2,0,0]=4 193 B15R2.352 CCCNC1=Cc2c(CC1)cccc2 Amb10569558 [1,0,0,1,0,0|2,0,0]=4 194 B15R2.352 CCNCC=1COc2ccccc2C1 Amb24337842 [1,0,0,1,0,0|1,0,0]=3 195 B15R2.352 CCNCC=1COc2ccccc2C1 Amb25272229 [1,0,0,1,0,0|1,0,0]=3 196 B15R2.352 OCCCC=1CCc2ccccc2C1 Amb25681494 [1,0,0,1,0,0|2,0,0]=4 197 B15R2.1851 CCC1CC(CO)Cc2ccccc21 Amb24535722 [1,0,0,1,0,0|0,0,2]=4 198 B15R2.4083 CC1CCC(Cc2ccccc2)C1O Amb24355148 [1,0,0,1,0,0|0,0,2]=4 199 B15R2.4083 CC1CCC(Nc2ccccc2)C1O Amb25055762 [1,0,0,1,0,0|1,0,1]=4 200 B15R2.4135 OCC1(CCCC1)Nc2ccccc2 Amb18971801 [1,0,0,1,0,0|1,0,1]=4 201 B15R2.4135 OCC1(CCCC1)Oc2ccccc2 Amb17401656 [1,0,0,1,0,0|1,0,1]=4 202 B15R2.5035 CC1CCC1(CO)Nc2ccccc2 Amb24372776 [1,0,0,1,0,0|1,0,1]=4 203 B15R2.17028 OCC(Nc1ccccc1)C2CCC2 Amb25835992 [1,0,0,1,0,0|1,0,1]=4 204 B15R2.1 CCC1CCC(CC1)c2ccccc2 Amb24711578 [0,0,0,1,1,0|1,0,1]=4 205 B15R2.1 CC[C@@H]1CC[C@H](CC1)c2ccccc2 Amb25350137 [0,0,0,1,1,0|1,0,1]=4 206 B15R2.32 CC1CCCC(C1O)c2ccccc2 Amb24630909 [0,0,0,1,1,0|0,0,1]=3 207 B15R2.32 C[C@@H]1CCC[C@@H]([C@@H]1O)c2ccccc2 Amb24748441 [0,0,0,1,1,0|0,0,1]=3 208 B15R2.32 C[C@H]1CCC[C@H]([C@H]1O)c2ccccc2 Amb25215682 [0,0,0,1,1,0|0,0,1]=3 209 B15R2.32 OC1CCC=C(C1O)c2ccccc2 Amb24704658 [0,0,0,1,1,0|1,0,1]=4 210 B15R2.32 OC1CCCC(C1O)c2ccccc2 Amb24386897 [0,0,0,1,1,0|1,0,1]=4 211 B15R2.66 CCCC1NC(CO1)c2ccccc2 Amb24398849 [0,0,0,1,1,0|1,0,1]=4 212 B15R2.66 CCCC1N[C@H](CO1)c2ccccc2 Amb25858166 [0,0,0,1,1,0|1,0,1]=4 213 B15R2.66 OCCC1CC(=NO1)c2ccccc2 Amb25099373 [0,0,0,1,1,0|2,0,0]=4 214 B15R2.131 BrCC(c1ccccc1)C2CCCC2 Amb17263193 [0,0,0,1,1,0|1,0,1]=4 215 B15R2.131 ClCC(c1ccccc1)C2CCCC2 Amb17240142 [0,0,0,1,1,0|1,0,1]=4 216 B15R2.131 NCC(c1ccccc1)C2CCCC2 Amb2196676 [0,0,0,1,1,0|1,0,1]=4 217 B15R2.131 OCC(c1ccccc1)N2CCCC2 Amb17235105 [0,0,0,1,1,0|1,0,1]=4 218 B15R2.131 OC[C@@H](c1ccccc1)N2CCCC2 Amb24429638 [0,0,0,1,1,0|1,0,1]=4 219 B15R2.131 OC[C@H](c1ccccc1)N2CCCC2 Amb24421873 [0,0,0,1,1,0|1,0,1]=4 220 B15R2.131 O\N=C(/C1CCCC1)\c2ccccc2 Amb24749408 [0,0,0,1,1,0|1,0,0]=3 221 B15R2.131 O\N=C(\C1CCCC1)/c2ccccc2 Amb24712718 [0,0,0,1,1,0|1,0,0]=3 222 B15R2.131 O\N=C(\C1CCCN1)/c2ccccc2 Amb18819182 [0,0,0,1,1,0|2,0,0]=4 223 B15R2.131 O\N=C(\C1CCCO1)/c2ccccc2 Amb25070935 [0,0,0,1,1,0|2,0,0]=4 224 B15R2.4980 BrCC1(CCCCC1)c2ccccc2 Amb17263192 [0,0,0,1,1,0|1,0,1]=4 225 B15R2.4980 CCC1(CCCCC1)c2ccccc2 Amb24348094 [0,0,0,1,1,0|1,0,1]=4 226 B15R2.4980 ClCC1(CCCCC1)c2ccccc2 Amb17240141 [0,0,0,1,1,0|1,0,1]=4 227 B15R2.4980 NCC1(CCCCC1)c2ccccc2 Amb2570540 [0,0,0,1,1,0|1,0,1]=4 228 B15R2.4980 OCC1(CCCCC1)c2cccc[n]2 Amb25201854 [0,0,0,1,1,0|1,0,1]=4 229 B15R2.4980 OCC1(CCCCC1)c2ccccc2 Amb20248731 [0,0,0,1,1,0|0,0,1]=3 230 B15R2.4980 OCC1(CCCCO1)c2ccccc2 Amb25284309 [0,0,0,1,1,0|1,0,1]=4 231 B15R2.4980 OCC1(CCCCS1)c2ccccc2 Amb23568667 [0,0,0,1,1,0|1,0,1]=4 232 B15R2.4980 OCC1(CCNCC1)c2ccccc2 Amb18650932 [0,0,0,1,1,0|1,0,1]=4 233 B15R2.4980 OCC1(CCOCC1)c2ccccc2 Amb22713407 [0,0,0,1,1,0|1,0,1]=4 234 B15R2.11492 CCC[n]1cc(CO)c2ccccc12 Amb23595844 [0,0,0,1,1,0|1,0,1]=4 235 B15R2.22222 OCC1CCC(CO)c2ccccc21 Amb25787225 [0,0,0,1,1,0|1,0,1]=4 236 B15R2.22222 OC[C@@H]1CC[C@H](CO)c2ccccc21 Amb25136312 [0,0,0,1,1,0|1,0,1]=4 237 B15R2.25515 CC1CCCC1(CO)c2ccccc2 Amb24648157 [0,0,0,1,1,0|0,0,1]=3 238 B15R2.87760 NCC1CCCCCc2ccccc21 Amb25760707 [0,0,0,1,1,0|1,0,1]=4 239 B15R2.87760 OCC1CCCCCc2ccccc21 Amb25105993 [0,0,0,1,1,0|0,0,1]=3 240 B17R2.268 CCCCNc1[n]oc([n]1)-c2ccccc2 Amb23761806 [0,0,0,1,0,1|2,0,0]=4 241 B17R2.3188 OCC(NCc1ccccc1)C2CCCC2 Amb24364583 [0,0,0,1,0,1|0,0,2]=4 242 B17R2.3395 OC1CCCCCC1NCc2ccccc2 Amb18970419 [0,0,0,1,0,1|0,0,2]=4 243 B17R2.3395 OC1CCCCCC1OCc2ccccc2 Amb25057033 [0,0,0,1,0,1|0,0,2]=4 244 B17R2.81765 OCC1(CCCCC1)NCc2ccccc2 Amb19023504 [0,0,0,1,0,1|0,0,2]=4 245 B17R2.138133 OCC(CCC1CC1)NCc2ccccc2 Amb25232359 [0,0,0,1,0,1|0,0,2]=4 246 B17R2.2159 CCCC(Br)Cc1cc2ccccc2cc1 Amb18548970 [0,1,0,1,0,0|1,0,1]=4 247 B17R2.12731 OCC1(CCCCC1)Oc2ccc(cc2)C Amb17405586 [0,1,0,1,0,0|1,0,1]=4 248 B17R2.12731 OCC1(CCCCC1)Oc2ccc(cc2)Cl Amb17410315 [0,1,0,1,0,0|1,0,1]=4 249 B17R2.12731 OCC1(CCCCC1)Oc2ccc(cc2)F Amb17406564 [0,1,0,1,0,0|1,0,1]=4 250 B17R2.6265 CCCC[n]1c(CO)[n]c2cc(Cl)ccc12 Amb18618060 [0,1,0,1,0,0|2,0,0]=4 251 B17R2.6265 CCCC[n]1c(CO)[n]c2cc(F)ccc12 Amb18102176 [0,1,0,1,0,0|2,0,0]=4 252 B17R2.6265 CCCCn1c(CO)nc2c1ccc(c2)N Amb13777464 [0,1,0,1,0,0|2,0,0]=4 253 B17R2.6265 CCCCn1c(CO)nc2cc(N)ccc12 Amb17727041 [0,1,0,1,0,0|2,0,0]=4 254 B17R2.6265 Cc1ccc2c(c1)[n]c(CO)[n]2CCCC Amb18618394 [0,1,0,1,0,0|2,0,0]=4 255 B17R2.41862 Brc1cccc(c1)\C=C\2/CCCC(C2=O)C Amb16210567 [0,1,0,1,0,0|0,0,2]=4 256 B17R2.81764 OCC1(CCCCC1)Oc2cccc(c2)C Amb17405585 [0,1,0,1,0,0|1,0,1]=4 257 B17R2.81764 OCC1(CCCCC1)Oc2cccc(c2)Cl Amb17410314 [0,1,0,1,0,0|1,0,1]=4 258 B17R2.81764 OCC1(CCCCC1)Oc2cccc(c2)F Amb17406563 [0,1,0,1,0,0|1,0,1]=4 259 B17R2.3299 CCCCNCc1cc2c(n1C)cccc2 Amb10559332 [0,1,0,1,0,0|2,0,0]=4 260 B17R2.5747 CCCCCn1c(CN)nc2c1cccc2 Amb17092060 [0,1,0,1,0,0|2,0,0]=4 261 B17R2.5747 CCCCCn1c(CO)nc2c1cccc2 Amb1212393 [0,1,0,1,0,0|1,0,0]=3 262 B17R2.5747 CCOCCn1c(CO)nc2c1cccc2 Amb1557859 [0,1,0,1,0,0|2,0,0]=4 263 B17R2.5747 COCCCn1c(CO)nc2c1cccc2 Amb10976500 [0,1,0,1,0,0|2,0,0]=4 264 B17R2.2264 O=C(c1ccccc1)N2CCCCCCC2 Amb2124611 [0,1,0,1,0,0|2,0,0]=4 265 B17R2.283 OCCN(Cc1ccccc1)C2CCCC2 Amb25198431 [0,1,0,1,0,0|1,0,1]=4 266 B17R2.6435 CCCCn1c(CCO)nc2c1cccc2 Amb1971171 [0,1,0,1,0,0|2,0,0]=4 267 B17R2.6435 CCCCn1c(COC)nc2c1cccc2 Amb1097023 [0,1,0,1,0,0|2,0,0]=4 268 B17R2.6435 CCCCn1c(COC)nc2c1cccc2 Amb1219131 [0,1,0,1,0,0|2,0,0]=4 269 B17R2.12117 CCOCCc1cc2ccccc2n1CC Amb17872648 [0,1,0,1,0,0|2,0,0]=4 270 B17R2.6436 CCCCn1c(nc2c1cccc2)C(O)C Amb1219141 [0,1,0,1,0,0|2,0,0]=4 271 B17R2.1273 OCc1nc2c(n1CCC(C)C)cccc2 Amb1555465 [0,1,0,1,0,0|2,0,0]=4 272 B17R2.24240 O=C1\C(=C\c2ccccc2)\CCCC1(C)C Amb10555164 [0,1,0,1,0,0|0,0,2]=4 273 B17R2.106317 OCC1(CCCCC1)Oc2ccccc2C Amb17405584 [0,1,0,1,0,0|1,0,1]=4 274 B17R2.106317 OCC1(CCCCC1)Oc2ccccc2Cl Amb17410313 [0,1,0,1,0,0|1,0,1]=4 275 B17R2.106317 OCC1(CCCCC1)Oc2ccccc2F Amb17406562 [0,1,0,1,0,0|1,0,1]=4 276 B17R2.1274 CCC(Cn1c(CO)nc2c1cccc2)C Amb2470285 [0,1,0,1,0,0|2,0,0]=4 277 B17R3.1829 C1CCCC[C@@H]2Oc3ccccc3N[C@@H]21 Amb23536468 [0,0,0,2,0,0|1,0,1]=4 278 B17R3.1829 C1CCc2c(CC1)cc3c(n2)cccc3 Amb2416878 [0,0,0,2,0,0|1,0,1]=4 279 B17R3.1917 C1CCN(C1)C2=Cc3c(CC2)cccc3 Amb10554852 [0,0,0,2,0,0|2,0,0]=4 280 B17R3.1917 C1Oc2ccccc2C=C1C3OCCO3 Amb25839273 [0,0,0,2,0,0|2,0,0]=4 281 B13R1.24 CCCCCC(=O)c1cc[n]cc1 Amb18804653 [1,0,0,0,1,0|1,0,1]=4 282 B13R1.24 CCCCCC(=O)c1ccc[n]c1 Amb18184182 [1,0,0,0,1,0|1,0,1]=4 283 B13R1.24 CCCCC[C@@H](N)c1ccccc1 Amb22288650 [1,0,0,0,1,0|1,0,1]=4 284 B13R1.24 CCCCNC(=S)c1ccccc1 Amb10561699 [1,0,0,0,1,0|1,1,0]=4 285 B13R1.24 CCCCSC(=O)c1ccccc1 Amb22231430 [1,0,0,0,1,0|1,0,1]=4 286 B13R1.24 CCCNCC(c1ccccc1)C Amb2119487 [1,0,0,0,1,0|1,0,1]=4 287 B13R1.24 CCCOCC(O)c1ccccc1 Amb18809348 [1,0,0,0,1,0|1,0,1]=4 288 B13R1.24 CCNCCN(C)c1ccccc1 Amb18186271 [1,0,0,0,1,0|2,0,0]=4 289 B13R1.24 C\C(=C/CCCN)\c1ccccc1 Amb18065585 [1,0,0,0,1,0|1,0,1]=4 290 B13R1.26 CCCCC(c1ccccc1)NO Amb10605017 [1,0,0,0,1,0|1,0,1]=4 291 B13R1.26 CCCC\C(=C/[Pr])\c1ccccc1 Amb10559340 [1,0,0,0,1,0|1,0,1]=4 292 B15R1.78 CCCCCC(=O)OCc1ccccc1 Amb22734264 [1,0,0,0,0,1|0,0,2]=4 293 B15R1.78 CCCCC[C@H](C)NCc1ccccc1 Amb24666751 [1,0,0,0,0,1|0,0,2]=4 294 B15R1.3921 CCCC[C@H](CO)NCc1ccccc1 Amb24555630 [1,0,0,0,0,1|0,0,2]=4