0 B14R2.7724 CC1=CC(=N)c2ccccc2C1=O Amb25134148 [0,0,0,0,0,0|4,0,0]=4 1 B14R2.7724 CC1=CC(=N)c2ccccc2N1C Amb19518966 [0,0,0,0,0,0|2,0,0]=2 2 B14R2.7724 CC1=CC(=N)c2ccccc2N1C Amb19816187 [0,0,0,0,0,0|2,0,0]=2 3 B14R2.7724 CC1=CC(=O)C(=O)c2[n]cccc21 Amb25832908 [0,0,0,0,0,0|4,0,0]=4 4 B14R2.7724 CC1=CC(=O)C(=O)c2ccc[n]c21 Amb24725352 [0,0,0,0,0,0|4,0,0]=4 5 B14R2.7724 CC1=CC(=O)N(C)c2ccccc12 Amb19653965 [0,0,0,0,0,0|1,0,0]=1 6 B14R2.7724 CC1=CC(=O)N(N)c2ccccc21 Amb18647836 [0,0,0,0,0,0|2,0,0]=2 7 B14R2.7724 CC1=CC(=O)c2ccccc2C1O Amb25059598 [0,0,0,0,0,0|3,0,1]=4 8 B14R2.7724 CC1=CC(=O)c2ccccc2N1C Amb22750765 [0,0,0,0,0,0|1,0,1]=2 9 B14R2.7724 CC1=CC(=O)c2ccccc2N1O Amb25282688 [0,0,0,0,0,0|2,0,1]=3 10 B14R2.7724 CC1=CC(=[NH2+])c2ccccc2N1C Amb22564828 [0,0,0,0,0,0|2,0,0]=2 11 B14R2.7724 CC1=CC(O)c2ccccc2C1=O Amb24633554 [0,0,0,0,0,0|3,0,1]=4 12 B14R2.7724 CC1=NC(=O)c2ccccc2N1C Amb22753723 [0,0,0,0,0,0|2,0,1]=3 13 B14R2.7724 CC1C(=O)CC(C)c2ccccc21 Amb25718436 [0,0,0,0,0,0|2,0,2]=4 14 B14R2.7724 CC1CC(=O)N(C)c2ccccc21 Amb18061648 [0,0,0,0,0,0|1,0,2]=3 15 B14R2.7724 CC1CC(=O)c2ccccc2N1C Amb25768566 [0,0,0,0,0,0|1,0,3]=4 16 B14R2.7724 CC1c2ccccc2C(=O)NC1=O Amb22364372 [0,0,0,0,0,0|2,0,1]=3 17 B14R2.7724 CC1c2ccccc2C(=O)OC1=O Amb23580671 [0,0,0,0,0,0|2,0,1]=3 18 B14R2.7724 CC=1c2ccccc2C(=O)NC1C Amb23454481 [0,0,0,0,0,0|3,0,1]=4 19 B14R2.7724 CN1C(=O)C=C(Br)c2ccccc12 Amb21962690 [0,0,0,0,0,0|1,0,0]=1 20 B14R2.7724 CN1C(=O)C=C(Cl)c2ccccc12 Amb17997066 [0,0,0,0,0,0|1,0,0]=1 21 B14R2.7724 CN1C(=O)C=C(N)c2ccccc12 Amb18127278 [0,0,0,0,0,0|1,0,0]=1 22 B14R2.7724 CN1C(=O)C=C(O)c2ccc[n]c12 Amb21934000 [0,0,0,0,0,0|1,0,0]=1 23 B14R2.7724 CN1C(=O)C=C(O)c2ccccc12 Amb18011109 [0,0,0,0,0,0|0,0,0]=0 24 B14R2.7724 CN1C(=O)CN(C)c2ccccc12 Amb20462941 [0,0,0,0,0,0|2,0,1]=3 25 B14R2.7724 CN1C(=O)N=[N+]([O-])c2ccccc12 Amb24414086 [0,0,0,0,0,0|2,0,1]=3 26 B14R2.7724 CN1C(N)=NC(=O)c2ccccc12 Amb18647897 [0,0,0,0,0,0|2,0,1]=3 27 B14R2.7724 CN1C(O)=CC(=O)c2ccccc12 Amb22564234 [0,0,0,0,0,0|0,0,2]=2 28 B14R2.7724 CN1C(S)=NC(=O)c2ccc[n]c12 Amb19769483 [0,0,0,0,0,0|2,1,1]=4 29 B14R2.7724 CN1C(S)=NC(=O)c2ccccc12 Amb21867966 [0,0,0,0,0,0|1,1,1]=3 30 B14R2.7724 CN1C=C(O)c2ccccc2C1=O Amb24761294 [0,0,0,0,0,0|4,0,0]=4 31 B14R2.7724 CN1c2[n]c[n]cc2C(=O)NC1=O Amb25040138 [0,0,0,0,0,0|3,0,1]=4 32 B14R2.7724 CN1c2[n]cccc2C(=O)NC1=O Amb22713456 [0,0,0,0,0,0|2,0,1]=3 33 B14R2.7724 CN1c2[n]cccc2C(=O)OC1=O Amb19891273 [0,0,0,0,0,0|2,0,1]=3 34 B14R2.7724 CN1c2ccccc2C(=O)NC1=O Amb19516832 [0,0,0,0,0,0|1,0,1]=2 35 B14R2.7724 CN1c2ccccc2C(=O)OC1=O Amb17933878 [0,0,0,0,0,0|1,0,1]=2 36 B14R2.7724 CN1c2ccccc2C(=S)NC1=S Amb25190426 [0,0,0,0,0,0|1,2,0]=3 37 B14R2.7724 C[n+]1c(C)cc(c2c1cccc2)N Amb10573352 [0,0,0,0,0,0|2,0,1]=3 38 B14R2.7724 C[n+]1c2ccccc2c(Cl)cc1Cl Amb22484087 [0,0,0,0,0,0|2,0,1]=3 39 B14R2.7724 C[n]1c(=O)[n]c(Cl)c2ccccc12 Amb24065912 [0,0,0,0,0,0|2,0,0]=2 40 B14R2.7724 Cc1[n]c(O)c2ccccc2c1N Amb25270134 [0,0,0,0,0,0|4,0,0]=4 41 B14R2.7724 Cc1c(Br)[n]c(N)c2ccccc21 Amb24455662 [0,0,0,0,0,0|4,0,0]=4 42 B14R2.7724 Cc1c(Br)cc(N)c2ccccc21 Amb25180240 [0,0,0,0,0,0|3,0,0]=3 43 B14R2.7724 Cc1c(Cl)[n]c(Br)c2ccccc21 Amb25034223 [0,0,0,0,0,0|4,0,0]=4 44 B14R2.7724 Cc1c(Cl)[n]c(N)c2ccccc21 Amb23580676 [0,0,0,0,0,0|4,0,0]=4 45 B14R2.7724 Cc1c(F)cc(Br)c2[n]cccc21 Amb23448762 [0,0,0,0,0,0|4,0,0]=4 46 B14R2.7724 Cc1c(F)cc(I)c2[n]cccc21 Amb23448764 [0,0,0,0,0,0|4,0,0]=4 47 B14R2.7724 Cc1c(F)cc(N)c2[n]cccc21 Amb23448759 [0,0,0,0,0,0|4,0,0]=4 48 B14R2.7724 Cc1c(F)cc(O)c2[n]cccc21 Amb23448766 [0,0,0,0,0,0|3,0,0]=3 49 B14R2.7724 Cc1c(N)[n]c(Cl)c2ccccc21 Amb25109210 [0,0,0,0,0,0|4,0,0]=4 50 B14R2.7724 Cc1c(N)cc(Br)c2ccccc21 Amb25099460 [0,0,0,0,0,0|3,0,0]=3 51 B14R2.7724 Cc1c(O)cc(Cl)c2ccccc21 Amb25093637 [0,0,0,0,0,0|2,0,1]=3 52 B14R2.7724 Cc1c2ccc[n]c2c(Cl)cc1Cl Amb25858734 [0,0,0,0,0,0|4,0,0]=4 53 B14R2.7724 Cc1c2ccccc2c(Br)[n]c1Br Amb25847939 [0,0,0,0,0,0|4,0,0]=4 54 B14R2.7724 Cc1c2ccccc2c(Br)[n]c1C Amb23560121 [0,0,0,0,0,0|4,0,0]=4 55 B14R2.7724 Cc1c2ccccc2c(C)[n]c1C Amb23560141 [0,0,0,0,0,0|4,0,0]=4 56 B14R2.7724 Cc1c2ccccc2c(Cl)[n]c1C Amb23454482 [0,0,0,0,0,0|4,0,0]=4 57 B14R2.7724 Cc1c2ccccc2c(Cl)[n]c1Cl Amb23440668 [0,0,0,0,0,0|4,0,0]=4 58 B14R2.7724 Cc1c2ccccc2c(N)[n]c1C Amb23454483 [0,0,0,0,0,0|4,0,0]=4 59 B14R2.7724 Cc1c2ccccc2c(O)cc1O Amb18127200 [0,0,0,0,0,0|1,0,1]=2 60 B14R2.7724 Cc1c2ccccc2c(S)[n]c1C Amb23560123 [0,0,0,0,0,0|3,1,0]=4 61 B14R2.7724 Cc1c[n+]([O-])c(C)c2ccccc12 Amb24496434 [0,0,0,0,0,0|3,0,1]=4 62 B14R2.7724 Cc1cc(Br)c(N)c2ccccc21 Amb24623462 [0,0,0,0,0,0|4,0,0]=4 63 B14R2.7724 Cc1cc(Br)c2[n]cccc2c1C Amb23589107 [0,0,0,0,0,0|4,0,0]=4 64 B14R2.7724 Cc1cc(Br)c2ccccc2c1F Amb24496184 [0,0,0,0,0,0|4,0,0]=4 65 B14R2.7724 Cc1cc(Br)c2ccccc2c1N Amb18135739 [0,0,0,0,0,0|4,0,0]=4 66 B14R2.7724 Cc1cc(C)[n+](C)c2ccccc12 Amb22446712 [0,0,0,0,0,0|2,0,1]=3 67 B14R2.7724 Cc1cc(C)c(N)c2ccccc12 Amb22751127 [0,0,0,0,0,0|4,0,0]=4 68 B14R2.7724 Cc1cc(Cl)c2[n]cccc2c1C Amb23589108 [0,0,0,0,0,0|4,0,0]=4 69 B14R2.7724 Cc1cc(Cl)c2ccccc2[n+]1C Amb22359536 [0,0,0,0,0,0|2,0,1]=3 70 B14R2.7724 Cc1cc(Cl)c2ccccc2[n+]1C Amb22359572 [0,0,0,0,0,0|2,0,1]=3 71 B14R2.7724 Cc1cc(Cl)c2ccccc2c1N Amb18650981 [0,0,0,0,0,0|4,0,0]=4 72 B14R2.7724 Cc1cc(Cl)c2ccccc2c1O Amb24408291 [0,0,0,0,0,0|4,0,0]=4 73 B14R2.7724 Cc1cc(N)c(C)c2[n]cccc12 Amb25701543 [0,0,0,0,0,0|4,0,0]=4 74 B14R2.7724 Cc1cc(N)c(C)c2cc[n]cc12 Amb24721026 [0,0,0,0,0,0|4,0,0]=4 75 B14R2.7724 Cc1cc(N)c2[n]cccc2c1C Amb22899683 [0,0,0,0,0,0|4,0,0]=4 76 B14R2.7724 Cc1cc(N)c2ccc[n]c2c1C Amb19337852 [0,0,0,0,0,0|4,0,0]=4 77 B14R2.7724 Cc1cc(N)c2ccccc2c1C Amb18647537 [0,0,0,0,0,0|3,0,0]=3 78 B14R2.7724 Cc1cc(N)c2ccccc2c1O Amb22489602 [0,0,0,0,0,0|4,0,0]=4 79 B14R2.7724 Cc1cc(O)c(C)c2cc[n]cc12 Amb24417752 [0,0,0,0,0,0|3,0,1]=4 80 B14R2.7724 Cc1cc(O)c2[n]cccc2c1C Amb23589109 [0,0,0,0,0,0|3,0,0]=3 81 B14R2.7724 Cc1cc(O)c2[n]cccc2c1N Amb24634130 [0,0,0,0,0,0|4,0,0]=4 82 B14R2.7724 Cc1cc(O)c2c(c1N)cccc2 Amb17594348 [0,0,0,0,0,0|3,0,0]=3 83 B14R2.7724 Clc1c(I)cc(Br)c2ccccc21 Amb22546705 [0,0,0,0,0,0|4,0,0]=4 84 B14R2.7724 Clc1cc(Cl)c(Cl)c2ccccc12 Amb25180822 [0,0,0,0,0,0|4,0,0]=4 85 B14R2.7724 Clc1cc(Cl)c2c(c1N)cccc2 Amb17595709 [0,0,0,0,0,0|4,0,0]=4 86 B14R2.7724 Clc1cc(N)c(c2c1cccc2)Cl Amb17595704 [0,0,0,0,0,0|4,0,0]=4 87 B14R2.7724 Clc1cc(O)c(c2c1cccc2)Cl Amb17595765 [0,0,0,0,0,0|3,0,1]=4 88 B14R2.7724 N=C1C=C(O)C(=O)c2ccccc21 Amb24408486 [0,0,0,0,0,0|3,0,1]=4 89 B14R2.7724 NC1=CC(=N)c2c(C1=O)cccc2 Amb17594308 [0,0,0,0,0,0|4,0,0]=4 90 B14R2.7724 NC1=CC(=O)c2ccccc2C1=[NH2+] Amb22466888 [0,0,0,0,0,0|3,0,1]=4 91 B14R2.7724 NC1=CC(=O)c2ccccc2S1=O Amb25064677 [0,0,0,0,0,0|3,0,1]=4 92 B14R2.7724 NC1c2ccccc2C(=O)NC1=O Amb22751304 [0,0,0,0,0,0|3,0,1]=4 93 B14R2.7724 Nc1c(Br)cc(F)c2ccccc21 Amb24594020 [0,0,0,0,0,0|4,0,0]=4 94 B14R2.7724 Nc1c(Cl)cc(Br)c2ccccc21 Amb24694987 [0,0,0,0,0,0|4,0,0]=4 95 B14R2.7724 Nc1c(I)cc(Br)c2ccccc21 Amb25034201 [0,0,0,0,0,0|4,0,0]=4 96 B14R2.7724 Nc1c(S)cc(Br)c2ccccc21 Amb24368549 [0,0,0,0,0,0|3,1,0]=4 97 B14R2.7724 Nc1cc(Br)c(I)c2ccccc21 Amb25155017 [0,0,0,0,0,0|4,0,0]=4 98 B14R2.7724 Nc1cc(C)c(c2c1cccc2)N Amb17594326 [0,0,0,0,0,0|4,0,0]=4 99 B14R2.7724 Nc1cc(I)c(I)c2ccccc21 Amb24441052 [0,0,0,0,0,0|4,0,0]=4 100 B14R2.7724 Nc1cc(N)c(c2c1cccc2)N Amb17594360 [0,0,0,0,0,0|4,0,0]=4 101 B14R2.7724 Nc1cc(N)c2c(c1O)cccc2 Amb17594385 [0,0,0,0,0,0|4,0,0]=4 102 B14R2.7724 Nc1cc(O)c(c2c1cccc2)N Amb17594396 [0,0,0,0,0,0|3,0,1]=4 103 B14R2.7724 Nc1cc(O)c2c(c1N)cccc2 Amb17594389 [0,0,0,0,0,0|3,0,0]=3 104 B14R2.7724 O=C1C=C(F)C(=O)c2ccccc12 Amb25075697 [0,0,0,0,0,0|3,0,1]=4 105 B14R2.7724 O=C1C=C(N)c2c(C1=O)cccc2 Amb17594342 [0,0,0,0,0,0|3,0,0]=3 106 B14R2.7724 O=C1C=C(S)C(=O)c2ccccc12 Amb24690896 [0,0,0,0,0,0|2,1,1]=4 107 B14R2.7724 O=C1CC(=O)c2c(N1C)cccc2 Amb1421567 [0,0,0,0,0,0|0,0,2]=2 108 B14R2.7724 O=C1c2ccccc2C(=O)OC1=O Amb22755689 [0,0,0,0,0,0|3,0,1]=4 109 B14R2.7724 OC1=CC(=O)N(O)c2ccccc12 Amb24099112 [0,0,0,0,0,0|1,0,0]=1 110 B14R2.7724 Oc1c(I)cc(Cl)c2ccccc21 Amb20248186 [0,0,0,0,0,0|4,0,0]=4 111 B14R2.7724 Oc1c2ccccc2c(Br)cc1Br Amb20240597 [0,0,0,0,0,0|4,0,0]=4 112 B14R2.7724 Oc1c2ccccc2c(F)cc1F Amb18128534 [0,0,0,0,0,0|4,0,0]=4 113 B14R2.7724 Oc1c2ccccc2c(S)cc1S Amb18131042 [0,0,0,0,0,0|2,2,0]=4 114 B14R2.7724 Oc1cc(Cl)c(O)c2[n]cccc12 Amb25191924 [0,0,0,0,0,0|4,0,0]=4 115 B14R2.7724 Oc1cc(Cl)c(O)c2c[n]ccc12 Amb25730093 [0,0,0,0,0,0|4,0,0]=4 116 B14R2.7724 Oc1cc(Cl)c(O)c2cc[n]cc12 Amb24416707 [0,0,0,0,0,0|4,0,0]=4 117 B14R2.7724 Oc1cc(Cl)c(O)c2ccc[n]c12 Amb25718296 [0,0,0,0,0,0|4,0,0]=4 118 B14R2.7724 Oc1cc(Cl)c(O)c2ccccc12 Amb18130135 [0,0,0,0,0,0|3,0,0]=3 119 B14R2.7724 Oc1cc(N)c(c2c1cccc2)O Amb17594429 [0,0,0,0,0,0|3,0,0]=3 120 B14R2.7724 Oc1cc(N)c2c(c1O)cccc2 Amb17594427 [0,0,0,0,0,0|3,0,1]=4 121 B14R2.7724 Oc1cc(O)c(Br)c2ccccc12 Amb23537509 [0,0,0,0,0,0|2,0,1]=3 122 B14R2.7724 Oc1cc(O)c(Cl)c2ccccc12 Amb23537510 [0,0,0,0,0,0|2,0,1]=3 123 B14R2.7724 Oc1cc(O)c(c2c1cccc2)O Amb17594460 [0,0,0,0,0,0|2,0,1]=3 124 B14R2.7724 Oc1cc(O)c2c(c1N)cccc2 Amb17594428 [0,0,0,0,0,0|2,0,1]=3 125 B14R2.7724 Oc1cc(S)c(O)c2ccccc12 Amb20247731 [0,0,0,0,0,0|2,1,0]=3 126 B14R2.7724 Oc1cc(S)c2ccccc2c1O Amb25807601 [0,0,0,0,0,0|2,1,1]=4 127 B14R2.7724 [O-][N+]1=CC(=O)N(O)c2ccccc12 Amb21913117 [0,0,0,0,0,0|2,0,1]=3 128 B13R2.32 Brc1c(I)ccc2ccccc21 Amb24535463 [1,0,0,0,0,0|3,0,0]=4 129 B13R2.32 Brc1ccc2c(c1F)cccc2 Amb16186009 [1,0,0,0,0,0|3,0,0]=4 130 B13R2.32 Brc1ccc2c(c1N)cccc2 Amb17596049 [1,0,0,0,0,0|3,0,0]=4 131 B13R2.32 Brc1ccc2ccccc2c1Br Amb24060608 [1,0,0,0,0,0|3,0,0]=4 132 B13R2.32 Brc1ccc2ccccc2c1I Amb24594397 [1,0,0,0,0,0|3,0,0]=4 133 B13R2.32 CC1=CNc2ccccc2N1C Amb24536695 [1,0,0,0,0,0|2,0,0]=3 134 B13R2.32 CC1C(=O)CNc2ccccc21 Amb25276622 [1,0,0,0,0,0|2,0,1]=4 135 B13R2.32 CC1C(=O)CSc2ccccc21 Amb24620041 [1,0,0,0,0,0|2,0,1]=4 136 B13R2.32 CN1C(=C)NCc2ccccc12 Amb25245953 [1,0,0,0,0,0|2,0,1]=4 137 B13R2.32 CN1C(=O)C=Cc2c[n]ccc12 Amb22491898 [1,0,0,0,0,0|1,0,0]=2 138 B13R2.32 CN1C(=O)C=Cc2cc[n]cc12 Amb25707761 [1,0,0,0,0,0|1,0,0]=2 139 B13R2.32 CN1C(=O)C=Cc2ccccc12 Amb19116112 [1,0,0,0,0,0|0,0,0]=1 140 B13R2.32 CN1C(=O)N=Cc2ccccc12 Amb24079785 [1,0,0,0,0,0|1,0,0]=2 141 B13R2.32 CN1C(=O)OCc2ccccc12 Amb25220213 [1,0,0,0,0,0|1,0,1]=3 142 B13R2.32 CN1C(=S)C=Cc2ccccc12 Amb19651670 [1,0,0,0,0,0|0,1,0]=2 143 B13R2.32 CN1C(=S)CSc2ccccc12 Amb24456908 [1,0,0,0,0,0|1,1,1]=4 144 B13R2.32 C[n+]1c(C)ccc2c1cccc2 Amb2540178 [1,0,0,0,0,0|1,0,1]=3 145 B13R2.32 C[n+]1c(I)ccc2ccccc12 Amb22485663 [1,0,0,0,0,0|1,0,1]=3 146 B13R2.32 C[n+]1c(N)ccc2c1cccc2 Amb10553827 [1,0,0,0,0,0|1,0,1]=3 147 B13R2.32 Cc1c(Br)c[n]c2ccccc21 Amb22263020 [1,0,0,0,0,0|3,0,0]=4 148 B13R2.32 Cc1c(Br)ccc2ccc[n]c21 Amb19895195 [1,0,0,0,0,0|3,0,0]=4 149 B13R2.32 Cc1c(Br)ccc2ccccc21 Amb21929204 [1,0,0,0,0,0|2,0,0]=3 150 B13R2.32 Cc1c(Cl)[n]cc2ccccc21 Amb22496769 [1,0,0,0,0,0|3,0,0]=4 151 B13R2.32 Cc1c(Cl)c[n]c2ccccc21 Amb24078686 [1,0,0,0,0,0|3,0,0]=4 152 B13R2.32 Cc1c(Cl)ccc2[n]cccc21 Amb24568895 [1,0,0,0,0,0|3,0,0]=4 153 B13R2.32 Cc1c(Cl)ccc2c[n]ccc21 Amb24374947 [1,0,0,0,0,0|3,0,0]=4 154 B13R2.32 Cc1c(F)ccc2[n]cccc21 Amb23448755 [1,0,0,0,0,0|3,0,0]=4 155 B13R2.32 Cc1c(F)ccc2ccc[n]c21 Amb24454469 [1,0,0,0,0,0|3,0,0]=4 156 B13R2.32 Cc1c(N)[n]cc2ccccc21 Amb18645062 [1,0,0,0,0,0|3,0,0]=4 157 B13R2.32 Cc1c(N)ccc2[n]cccc21 Amb24557734 [1,0,0,0,0,0|3,0,0]=4 158 B13R2.32 Cc1c(N)ccc2cc[n]cc21 Amb22753791 [1,0,0,0,0,0|3,0,0]=4 159 B13R2.32 Cc1c(O)c[n]c2ccccc21 Amb18645166 [1,0,0,0,0,0|2,0,1]=4 160 B13R2.32 Cc1c(O)ccc2[n]cccc21 Amb18645164 [1,0,0,0,0,0|2,0,1]=4 161 B13R2.32 Cc1c(O)ccc2ccc[n]c21 Amb18645163 [1,0,0,0,0,0|2,0,1]=4 162 B13R2.32 Cc1c2ccccc2c[n]c1C Amb23560126 [1,0,0,0,0,0|3,0,0]=4 163 B13R2.32 Cc1c2ccccc2cc[n+]1[O-] Amb25266052 [1,0,0,0,0,0|2,0,1]=4 164 B13R2.32 Cc1ccc2c(c1N)cccc2 Amb2429201 [1,0,0,0,0,0|3,0,0]=4 165 B13R2.32 Cc1ccc2ccc[n]c2c1C Amb19101295 [1,0,0,0,0,0|3,0,0]=4 166 B13R2.32 Cc1ccc2ccccc2[n+]1C Amb17843414 [1,0,0,0,0,0|1,0,1]=3 167 B13R2.32 Cc1ccc2ccccc2c1S Amb25340394 [1,0,0,0,0,0|3,0,0]=4 168 B13R2.32 Clc1c(Br)ccc2ccccc21 Amb24444356 [1,0,0,0,0,0|3,0,0]=4 169 B13R2.32 Clc1ccc2c(c1C)nccc2 Amb10607058 [1,0,0,0,0,0|3,0,0]=4 170 B13R2.32 Clc1ccc2c(c1N)cccc2 Amb17594523 [1,0,0,0,0,0|3,0,0]=4 171 B13R2.32 Clc1ccc2c(c1O)cccc2 Amb17594568 [1,0,0,0,0,0|3,0,0]=4 172 B13R2.32 Clc1ccc2ccccc2c1Br Amb25082370 [1,0,0,0,0,0|3,0,0]=4 173 B13R2.32 Clc1ccc2ccccc2c1Cl Amb25189491 [1,0,0,0,0,0|3,0,0]=4 174 B13R2.32 Clc1ccc2ccccc2c1I Amb25309391 [1,0,0,0,0,0|3,0,0]=4 175 B13R2.32 Fc1c(Cl)ccc2ccccc21 Amb25696316 [1,0,0,0,0,0|3,0,0]=4 176 B13R2.32 Fc1c(I)ccc2ccccc21 Amb22547558 [1,0,0,0,0,0|3,0,0]=4 177 B13R2.32 Fc1ccc2c(c1N)cccc2 Amb17594017 [1,0,0,0,0,0|3,0,0]=4 178 B13R2.32 Fc1ccc2ccccc2c1Br Amb25068848 [1,0,0,0,0,0|3,0,0]=4 179 B13R2.32 Fc1ccc2ccccc2c1Cl Amb25232022 [1,0,0,0,0,0|3,0,0]=4 180 B13R2.32 Fc1ccc2ccccc2c1F Amb24607338 [1,0,0,0,0,0|3,0,0]=4 181 B13R2.32 NC1C=Cc2ccccc2N1[K] Amb24603936 [1,0,0,0,0,0|2,0,1]=4 182 B13R2.32 NN1C(=N)C=Cc2ccccc12 Amb19894845 [1,0,0,0,0,0|2,0,0]=3 183 B13R2.32 NN1C(=O)CCc2ccccc12 Amb18645671 [1,0,0,0,0,0|1,0,2]=4 184 B13R2.32 NN1C(=O)CNc2ccccc12 Amb19929383 [1,0,0,0,0,0|2,0,1]=4 185 B13R2.32 NN1C(=O)CNc2ccccc12 Amb24540886 [1,0,0,0,0,0|2,0,1]=4 186 B13R2.32 Nc1c(I)ccc2ccccc21 Amb22491989 [1,0,0,0,0,0|3,0,0]=4 187 B13R2.32 Nc1ccc2c(c1C)cccc2 Amb17593938 [1,0,0,0,0,0|2,0,0]=3 188 B13R2.32 Nc1ccc2c(c1C)nccc2 Amb1116383 [1,0,0,0,0,0|3,0,0]=4 189 B13R2.32 Nc1ccc2c(c1N)cccc2 Amb16191900 [1,0,0,0,0,0|3,0,0]=4 190 B13R2.32 Nc1ccc2c(c1O)cccc2 Amb17593980 [1,0,0,0,0,0|3,0,0]=4 191 B13R2.32 Nc1ccc2ccccc2c1Br Amb19374680 [1,0,0,0,0,0|3,0,0]=4 192 B13R2.32 Nc1ccc2ccccc2c1F Amb22497545 [1,0,0,0,0,0|3,0,0]=4 193 B13R2.32 Nc1ccc2ccccc2c1O Amb19930160 [1,0,0,0,0,0|3,0,0]=4 194 B13R2.32 Nc1ccc2ccccc2c1S Amb18647914 [1,0,0,0,0,0|3,0,0]=4 195 B13R2.32 Nn1c(=O)ccc2c1cccc2 Amb10553630 [1,0,0,0,0,0|1,0,0]=2 196 B13R2.32 O=C1C=Cc2cc[n]cc2C1=O Amb25066405 [1,0,0,0,0,0|3,0,0]=4 197 B13R2.32 O=C1C=Nc2ccccc2C1=O Amb24722889 [1,0,0,0,0,0|3,0,0]=4 198 B13R2.32 O=C1CCc2c(N1C)cccc2 Amb17322846 [1,0,0,0,0,0|0,0,2]=3 199 B13R2.32 O=C1CCc2c(N1O)cccc2 Amb1099957 [1,0,0,0,0,0|1,0,2]=4 200 B13R2.32 O=C1COc2c(N1C)cccc2 Amb1351378 [1,0,0,0,0,0|1,0,1]=3 201 B13R2.32 O=C1COc2c(N1O)cccc2 Amb2423861 [1,0,0,0,0,0|2,0,1]=4 202 B13R2.32 O=C1NC=C2C=CC=CC2=C1F Amb25269874 [1,0,0,0,0,0|3,0,0]=4 203 B13R2.32 O=C1NC=C2C=CC=CC2=C1I Amb25238851 [1,0,0,0,0,0|3,0,0]=4 204 B13R2.32 O=C1c2ccc[n]c2C=CC1=O Amb24081305 [1,0,0,0,0,0|3,0,0]=4 205 B13R2.32 OC=1C(=O)NC=C2C=CC=CC21 Amb24632621 [1,0,0,0,0,0|3,0,0]=4 206 B13R2.32 ON1C(=O)C=Cc2ccccc12 Amb22723451 [1,0,0,0,0,0|1,0,0]=2 207 B13R2.32 ON1C(=O)NCc2ccccc12 Amb25124767 [1,0,0,0,0,0|2,0,1]=4 208 B13R2.32 ON1C(=O)OCc2ccccc12 Amb24086560 [1,0,0,0,0,0|2,0,1]=4 209 B13R2.32 Oc1c(F)ccc2ccccc21 Amb18645623 [1,0,0,0,0,0|3,0,0]=4 210 B13R2.32 Oc1c(S)ccc2ccccc21 Amb18647979 [1,0,0,0,0,0|2,1,0]=4 211 B13R2.32 Oc1ccc2c(c1Cl)cccc2 Amb17594574 [1,0,0,0,0,0|2,0,1]=4 212 B13R2.32 Oc1ccc2c(c1N)cccc2 Amb1088955 [1,0,0,0,0,0|2,0,1]=4 213 B13R2.32 Oc1ccc2ccccc2c1F Amb18645624 [1,0,0,0,0,0|2,0,1]=4 214 B13R2.32 Oc1ccc2ccccc2c1O Amb18054059 [1,0,0,0,0,0|2,0,1]=4 215 B13R2.32 Oc1ccc2ccccc2c1S Amb20093303 [1,0,0,0,0,0|2,0,1]=4 216 B13R2.32 Sc1ccc2c(c1N)cccc2 Amb17594453 [1,0,0,0,0,0|2,1,0]=4 217 B13R2.32 [NH3+]c1c(O)ccc2ccccc21 Amb22489532 [1,0,0,0,0,0|2,0,1]=4 218 B13R2.32 [O-][n+]1c(N)ccc2c1cccc2 Amb10565848 [1,0,0,0,0,0|2,0,1]=4 219 B13R2.328 Brc1cc2ccccc2c(Br)c1 Amb24060654 [1,0,0,0,0,0|3,0,0]=4 220 B13R2.328 Brc1cc2ccccc2c(c1)N Amb17596048 [1,0,0,0,0,0|3,0,0]=4 221 B13R2.328 Brc1cc2ccccc2c(c1)O Amb17596075 [1,0,0,0,0,0|2,0,0]=3 222 B13R2.328 C=C1NC(=O)Nc2ccccc21 Amb25150937 [1,0,0,0,0,0|2,0,0]=3 223 B13R2.328 C=C1OC(=O)Nc2ccccc21 Amb24497158 [1,0,0,0,0,0|2,0,0]=3 224 B13R2.328 C=C1SC(=O)Nc2ccccc21 Amb25241617 [1,0,0,0,0,0|2,0,0]=3 225 B13R2.328 CC1=CC(=O)C=C2C=CC=CN21 Amb24380800 [1,0,0,0,0,0|3,0,0]=4 226 B13R2.328 CC1=CC(=O)N=C2C=CC=CN21 Amb20655584 [1,0,0,0,0,0|2,0,1]=4 227 B13R2.328 CC1=CC(=O)Nc2cc[n]cc21 Amb18015580 [1,0,0,0,0,0|2,0,0]=3 228 B13R2.328 CC1=CC(=O)Nc2ccccc21 Amb19654011 [1,0,0,0,0,0|1,0,0]=2 229 B13R2.328 CC1=CC(=O)Oc2ccccc21 Amb20001467 [1,0,0,0,0,0|2,0,0]=3 230 B13R2.328 CC1=CC(=O)[N]2=CC=CC=C2N1 Amb17771529 [1,0,0,0,0,0|2,0,1]=4 231 B13R2.328 CC1=CC(=O)c2[n]cccc2N1 Amb24497195 [1,0,0,0,0,0|2,0,1]=4 232 B13R2.328 CC1=CC(=O)c2cc[n]cc2N1 Amb25759073 [1,0,0,0,0,0|2,0,1]=4 233 B13R2.328 CC1=CC(=O)c2ccccc2N1 Amb18368798 [1,0,0,0,0,0|1,0,1]=3 234 B13R2.328 CC1=CC(=O)c2ccccc2O1 Amb19666848 [1,0,0,0,0,0|2,0,1]=4 235 B13R2.328 CC1=CC(=O)c2ccccc2S1 Amb20414518 [1,0,0,0,0,0|2,0,1]=4 236 B13R2.328 CC1=CC(=S)Nc2cc[n]cc21 Amb18528730 [1,0,0,0,0,0|2,1,0]=4 237 B13R2.328 CC1=CC(=S)Nc2ccccc21 Amb18010309 [1,0,0,0,0,0|1,1,0]=3 238 B13R2.328 CC1=CC(=S)Oc2ccccc21 Amb19200772 [1,0,0,0,0,0|2,1,0]=4 239 B13R2.328 CC1=CC(=S)c2ccccc2S1 Amb20651777 [1,0,0,0,0,0|2,1,0]=4 240 B13R2.328 CC1=CC(Cl)Nc2ccccc21 Amb22228711 [1,0,0,0,0,0|2,0,1]=4 241 B13R2.328 CC1CC(=O)Nc2ccccc12 Amb17836212 [1,0,0,0,0,0|1,0,2]=4 242 B13R2.328 CC1NC(=O)Nc2ccccc21 Amb22756019 [1,0,0,0,0,0|2,0,1]=4 243 B13R2.328 CC1OC(=O)Nc2ccccc21 Amb25063171 [1,0,0,0,0,0|2,0,1]=4 244 B13R2.328 CC=1NC(=O)C=C2C=CC=CC21 Amb22371049 [1,0,0,0,0,0|3,0,0]=4 245 B13R2.328 CC=1NC(=O)N=C2C=CC=CC21 Amb22493795 [1,0,0,0,0,0|2,0,1]=4 246 B13R2.328 CC=1Nc2ccccc2C(=O)N1 Amb19844242 [1,0,0,0,0,0|2,0,1]=4 247 B13R2.328 CN1CC(=O)Nc2ccccc12 Amb21864918 [1,0,0,0,0,0|2,0,1]=4 248 B13R2.328 CS1=NC(=O)Nc2ccccc12 Amb25372251 [1,0,0,0,0,0|3,0,0]=4 249 B13R2.328 C[C@@H]1CC(=O)Nc2ccccc21 Amb24445921 [1,0,0,0,0,0|1,0,2]=4 250 B13R2.328 C[C@H]1CC(=O)Nc2ccccc21 Amb25335663 [1,0,0,0,0,0|1,0,2]=4 251 B13R2.328 C[n+]1cc2ccccc2c(c1)O Amb10553824 [1,0,0,0,0,0|3,0,0]=4 252 B13R2.328 C[n+]1cc2ccccc2c(c1)O Amb10553834 [1,0,0,0,0,0|3,0,0]=4 253 B13R2.328 Cc1cc(Br)[n]c2ccccc21 Amb18355120 [1,0,0,0,0,0|2,0,1]=4 254 B13R2.328 Cc1cc(Cl)c2ccccc2[n]1 Amb20234731 [1,0,0,0,0,0|2,0,1]=4 255 B13R2.328 Cc1cc(Cl)c2ccccc2[n]1 Amb22496125 [1,0,0,0,0,0|2,0,1]=4 256 B13R2.328 Cc1cc(F)[n]c2ccccc21 Amb25196536 [1,0,0,0,0,0|2,0,1]=4 257 B13R2.328 Cc1cc(I)c2ccccc2[n]1 Amb22756186 [1,0,0,0,0,0|2,0,1]=4 258 B13R2.328 Cc1cc(I)cc2ccccc21 Amb24427637 [1,0,0,0,0,0|3,0,0]=4 259 B13R2.328 Cc1cc(N)c2c(n1)cccc2 Amb11032603 [1,0,0,0,0,0|2,0,1]=4 260 B13R2.328 Cc1cc(N)c2c(n1)cccc2 Amb1204080 [1,0,0,0,0,0|2,0,1]=4 261 B13R2.328 Cc1cc(N)c2ccccc2[n]1 Amb24065825 [1,0,0,0,0,0|2,0,1]=4 262 B13R2.328 Cc1cc(N)cc2ccccc21 Amb18126074 [1,0,0,0,0,0|3,0,0]=4 263 B13R2.328 Cc1cc(O)c2c(n1)cccc2 Amb1796824 [1,0,0,0,0,0|1,0,1]=3 264 B13R2.328 Cc1cc(O)c2ccc[n]c2c1 Amb23589101 [1,0,0,0,0,0|3,0,0]=4 265 B13R2.328 Cc1cc(O)cc2ccccc21 Amb18645052 [1,0,0,0,0,0|2,0,1]=4 266 B13R2.328 Cc1cc2c[n]ccc2c(O)c1 Amb25086609 [1,0,0,0,0,0|3,0,0]=4 267 B13R2.328 Cc1cc2ccc[n]c2c(O)c1 Amb18645162 [1,0,0,0,0,0|3,0,0]=4 268 B13R2.328 Cc1cc2ccccc2c(Br)c1 Amb20669369 [1,0,0,0,0,0|3,0,0]=4 269 B13R2.328 Cc1cc2ccccc2c(F)c1 Amb25204458 [1,0,0,0,0,0|3,0,0]=4 270 B13R2.328 Cc1cc2ccccc2c(N)c1 Amb18644932 [1,0,0,0,0,0|3,0,0]=4 271 B13R2.328 Cc1cc2ccccc2c(O)[n]1 Amb18645154 [1,0,0,0,0,0|3,0,0]=4 272 B13R2.328 Cc1cc2ccccc2c(O)c1 Amb18645049 [1,0,0,0,0,0|2,0,0]=3 273 B13R2.328 Clc1cc(Br)[n]c2ccccc21 Amb22263015 [1,0,0,0,0,0|2,0,1]=4 274 B13R2.328 Clc1cc(Br)c2ccccc2[n]1 Amb25150013 [1,0,0,0,0,0|2,0,1]=4 275 B13R2.328 Clc1cc(Br)cc2ccccc21 Amb22641869 [1,0,0,0,0,0|3,0,0]=4 276 B13R2.328 Clc1cc(C)c2c(n1)cccc2 Amb1351694 [1,0,0,0,0,0|2,0,1]=4 277 B13R2.328 Clc1cc(I)[n]c2ccccc21 Amb25232256 [1,0,0,0,0,0|2,0,1]=4 278 B13R2.328 Clc1cc(I)cc2ccccc21 Amb25217612 [1,0,0,0,0,0|3,0,0]=4 279 B13R2.328 Clc1cc2ccccc2c(I)c1 Amb24718958 [1,0,0,0,0,0|3,0,0]=4 280 B13R2.328 Clc1cc2ccccc2c(c1)N Amb17594522 [1,0,0,0,0,0|3,0,0]=4 281 B13R2.328 Clc1cc2ccccc2c(c1)O Amb17594569 [1,0,0,0,0,0|2,0,0]=3 282 B13R2.328 Fc1cc(Br)[n]c2ccccc21 Amb24483726 [1,0,0,0,0,0|2,0,1]=4 283 B13R2.328 Fc1cc(Cl)[n]c2ccccc21 Amb24064934 [1,0,0,0,0,0|2,0,1]=4 284 B13R2.328 Fc1cc(I)cc2ccccc21 Amb22547559 [1,0,0,0,0,0|3,0,0]=4 285 B13R2.328 Fc1cc2ccccc2c(Cl)c1 Amb25121500 [1,0,0,0,0,0|3,0,0]=4 286 B13R2.328 Ic1cc2ccccc2c(I)c1 Amb25848812 [1,0,0,0,0,0|3,0,0]=4 287 B13R2.328 N=C1N=C(O)c2ccccc2S1 Amb22572494 [1,0,0,0,0,0|3,0,0]=4 288 B13R2.328 N=C1NC(=O)Cc2ccccc21 Amb25309609 [1,0,0,0,0,0|3,0,0]=4 289 B13R2.328 NC1=CC(=O)N=C2C=CC=CN21 Amb18645474 [1,0,0,0,0,0|2,0,1]=4 290 B13R2.328 NC1=CC(=O)Nc2ccccc21 Amb18645325 [1,0,0,0,0,0|1,0,0]=2 291 B13R2.328 NC1=CC(=O)Oc2ccccc21 Amb18645456 [1,0,0,0,0,0|2,0,0]=3 292 B13R2.328 NC1=CC(=O)c2ccccc2N1 Amb21856421 [1,0,0,0,0,0|1,0,1]=3 293 B13R2.328 NC1=CC(=O)c2ccccc2O1 Amb19870090 [1,0,0,0,0,0|2,0,1]=4 294 B13R2.328 NC1=CC(=O)c2ccccc2S1 Amb25097114 [1,0,0,0,0,0|2,0,1]=4 295 B13R2.328 NC1=NC(=O)Nc2[n]cccc21 Amb18026135 [1,0,0,0,0,0|3,0,0]=4 296 B13R2.328 NC1=NC(=O)Nc2ccc[n]c21 Amb25100995 [1,0,0,0,0,0|3,0,0]=4 297 B13R2.328 NC1=NC(=O)Oc2ccccc21 Amb25751273 [1,0,0,0,0,0|3,0,0]=4 298 B13R2.328 NC1=NC(=S)Nc2ccccc21 Amb18048537 [1,0,0,0,0,0|2,1,0]=4 299 B13R2.328 NC1CC(=O)Nc2ccccc21 Amb22586933 [1,0,0,0,0,0|1,0,2]=4 300 B13R2.328 NC=1NC(=O)C=C2C=CC=CC21 Amb24511574 [1,0,0,0,0,0|3,0,0]=4 301 B13R2.328 NC=1NC(=O)N=C2C=CC=CC21 Amb22015224 [1,0,0,0,0,0|2,0,1]=4 302 B13R2.328 NC=1Nc2ccccc2C(=O)N1 Amb19665071 [1,0,0,0,0,0|2,0,1]=4 303 B13R2.328 NN1CC(=O)Nc2ccccc12 Amb18645826 [1,0,0,0,0,0|2,0,1]=4 304 B13R2.328 N[C@@H]1CC(=O)Nc2ccccc21 Amb25766431 [1,0,0,0,0,0|1,0,2]=4 305 B13R2.328 Nc1[n]c2ccccc2c(O)[n]1 Amb18645457 [1,0,0,0,0,0|2,0,1]=4 306 B13R2.328 Nc1cc(Br)[n]c2ccccc21 Amb20248088 [1,0,0,0,0,0|2,0,1]=4 307 B13R2.328 Nc1cc(Br)c2c(n1)cccc2 Amb10070902 [1,0,0,0,0,0|2,0,1]=4 308 B13R2.328 Nc1cc(C)c2c(n1)cccc2 Amb1994857 [1,0,0,0,0,0|2,0,1]=4 309 B13R2.328 Nc1cc(C)c2c(n1)cccc2 Amb1994874 [1,0,0,0,0,0|2,0,1]=4 310 B13R2.328 Nc1cc(Cl)[n]c2ccccc21 Amb18648199 [1,0,0,0,0,0|2,0,1]=4 311 B13R2.328 Nc1cc(Cl)[n]c2ccccc21 Amb22275993 [1,0,0,0,0,0|2,0,1]=4 312 B13R2.328 Nc1cc(Cl)c2ccccc2[n]1 Amb18648192 [1,0,0,0,0,0|2,0,1]=4 313 B13R2.328 Nc1cc(F)c2ccccc2[n]1 Amb25760167 [1,0,0,0,0,0|2,0,1]=4 314 B13R2.328 Nc1cc(O)cc2ccccc21 Amb18048469 [1,0,0,0,0,0|2,0,1]=4 315 B13R2.328 Nc1cc2ccccc2c(F)c1 Amb22497546 [1,0,0,0,0,0|3,0,0]=4 316 B13R2.328 Nc1cc2ccccc2c(c1)Br Amb17596046 [1,0,0,0,0,0|3,0,0]=4 317 B13R2.328 Nc1cc2ccccc2c(c1)Cl Amb17594518 [1,0,0,0,0,0|3,0,0]=4 318 B13R2.328 Nc1cc2ccccc2c(c1)N Amb17593963 [1,0,0,0,0,0|3,0,0]=4 319 B13R2.328 Nc1cc2ccccc2c(c1)O Amb17593981 [1,0,0,0,0,0|2,0,0]=3 320 B13R2.328 O=C1C=C(Br)c2ccccc2N1 Amb21520307 [1,0,0,0,0,0|1,0,0]=2 321 B13R2.328 O=C1C=C(Br)c2ccccc2O1 Amb20248285 [1,0,0,0,0,0|2,0,0]=3 322 B13R2.328 O=C1C=C(Cl)Nc2ccccc21 Amb22500808 [1,0,0,0,0,0|1,0,1]=3 323 B13R2.328 O=C1C=C(Cl)c2ccc[n]c2N1 Amb22753696 [1,0,0,0,0,0|2,0,0]=3 324 B13R2.328 O=C1C=C(Cl)c2ccccc2N1 Amb19516664 [1,0,0,0,0,0|1,0,0]=2 325 B13R2.328 O=C1C=C(Cl)c2ccccc2O1 Amb20414537 [1,0,0,0,0,0|2,0,0]=3 326 B13R2.328 O=C1C=C(Cl)c2ccccc2S1 Amb20663397 [1,0,0,0,0,0|2,0,0]=3 327 B13R2.328 O=C1C=C(F)c2ccccc2O1 Amb24553071 [1,0,0,0,0,0|2,0,0]=3 328 B13R2.328 O=C1C=C(S)Nc2ccccc21 Amb25197872 [1,0,0,0,0,0|0,1,1]=3 329 B13R2.328 O=C1C=C(S)c2ccccc2O1 Amb24446596 [1,0,0,0,0,0|1,1,0]=3 330 B13R2.328 O=C1C=C2C=CC=CC2=C(Cl)N1 Amb25364291 [1,0,0,0,0,0|3,0,0]=4 331 B13R2.328 O=C1CC(=O)Nc2cc[n]cc12 Amb25194953 [1,0,0,0,0,0|1,0,2]=4 332 B13R2.328 O=C1CC(=O)Nc2ccccc12 Amb22263121 [1,0,0,0,0,0|0,0,2]=3 333 B13R2.328 O=C1CC(=O)Oc2ccccc12 Amb19748567 [1,0,0,0,0,0|1,0,2]=4 334 B13R2.328 O=C1CC(=O)Sc2ccccc12 Amb24633520 [1,0,0,0,0,0|1,0,2]=4 335 B13R2.328 O=C1CC(=O)c2ccc[n]c2N1 Amb25698340 [1,0,0,0,0,0|1,0,2]=4 336 B13R2.328 O=C1CC(N)c2c(N1)cccc2 Amb10607650 [1,0,0,0,0,0|1,0,2]=4 337 B13R2.328 O=C1CS(=O)c2ccccc2N1 Amb25733529 [1,0,0,0,0,0|1,0,2]=4 338 B13R2.328 O=C1Cc2ccccc2C(=S)N1 Amb17843901 [1,0,0,0,0,0|2,1,0]=4 339 B13R2.328 O=C1N=C(S)Nc2ccccc21 Amb19748659 [1,0,0,0,0,0|1,1,1]=4 340 B13R2.328 O=C1NC(=O)Oc2ccccc12 Amb20243206 [1,0,0,0,0,0|2,0,1]=4 341 B13R2.328 O=C1NC(=O)Sc2ccccc12 Amb22036855 [1,0,0,0,0,0|2,0,1]=4 342 B13R2.328 O=C1NC(=O)c2c(C1)cccc2 Amb1221580 [1,0,0,0,0,0|2,0,1]=4 343 B13R2.328 O=C1NC(=S)Nc2ccccc21 Amb18010655 [1,0,0,0,0,0|1,1,1]=4 344 B13R2.328 O=C1NC(=S)c2ccc[n]c2N1 Amb25327535 [1,0,0,0,0,0|2,1,0]=4 345 B13R2.328 O=C1NC(=S)c2ccccc2S1 Amb24341894 [1,0,0,0,0,0|2,1,0]=4 346 B13R2.328 O=C1Nc2[n]cccc2C(=O)N1 Amb22001013 [1,0,0,0,0,0|2,0,1]=4 347 B13R2.328 O=C1Nc2[n]cccc2C(=O)O1 Amb19325140 [1,0,0,0,0,0|2,0,1]=4 348 B13R2.328 O=C1Nc2c[n]ccc2C(=O)N1 Amb19515865 [1,0,0,0,0,0|2,0,1]=4 349 B13R2.328 O=C1Nc2cc[n]cc2C(=O)N1 Amb22234336 [1,0,0,0,0,0|2,0,1]=4 350 B13R2.328 O=C1Nc2ccc[n]c2C(=O)N1 Amb20242004 [1,0,0,0,0,0|2,0,1]=4 351 B13R2.328 O=C1Nc2ccccc2C(=O)N1 Amb18005794 [1,0,0,0,0,0|1,0,1]=3 352 B13R2.328 O=C1Nc2ccccc2C(Cl)=N1 Amb22371858 [1,0,0,0,0,0|2,0,0]=3 353 B13R2.328 O=C1OC(=O)Nc2c[n]ccc12 Amb24422945 [1,0,0,0,0,0|2,0,1]=4 354 B13R2.328 O=C1OC(=O)Nc2ccccc12 Amb18183505 [1,0,0,0,0,0|1,0,1]=3 355 B13R2.328 O=C1OC(=O)c2c(C1)cccc2 Amb1157145 [1,0,0,0,0,0|2,0,1]=4 356 B13R2.328 O=C1OC(=S)Nc2ccccc21 Amb24086333 [1,0,0,0,0,0|1,1,1]=4 357 B13R2.328 O=c1[nH]c2ccccc2c(=O)[nH]1 Amb1157217 [1,0,0,0,0,0|1,0,1]=3 358 B13R2.328 O=c1[s]c(=O)[nH]c2ccccc12 Amb24065644 [1,0,0,0,0,0|1,0,1]=3 359 B13R2.328 O=c1cc(N)c2c(o1)cccc2 Amb2388638 [1,0,0,0,0,0|2,0,0]=3 360 B13R2.328 O=c1cc(O)c2c([nH]1)cccc2 Amb1146861 [1,0,0,0,0,0|0,0,0]=1 361 B13R2.328 O=c1cc(O)c2c([nH]1)nccc2 Amb2388686 [1,0,0,0,0,0|1,0,0]=2 362 B13R2.328 O=c1cc(O)c2c(o1)cccc2 Amb1151858 [1,0,0,0,0,0|1,0,0]=2 363 B13R2.328 O=c1nc(O)c2c(s1)cccc2 Amb2502845 [1,0,0,0,0,0|2,0,0]=3 364 B13R2.328 O=c1oc(=O)[nH]c2ccc[n]c12 Amb24100800 [1,0,0,0,0,0|2,0,1]=4 365 B13R2.328 OB1NC(=O)Nc2ccccc21 Amb25315057 [1,0,0,0,0,0|2,0,0]=3 366 B13R2.328 OC1=CC(=O)N=C2C=CC=CN21 Amb19932151 [1,0,0,0,0,0|1,0,1]=3 367 B13R2.328 OC1=CC(=O)Nc2[n]cccc21 Amb20662029 [1,0,0,0,0,0|1,0,0]=2 368 B13R2.328 OC1=CC(=O)Nc2c[n]ccc21 Amb22494124 [1,0,0,0,0,0|1,0,0]=2 369 B13R2.328 OC1=CC(=O)Nc2ccc[n]c21 Amb22372203 [1,0,0,0,0,0|1,0,0]=2 370 B13R2.328 OC1=CC(=O)Nc2ccccc21 Amb18002636 [1,0,0,0,0,0|0,0,0]=1 371 B13R2.328 OC1=CC(=O)Oc2ccccc21 Amb18372000 [1,0,0,0,0,0|1,0,0]=2 372 B13R2.328 OC1=CC(=O)Sc2ccccc21 Amb19517275 [1,0,0,0,0,0|1,0,0]=2 373 B13R2.328 OC1=CC(=S)Oc2ccccc21 Amb24572900 [1,0,0,0,0,0|1,1,0]=3 374 B13R2.328 OC1=CC(O)Oc2ccccc12 Amb24474149 [1,0,0,0,0,0|1,0,2]=4 375 B13R2.328 OC1=NC(=O)Sc2ccccc21 Amb20651211 [1,0,0,0,0,0|2,0,0]=3 376 B13R2.328 OC1=NC(=S)Nc2ccccc21 Amb22527681 [1,0,0,0,0,0|1,1,0]=3 377 B13R2.328 OC1=NC(=S)Sc2ccccc21 Amb22572201 [1,0,0,0,0,0|2,1,0]=4 378 B13R2.328 OC1CC(=O)Cc2ccccc21 Amb24707065 [1,0,0,0,0,0|1,0,2]=4 379 B13R2.328 OC1NC(=O)Oc2ccccc21 Amb25278301 [1,0,0,0,0,0|2,0,1]=4 380 B13R2.328 OC=1Cc2ccccc2C(=O)C1 Amb24060177 [1,0,0,0,0,0|1,0,2]=4 381 B13R2.328 Oc1[n]c(Br)[n]c2ccccc21 Amb20618706 [1,0,0,0,0,0|2,0,1]=4 382 B13R2.328 Oc1cc(=O)oc2ccccc21 Amb24078542 [1,0,0,0,0,0|1,0,0]=2 383 B13R2.328 Oc1cc(Br)[n]c2[n]cccc21 Amb25313324 [1,0,0,0,0,0|2,0,1]=4 384 B13R2.328 Oc1cc(Br)[n]c2ccccc21 Amb22500448 [1,0,0,0,0,0|1,0,1]=3 385 B13R2.328 Oc1cc(Br)cc2[n]cccc21 Amb21964828 [1,0,0,0,0,0|3,0,0]=4 386 B13R2.328 Oc1cc(Br)cc2ccc[n]c21 Amb23399826 [1,0,0,0,0,0|3,0,0]=4 387 B13R2.328 Oc1cc(Cl)[n]c2ccccc21 Amb19957815 [1,0,0,0,0,0|1,0,1]=3 388 B13R2.328 Oc1cc(Cl)cc2[n]cccc21 Amb22276074 [1,0,0,0,0,0|3,0,0]=4 389 B13R2.328 Oc1cc(Cl)cc2ccc[n]c21 Amb22886928 [1,0,0,0,0,0|3,0,0]=4 390 B13R2.328 Oc1cc(F)cc2[n]cccc21 Amb23437357 [1,0,0,0,0,0|3,0,0]=4 391 B13R2.328 Oc1cc(F)cc2ccc[n]c21 Amb22234249 [1,0,0,0,0,0|3,0,0]=4 392 B13R2.328 Oc1cc(I)[n]c2ccccc21 Amb25148687 [1,0,0,0,0,0|1,0,1]=3 393 B13R2.328 Oc1cc(I)c2ccccc2[n]1 Amb25148736 [1,0,0,0,0,0|1,0,2]=4 394 B13R2.328 Oc1cc(I)cc2[n]cccc21 Amb23437361 [1,0,0,0,0,0|3,0,0]=4 395 B13R2.328 Oc1cc(I)cc2ccc[n]c21 Amb23437359 [1,0,0,0,0,0|3,0,0]=4 396 B13R2.328 Oc1cc(O)c2c(n1)cccc2 Amb1104174 [1,0,0,0,0,0|0,0,2]=3 397 B13R2.328 Oc1cc(O)c2c[n]ccc2[n]1 Amb18645591 [1,0,0,0,0,0|1,0,2]=4 398 B13R2.328 Oc1cc2[n]cccc2c(O)c1 Amb24484214 [1,0,0,0,0,0|2,0,1]=4 399 B13R2.328 Oc1cc2cc[n]cc2c(O)c1 Amb24497362 [1,0,0,0,0,0|2,0,1]=4 400 B13R2.328 Oc1cc2ccccc2c(c1)Br Amb17596081 [1,0,0,0,0,0|2,0,1]=4 401 B13R2.328 S=C1Nc2ccccc2C(=S)N1 Amb19205460 [1,0,0,0,0,0|1,2,0]=4 402 B13R2.328 S=C1SC(=S)Nc2ccccc12 Amb19654095 [1,0,0,0,0,0|1,2,0]=4 403 B13R2.328 S=c1cc(C)c2c([nH]1)cccc2 Amb2468572 [1,0,0,0,0,0|1,1,0]=3 404 B13R2.328 Sc1cc(C)c2c(n1)cccc2 Amb1104121 [1,0,0,0,0,0|1,1,1]=4 405 B13R2.328 [O-]C1=CC(=O)Nc2cccc[n+]21 Amb20415253 [1,0,0,0,0,0|1,0,1]=3 406 B13R2.328 [O-]C1=CC(=O)Nc2ccccc21 Amb22731733 [1,0,0,0,0,0|0,0,1]=2 407 B13R2.328 [O-][N+]1=NC(=O)Nc2ccccc12 Amb20527610 [1,0,0,0,0,0|2,0,1]=4 408 B13R2.328 [O-]c1cc(O)[n]c2ccccc21 Amb22336461 [1,0,0,0,0,0|0,0,3]=4 409 B13R2.371 Brc1ccc(c2c1cccc2)N Amb2234802 [1,0,0,0,0,0|3,0,0]=4 410 B13R2.371 Brc1ccc(c2c1cccn2)C Amb2234894 [1,0,0,0,0,0|3,0,0]=4 411 B13R2.371 Brc1ccc(c2c1cccn2)O Amb2500199 [1,0,0,0,0,0|3,0,0]=4 412 B13R2.371 CC1C=CC(N)c2ccccc21 Amb18645216 [1,0,0,0,0,0|2,0,1]=4 413 B13R2.371 CN1C=CC(=O)c2ccccc12 Amb18048473 [1,0,0,0,0,0|0,0,1]=2 414 B13R2.371 CN1C=CC(O)c2ccccc12 Amb25324366 [1,0,0,0,0,0|0,0,1]=2 415 B13R2.371 CN1C=NC(=O)c2ccccc12 Amb22752698 [1,0,0,0,0,0|1,0,1]=3 416 B13R2.371 CN1C=NC(O)c2ccccc12 Amb24099682 [1,0,0,0,0,0|1,0,1]=3 417 B13R2.371 CN1CCC(=O)c2ccccc12 Amb18560299 [1,0,0,0,0,0|0,0,3]=4 418 B13R2.371 CN1CCC(O)c2ccccc12 Amb22372300 [1,0,0,0,0,0|0,0,3]=4 419 B13R2.371 C[N+]1=CNC(=O)c2ccccc12 Amb24447072 [1,0,0,0,0,0|1,0,2]=4 420 B13R2.371 C[n+]1[n]cc(N)c2ccccc12 Amb25188018 [1,0,0,0,0,0|2,0,1]=4 421 B13R2.371 C[n+]1cc[n+](c2c1cccc2)[O-] Amb10553662 [1,0,0,0,0,0|1,0,2]=4 422 B13R2.371 C[n+]1ccc(c2c1cccc2)C Amb10553447 [1,0,0,0,0,0|1,0,1]=3 423 B13R2.371 C[n+]1ccc(c2c1cccc2)C Amb10553450 [1,0,0,0,0,0|1,0,1]=3 424 B13R2.371 C[n+]1ncc(c2c1cccc2)N Amb10553682 [1,0,0,0,0,0|2,0,1]=4 425 B13R2.371 Cc1[n]cc(Br)c2ccccc21 Amb22757013 [1,0,0,0,0,0|3,0,0]=4 426 B13R2.371 Cc1[n]cc(Cl)c2ccccc21 Amb25736337 [1,0,0,0,0,0|3,0,0]=4 427 B13R2.371 Cc1[n]cc(N)c2ccccc21 Amb22753790 [1,0,0,0,0,0|3,0,0]=4 428 B13R2.371 Cc1[n]cc(O)c2ccccc21 Amb24079648 [1,0,0,0,0,0|2,0,0]=3 429 B13R2.371 Cc1c[n][n+](C)c2ccccc12 Amb25830205 [1,0,0,0,0,0|2,0,1]=4 430 B13R2.371 Cc1c[n]c(Br)c2ccccc21 Amb18346618 [1,0,0,0,0,0|3,0,0]=4 431 B13R2.371 Cc1c[n]c(C)c2ccccc12 Amb25261499 [1,0,0,0,0,0|3,0,0]=4 432 B13R2.371 Cc1c[n]c(Cl)c2ccccc21 Amb18346727 [1,0,0,0,0,0|3,0,0]=4 433 B13R2.371 Cc1c[n]c(N)c2ccccc21 Amb25700005 [1,0,0,0,0,0|3,0,0]=4 434 B13R2.371 Cc1c[n]c(O)c2ccccc21 Amb18645157 [1,0,0,0,0,0|2,0,0]=3 435 B13R2.371 Cc1cc[n+]([O-])c2ccccc21 Amb25071754 [1,0,0,0,0,0|2,0,1]=4 436 B13R2.371 Cc1ccc(Br)c2[n]cccc21 Amb23441933 [1,0,0,0,0,0|3,0,0]=4 437 B13R2.371 Cc1ccc(Br)c2c[n]ccc21 Amb18349261 [1,0,0,0,0,0|3,0,0]=4 438 B13R2.371 Cc1ccc(Br)c2cc[n]cc21 Amb19100707 [1,0,0,0,0,0|3,0,0]=4 439 B13R2.371 Cc1ccc(C)c2c[n]ccc12 Amb24487232 [1,0,0,0,0,0|3,0,0]=4 440 B13R2.371 Cc1ccc(C)c2ccc[n]c12 Amb19108422 [1,0,0,0,0,0|3,0,0]=4 441 B13R2.371 Cc1ccc(Cl)c2[n]cccc21 Amb21964462 [1,0,0,0,0,0|3,0,0]=4 442 B13R2.371 Cc1ccc(Cl)c2ccccc21 Amb22499152 [1,0,0,0,0,0|2,0,0]=3 443 B13R2.371 Cc1ccc(F)c2[n]cccc21 Amb23448836 [1,0,0,0,0,0|3,0,0]=4 444 B13R2.371 Cc1ccc(N)c2[n]cccc21 Amb18645059 [1,0,0,0,0,0|3,0,0]=4 445 B13R2.371 Cc1ccc(N)c2c[n]ccc21 Amb25774370 [1,0,0,0,0,0|3,0,0]=4 446 B13R2.371 Cc1ccc(N)c2cc[n]cc21 Amb25133266 [1,0,0,0,0,0|3,0,0]=4 447 B13R2.371 Cc1ccc(O)c2C=CCOc21 Amb25735174 [1,0,0,0,0,0|2,0,1]=4 448 B13R2.371 Cc1ccc(O)c2cc[n]cc21 Amb24524705 [1,0,0,0,0,0|2,0,0]=3 449 B13R2.371 Cc1ccc(O)c2ccc[n]c21 Amb22750815 [1,0,0,0,0,0|2,0,0]=3 450 B13R2.371 Cc1ccc(S)c2ccc[n]c21 Amb24416647 [1,0,0,0,0,0|2,1,0]=4 451 B13R2.371 Cc1ccc(S)c2ccccc21 Amb25133203 [1,0,0,0,0,0|1,1,0]=3 452 B13R2.371 Cc1ccc(c2c1cccc2)C Amb16192902 [1,0,0,0,0,0|2,0,0]=3 453 B13R2.371 Clc1ccc(Cl)c2ccccc12 Amb20622401 [1,0,0,0,0,0|3,0,0]=4 454 B13R2.371 Clc1ccc(c2c1cccn2)O Amb1777292 [1,0,0,0,0,0|3,0,0]=4 455 B13R2.371 Clc1ncc(c2c1cccc2)O Amb16231030 [1,0,0,0,0,0|3,0,0]=4 456 B13R2.371 Fc1ccc(Cl)c2ccccc21 Amb24625777 [1,0,0,0,0,0|3,0,0]=4 457 B13R2.371 Fc1ccc(I)c2ccccc21 Amb24064704 [1,0,0,0,0,0|3,0,0]=4 458 B13R2.371 Fc1ccc(S)c2ccccc21 Amb25726189 [1,0,0,0,0,0|2,1,0]=4 459 B13R2.371 Fc1ccc(c2c1cccc2)N Amb17594016 [1,0,0,0,0,0|3,0,0]=4 460 B13R2.371 Fc1ccc(c2c1cccn2)O Amb2414034 [1,0,0,0,0,0|3,0,0]=4 461 B13R2.371 N=C1C=CC(=O)c2ccccc21 Amb25723201 [1,0,0,0,0,0|2,0,1]=4 462 B13R2.371 Nc1[n]cc(O)c2ccccc21 Amb25109263 [1,0,0,0,0,0|3,0,0]=4 463 B13R2.371 Nc1ccc(F)c2ccccc21 Amb23439059 [1,0,0,0,0,0|3,0,0]=4 464 B13R2.371 Nc1ccc(N)c2ccccc12 Amb22587376 [1,0,0,0,0,0|3,0,0]=4 465 B13R2.371 Nc1ccc(N)c2ccccc12 Amb23468554 [1,0,0,0,0,0|3,0,0]=4 466 B13R2.371 Nc1ccc(O)c2c[n]ccc21 Amb24109269 [1,0,0,0,0,0|3,0,0]=4 467 B13R2.371 Nc1ccc(c2c1cccc2)C Amb17200158 [1,0,0,0,0,0|2,0,0]=3 468 B13R2.371 Nc1ccc(c2c1cccc2)N Amb15701565 [1,0,0,0,0,0|3,0,0]=4 469 B13R2.371 Nc1ccc(c2c1cccn2)C Amb1119721 [1,0,0,0,0,0|3,0,0]=4 470 B13R2.371 OC1=CNC(=O)c2ccccc21 Amb19987031 [1,0,0,0,0,0|3,0,0]=4 471 B13R2.371 OC1=CNC(=S)c2ccccc21 Amb25207948 [1,0,0,0,0,0|3,0,0]=4 472 B13R2.371 OC1C=CC(=O)c2ccccc21 Amb25706969 [1,0,0,0,0,0|2,0,1]=4 473 B13R2.371 ON1C=NC(=O)c2ccccc12 Amb22752699 [1,0,0,0,0,0|2,0,1]=4 474 B13R2.371 Oc1c[n]c(O)c2ccccc12 Amb22295929 [1,0,0,0,0,0|3,0,0]=4 475 B13R2.371 Oc1ccc(Br)c2[n]cccc21 Amb22752324 [1,0,0,0,0,0|3,0,0]=4 476 B13R2.371 Oc1ccc(Cl)c2[n]cccc21 Amb19957335 [1,0,0,0,0,0|3,0,0]=4 477 B13R2.371 Oc1ccc(Cl)c2[n]cccc21 Amb24710944 [1,0,0,0,0,0|3,0,0]=4 478 B13R2.371 Oc1ccc(Cl)c2ccc[n]c12 Amb22736165 [1,0,0,0,0,0|3,0,0]=4 479 B13R2.371 Oc1ccc(F)c2[n]cccc21 Amb23437330 [1,0,0,0,0,0|3,0,0]=4 480 B13R2.371 Oc1ccc(F)c2c[n]ccc21 Amb25270993 [1,0,0,0,0,0|3,0,0]=4 481 B13R2.371 Oc1ccc(I)c2[n]cccc21 Amb23437331 [1,0,0,0,0,0|3,0,0]=4 482 B13R2.371 Oc1ccc(I)c2ccc[n]c21 Amb22234264 [1,0,0,0,0,0|3,0,0]=4 483 B13R2.371 Oc1ccc(I)c2ccccc21 Amb23402064 [1,0,0,0,0,0|2,0,0]=3 484 B13R2.371 Oc1ccc(O)c2ccc[n]c12 Amb18554404 [1,0,0,0,0,0|3,0,0]=4 485 B13R2.371 Oc1ccc(S)c2ccc[n]c21 Amb18127865 [1,0,0,0,0,0|3,0,0]=4 486 B13R2.371 Oc1ccc(c2c1cccc2)C Amb17200159 [1,0,0,0,0,0|1,0,0]=2 487 B13R2.371 Oc1ccc(c2c1cccc2)N Amb1154884 [1,0,0,0,0,0|2,0,0]=3 488 B13R2.371 Oc1ccc(c2c1cccc2)N Amb2371292 [1,0,0,0,0,0|2,0,0]=3 489 B13R2.371 Oc1ncc(c2c1cccc2)Br Amb16185652 [1,0,0,0,0,0|3,0,0]=4 490 B13R2.371 Oc1nnc(c2c1cccc2)C Amb2371419 [1,0,0,0,0,0|3,0,0]=4 491 B13R2.371 Sc1ccc(Br)c2ccccc21 Amb23580548 [1,0,0,0,0,0|2,1,0]=4 492 B13R2.371 Sc1ccc(c2c1cccc2)O Amb17594486 [1,0,0,0,0,0|2,0,0]=3 493 B13R2.371 [NH3+]c1ccc(O)c2ccccc21 Amb22034889 [1,0,0,0,0,0|2,0,0]=3 494 B13R2.371 [O-][n+]1ccc(c2c1cccc2)Cl Amb10553132 [1,0,0,0,0,0|2,0,1]=4 495 B15R2.6124 CC1=CC(=O)N(C=O)c2ccccc21 Amb24060064 [0,1,0,0,0,0|1,0,1]=3 496 B15R2.6124 CC1=CC(=O)c2ccccc2N1C=C Amb24568724 [0,1,0,0,0,0|1,0,2]=4 497 B15R2.6124 CC1=CC(=S)c2ccccc2N1CC Amb21862720 [0,1,0,0,0,0|1,1,0]=3 498 B15R2.6124 CCC1c2ccccc2C(=O)OC1=O Amb23580672 [0,1,0,0,0,0|2,0,1]=4 499 B15R2.6124 CCN1C(=O)C=C(Cl)c2ccccc12 Amb22463202 [0,1,0,0,0,0|1,0,0]=2 500 B15R2.6124 CCN1C(=O)C=C(N)c2[n]cccc12 Amb18650200 [0,1,0,0,0,0|2,0,0]=3 501 B15R2.6124 CCN1C(=O)C=C(O)c2ccc[n]c12 Amb20660821 [0,1,0,0,0,0|1,0,0]=2 502 B15R2.6124 CCN1C(=O)C=C(O)c2ccccc12 Amb19517249 [0,1,0,0,0,0|0,0,0]=1 503 B15R2.6124 CCN1C(=O)N=C(N)c2ccccc12 Amb24506507 [0,1,0,0,0,0|2,0,0]=3 504 B15R2.6124 CCN1c2ccccc2C(=O)NC1=O Amb19651650 [0,1,0,0,0,0|1,0,1]=3 505 B15R2.6124 CCN1c2ccccc2C(=O)OC1=O Amb18533334 [0,1,0,0,0,0|1,0,1]=3 506 B15R2.6124 CCc1c2ccccc2c(N)cc1N Amb25232517 [0,1,0,0,0,0|3,0,0]=4 507 B15R2.6124 CCn1c(=O)cc(c2c1cccc2)O Amb2387356 [0,1,0,0,0,0|0,0,0]=1 508 B15R2.6124 CCn1c(C)cc(=O)c2c1cccc2 Amb10976741 [0,1,0,0,0,0|1,0,1]=3 509 B15R2.6124 COC1C(=O)OC(=O)c2ccccc21 Amb23580684 [0,1,0,0,0,0|2,0,1]=4 510 B15R2.6124 COc1c(Cl)cc(O)c2ccccc21 Amb18656351 [0,1,0,0,0,0|2,0,0]=3 511 B15R2.6124 Cc1cc(Br)c2ccccc2c1NC Amb24705157 [0,1,0,0,0,0|3,0,0]=4 512 B15R2.6124 Cc1cc(C)c(CCl)c2ccccc12 Amb25685926 [0,1,0,0,0,0|3,0,0]=4 513 B15R2.6124 Cc1cc(Cl)c2ccccc2c1NC Amb24336664 [0,1,0,0,0,0|3,0,0]=4 514 B15R2.6124 Cc1cc(N)c2ccccc2c1CC Amb24451126 [0,1,0,0,0,0|3,0,0]=4 515 B15R2.6124 Cc1cc(O)c(OC)c2ccccc12 Amb24645460 [0,1,0,0,0,0|2,0,1]=4 516 B15R2.6124 Cc1cc(O)c2ccccc2c1C#N Amb24530477 [0,1,0,0,0,0|2,0,1]=4 517 B15R2.6124 Cc1cc(O)c2ccccc2c1OC Amb18649858 [0,1,0,0,0,0|2,0,0]=3 518 B15R2.6124 NC1=CC(=O)\C(=N/O)\c2ccccc21 Amb25264370 [0,1,0,0,0,0|3,0,0]=4 519 B15R2.9032 CC1=C(Br)C(=O)c2ccccc2N1C Amb24685157 [0,1,0,0,0,0|1,0,1]=3 520 B15R2.9032 CC1=C(I)C(=O)c2ccccc2N1C Amb25085011 [0,1,0,0,0,0|1,0,1]=3 521 B15R2.9032 CC1=C(N)c2ccccc2C(=O)C1=O Amb25114160 [0,1,0,0,0,0|3,0,0]=4 522 B15R2.9032 CC1=C(O)C(=O)c2ccccc2N1C Amb20242314 [0,1,0,0,0,0|1,0,1]=3 523 B15R2.9032 CC1=C(O)c2ccccc2C(=O)C1=O Amb24694636 [0,1,0,0,0,0|2,0,0]=3 524 B15R2.9032 CC1c2ccccc2C(=O)N(O)C1=O Amb25783634 [0,1,0,0,0,0|2,0,1]=4 525 B15R2.9032 CC=1C(=O)N(C)c2ccccc2C1Cl Amb19894905 [0,1,0,0,0,0|1,0,0]=2 526 B15R2.9032 CC=1C(=O)N(C)c2ccccc2C1N Amb18649967 [0,1,0,0,0,0|1,0,0]=2 527 B15R2.9032 CC=1C(=O)N(C)c2ccccc2C1O Amb19668039 [0,1,0,0,0,0|0,0,0]=1 528 B15R2.9032 CC=1C(=O)N(O)c2ccccc2[N+]1[O-] Amb19773770 [0,1,0,0,0,0|2,0,1]=4 529 B15R2.9032 CC=1c2ccccc2N(C)C(=O)C1Br Amb23448570 [0,1,0,0,0,0|1,0,0]=2 530 B15R2.9032 CC=1c2ccccc2N(C)C(=O)C1N Amb23448332 [0,1,0,0,0,0|1,0,0]=2 531 B15R2.9032 CC=1c2ccccc2N(C)C(=O)C1O Amb22751148 [0,1,0,0,0,0|1,0,0]=2 532 B15R2.9032 CN1C(=O)C(Br)=C(O)c2ccccc12 Amb20660833 [0,1,0,0,0,0|0,0,0]=1 533 B15R2.9032 CN1C(=O)C(Cl)=C(Cl)c2ccccc12 Amb22447977 [0,1,0,0,0,0|1,0,0]=2 534 B15R2.9032 CN1C(=O)C(Cl)=C(O)c2ccccc12 Amb19520628 [0,1,0,0,0,0|0,0,0]=1 535 B15R2.9032 CN1C(=O)C(I)=C(Cl)c2ccccc12 Amb23509158 [0,1,0,0,0,0|1,0,0]=2 536 B15R2.9032 CN1C(=O)C(I)=C(O)c2ccccc12 Amb19667473 [0,1,0,0,0,0|0,0,0]=1 537 B15R2.9032 CN1C(=O)C(N)=C(N)c2ccc[n]c12 Amb24695288 [0,1,0,0,0,0|2,0,0]=3 538 B15R2.9032 CN1C(=O)C(N)=C(O)c2ccccc12 Amb18650459 [0,1,0,0,0,0|0,0,0]=1 539 B15R2.9032 CN1C(=O)C(N)=C(O)c2ccccc12 Amb21927455 [0,1,0,0,0,0|0,0,0]=1 540 B15R2.9032 CN1C(=O)C(O)=C(O)c2ccccc12 Amb21912831 [0,1,0,0,0,0|0,0,0]=1 541 B15R2.9032 CN1C(=O)N(N)c2ccccc2C1=O Amb22896487 [0,1,0,0,0,0|2,0,1]=4 542 B15R2.9032 CN1C(=S)N(C)C(=O)c2ccccc12 Amb20462525 [0,1,0,0,0,0|1,1,1]=4 543 B15R2.9032 CN1c2[n]cccc2N(C)C(=O)C1=O Amb20249396 [0,1,0,0,0,0|3,0,0]=4 544 B15R2.9032 CN1c2cc[n]cc2N(C)C(=O)C1=O Amb25204271 [0,1,0,0,0,0|3,0,0]=4 545 B15R2.9032 CN1c2ccccc2C(=O)C(=O)C1=O Amb22750771 [0,1,0,0,0,0|0,0,1]=2 546 B15R2.9032 CN1c2ccccc2C(=O)N(C)C1=O Amb19653986 [0,1,0,0,0,0|1,0,1]=3 547 B15R2.9032 CN1c2ccccc2N(C)C(=O)C1=O Amb19654053 [0,1,0,0,0,0|2,0,0]=3 548 B15R2.9032 C[n]1c(=O)c(N)c(N)c2ccccc12 Amb24085450 [0,1,0,0,0,0|1,0,0]=2 549 B15R2.9032 Cc1c(Cl)c(O)c2ccccc2c1O Amb25713020 [0,1,0,0,0,0|3,0,0]=4 550 B15R2.9032 Cc1c(O)c2ccccc2c(O)c1C Amb18129767 [0,1,0,0,0,0|3,0,0]=4 551 B15R2.9032 Cc1c(S)c2ccccc2c(O)c1C Amb24583561 [0,1,0,0,0,0|3,0,0]=4 552 B15R2.9032 Cc1c2ccccc2c(C)c(O)c1O Amb25044329 [0,1,0,0,0,0|2,0,1]=4 553 B15R2.9032 NC1=C(Cl)C(=O)C(=O)c2ccccc21 Amb24435366 [0,1,0,0,0,0|3,0,0]=4 554 B15R2.9032 NN1c2ccccc2N(N)C(=O)C1=O Amb22461124 [0,1,0,0,0,0|3,0,0]=4 555 B15R2.9032 Nc1c(Cl)c(O)c2ccccc2c1O Amb25698382 [0,1,0,0,0,0|3,0,0]=4 556 B15R2.9032 Nc1c(O)c(O)c2ccccc2c1O Amb25109182 [0,1,0,0,0,0|2,0,1]=4 557 B15R2.9032 Nc1c(O)c2ccccc2c(O)c1N Amb25814777 [0,1,0,0,0,0|3,0,0]=4 558 B15R2.9032 O=C1c2ccccc2C(=O)C(=O)C1=O Amb18048565 [0,1,0,0,0,0|2,0,1]=4 559 B15R2.9032 O=C1c2ccccc2C(=O)C(=O)C1=O Amb19984875 [0,1,0,0,0,0|2,0,1]=4 560 B15R2.9032 OC1=C(Cl)C(=O)C(=O)c2c[n]ccc21 Amb24071963 [0,1,0,0,0,0|3,0,0]=4 561 B15R2.9032 ON1c2ccccc2N(O)C(=O)C1=O Amb21869643 [0,1,0,0,0,0|2,0,0]=3 562 B15R2.9032 ON1c2ccccc2N(O)C(=O)C1=O Amb22360845 [0,1,0,0,0,0|2,0,0]=3 563 B15R2.9032 Oc1c(N)c(O)c(c2c1cccc2)N Amb17594946 [0,1,0,0,0,0|2,0,1]=4 564 B15R2.9032 Oc1c(O)c(N)c(c2c1cccc2)N Amb17594945 [0,1,0,0,0,0|3,0,0]=4 565 B15R2.9032 Oc1c(O)c(O)c(c2c1cccc2)O Amb17595014 [0,1,0,0,0,0|2,0,1]=4 566 B15R2.9032 Oc1c2ccccc2c(O)c(F)c1F Amb24737527 [0,1,0,0,0,0|3,0,0]=4 567 B15R2.13166 CN1C(=O)CC(C)(C)c2ccccc12 Amb18559276 [0,1,0,0,0,0|1,0,2]=4 568 B15R2.13166 CN1c2ccccc2S(=O)(=O)CC1=O Amb22444138 [0,1,0,0,0,0|1,0,2]=4 569 B15R2.13166 CN1c2ccccc2S(=O)(=O)NC1=O Amb22455071 [0,1,0,0,0,0|2,0,1]=4 570 B15R2.13166 O=C1CC(C)(N)c2c(N1C)cccc2 Amb17605520 [0,1,0,0,0,0|1,0,2]=4 571 B15R2.13626 CC=1C=C(C)N(C)C2=CC=CC(=O)C12 Amb22359252 [0,1,0,0,0,0|2,0,0]=3 572 B15R2.13626 CN1c2[n]ccc(Cl)c2C(=O)NC1=O Amb22713458 [0,1,0,0,0,0|2,0,1]=4 573 B15R2.13626 CN1c2[n]ccc(N)c2C(=O)NC1=O Amb22713460 [0,1,0,0,0,0|2,0,1]=4 574 B15R2.13626 CN1c2[n]ccc(O)c2C(=O)NC1=O Amb21936600 [0,1,0,0,0,0|2,0,1]=4 575 B15R2.13626 CN1c2cccc(Cl)c2C(=O)OC1=O Amb20247073 [0,1,0,0,0,0|1,0,1]=3 576 B15R2.13626 Cc1c2OC=CC(=O)c2c(O)cc1O Amb25059666 [0,1,0,0,0,0|2,0,1]=4 577 B15R2.13626 Cc1cc(O)c2c(cccc2O)c1C Amb24506278 [0,1,0,0,0,0|2,0,0]=3 578 B15R2.13626 Cc1cc(O)c2c(cccc2O)c1O Amb18650353 [0,1,0,0,0,0|3,0,0]=4 579 B15R2.13626 OC1=CC(=O)C(=O)c2cccc(O)c12 Amb25718321 [0,1,0,0,0,0|2,0,0]=3 580 B15R2.13626 Oc1cc(Cl)c(O)c2cccc(O)c12 Amb24530299 [0,1,0,0,0,0|3,0,0]=4 581 B15R2.13626 Oc1cc(O)c2c(c1O)cccc2O Amb17595015 [0,1,0,0,0,0|2,0,1]=4 582 B15R2.13627 CC1=CC(=O)N(C)c2c1cccc2C Amb21927209 [0,1,0,0,0,0|1,0,0]=2 583 B15R2.13627 CN1c2c(F)cccc2C(=O)OC1=O Amb24404608 [0,1,0,0,0,0|1,0,1]=3 584 B15R2.13627 Cc1cccc2c1n(C)c(cc2=O)C Amb10976711 [0,1,0,0,0,0|1,0,1]=3 585 B15R2.13627 Clc1cccc2c1n(C)c(cc2=O)C Amb10976715 [0,1,0,0,0,0|1,0,1]=3 586 B15R2.13627 Fc1cccc2c1n(C)c(cc2=O)C Amb10976717 [0,1,0,0,0,0|1,0,1]=3 587 B15R2.13627 OC1=CC(=O)C(=O)c2c1cccc2O Amb24631231 [0,1,0,0,0,0|2,0,0]=3 588 B15R2.13627 Oc1cc(O)c(c2c1cccc2O)O Amb17595018 [0,1,0,0,0,0|2,0,1]=4 589 B15R2.13861 CN1c2[n]cccc2C(N)=CS1(=O)=O Amb22896365 [0,1,0,0,0,0|3,0,0]=4 590 B15R2.13861 O=C1CS(=O)(=O)N(c2c1cccc2)C Amb2445888 [0,1,0,0,0,0|1,0,2]=4 591 B15R2.19973 CCc1cc(O)c2ccccc2c1O Amb18129766 [0,1,0,0,0,0|3,0,0]=4 592 B15R2.19973 CN1C(=CC(=O)c2ccccc12)C=O Amb18649537 [0,1,0,0,0,0|0,0,1]=2 593 B15R2.19973 CN1C(CCl)=NC(=O)c2ccccc12 Amb25217019 [0,1,0,0,0,0|2,0,1]=4 594 B15R2.19973 CN1C(CO)=NC(=O)c2ccccc12 Amb24718313 [0,1,0,0,0,0|1,0,2]=4 595 B15R2.19973 CN1C(NN)=NC(=O)c2ccccc12 Amb18650478 [0,1,0,0,0,0|2,0,1]=4 596 B15R2.19973 COc1cc(O)c2ccccc2c1O Amb18650360 [0,1,0,0,0,0|2,0,1]=4 597 B15R2.19973 CSc1cc(O)c2ccccc2c1O Amb24357128 [0,1,0,0,0,0|2,1,0]=4 598 B15R2.19973 Cc1c(CO)cc(F)c2ccccc21 Amb25739834 [0,1,0,0,0,0|2,0,1]=4 599 B15R2.19973 Cc1c2ccccc2c(O)cc1CC Amb25066283 [0,1,0,0,0,0|2,0,0]=3 600 B15R2.19973 Cc1c2ccccc2c(O)cc1OC Amb24633613 [0,1,0,0,0,0|1,0,1]=3 601 B15R2.19973 Cc1cc(C=O)c(C)c2ccccc12 Amb25695320 [0,1,0,0,0,0|2,0,0]=3 602 B15R2.19973 Cc1cc(C=O)c(O)c2ccccc21 Amb18129610 [0,1,0,0,0,0|3,0,0]=4 603 B15R2.19973 Cc1cc(N=O)c(O)c2ccccc21 Amb25334962 [0,1,0,0,0,0|3,0,0]=4 604 B15R2.19973 Cc1cc(SC)[n+](C)c2ccccc12 Amb22449765 [0,1,0,0,0,0|1,1,1]=4 605 B15R2.19973 N#Cc1cc(O)c2ccccc2c1O Amb25143448 [0,1,0,0,0,0|3,0,0]=4 606 B15R2.19973 O=CC1=CC(=O)c2ccccc2C1=O Amb18649225 [0,1,0,0,0,0|2,0,1]=4 607 B15R2.19973 O=Cc1cc(Br)c2ccccc2c1F Amb20247985 [0,1,0,0,0,0|3,0,0]=4 608 B15R2.19973 OCc1cc(O)c2ccccc2c1O Amb25358843 [0,1,0,0,0,0|2,0,1]=4 609 B15R2.19973 Oc1c(C=O)cc(Cl)c2ccccc21 Amb18130973 [0,1,0,0,0,0|3,0,0]=4 610 B15R2.19973 Oc1cc(C=O)c(O)c2ccccc12 Amb24336497 [0,1,0,0,0,0|2,0,0]=3 611 B15R2.21211 CC1=CC(=NO)c2ccccc2C1=O Amb22488366 [0,1,0,0,0,0|3,0,0]=4 612 B15R2.21211 CN1C(=O)C=C(C#N)c2ccccc12 Amb18648875 [0,1,0,0,0,0|1,0,0]=2 613 B15R2.21211 CN1C(=O)C=C(CCl)c2ccccc12 Amb23448572 [0,1,0,0,0,0|1,0,0]=2 614 B15R2.21211 CN1C(=O)C=C(CN)c2ccccc12 Amb18909694 [0,1,0,0,0,0|1,0,0]=2 615 B15R2.21211 CN1C(=O)C=C(NN)c2ccccc12 Amb19517105 [0,1,0,0,0,0|1,0,0]=2 616 B15R2.21211 CN1C(=O)CC(CN)c2ccccc12 Amb19516992 [0,1,0,0,0,0|1,0,2]=4 617 B15R2.21211 CN1C(=O)CC(CN)c2ccccc12 Amb22587459 [0,1,0,0,0,0|1,0,2]=4 618 B15R2.21211 CN1c2ccccc2C(=CC1=O)C=O Amb18649521 [0,1,0,0,0,0|0,0,1]=2 619 B15R2.21211 CNC1=CC(=O)C(=O)c2ccccc12 Amb25732009 [0,1,0,0,0,0|3,0,0]=4 620 B15R2.21211 COC1=CC(=O)C(=O)c2c1cccc2 Amb17594871 [0,1,0,0,0,0|2,0,0]=3 621 B15R2.21211 COC1=CC(=O)N(C)c2ccccc12 Amb22172864 [0,1,0,0,0,0|0,0,0]=1 622 B15R2.21211 COc1cc(Br)c(O)c2ccccc21 Amb18667400 [0,1,0,0,0,0|3,0,0]=4 623 B15R2.21211 COc1cc(Cl)c(O)c2ccccc21 Amb18656350 [0,1,0,0,0,0|3,0,0]=4 624 B15R2.21211 COc1cc(N)c(Br)c2ccccc21 Amb18667222 [0,1,0,0,0,0|3,0,0]=4 625 B15R2.21211 COc1cc(O)c(O)c2ccccc21 Amb18650369 [0,1,0,0,0,0|2,0,1]=4 626 B15R2.21211 CSc1[n]c(=O)[n](C)c2ccccc21 Amb24064786 [0,1,0,0,0,0|1,1,0]=3 627 B15R2.21211 C[n]1c(=O)cc(CBr)c2ccccc12 Amb24102933 [0,1,0,0,0,0|1,0,0]=2 628 B15R2.21211 C[n]1c(=O)cc(CO)c2ccccc12 Amb24102991 [0,1,0,0,0,0|0,0,0]=1 629 B15R2.21211 Cc1c(N)[n]c(OC)c2ccccc12 Amb25321881 [0,1,0,0,0,0|3,0,0]=4 630 B15R2.21211 Cc1c2ccccc2c(CO)[n]c1C Amb23560135 [0,1,0,0,0,0|3,0,0]=4 631 B15R2.21211 Cc1cc(CCl)c2ccccc2c1C Amb24435516 [0,1,0,0,0,0|3,0,0]=4 632 B15R2.21211 Cc1cc(NO)c2ccccc2[n+]1[O-] Amb24401049 [0,1,0,0,0,0|2,0,1]=4 633 B15R2.21211 Cc1cc(OC)c2ccccc2c1N Amb18129690 [0,1,0,0,0,0|3,0,0]=4 634 B15R2.21211 Cc1cc(OC)c2ccccc2c1O Amb18129765 [0,1,0,0,0,0|3,0,0]=4 635 B15R2.21211 NNc1cc(=O)n(c2c1cccc2)C Amb2388425 [0,1,0,0,0,0|1,0,0]=2 636 B15R2.61763 CC1(C)c2ccccc2C(=O)OC1=O Amb21964032 [0,1,0,0,0,0|2,0,1]=4 637 B15R2.61763 O=C1CC(=O)c2c(C1(C)C)cccc2 Amb17594880 [0,1,0,0,0,0|1,0,2]=4 638 B15R2.63814 Brc1ccc2c(c1)c(=O)cc(n2C)C Amb10976735 [0,1,0,0,0,0|1,0,1]=3 639 B15R2.63814 CC1=CC(=O)N(C)c2ccc(I)cc12 Amb23448574 [0,1,0,0,0,0|1,0,0]=2 640 B15R2.63814 CC1=CC(=O)N(C)c2ccc(N)cc12 Amb22524553 [0,1,0,0,0,0|1,0,0]=2 641 B15R2.63814 CC1=CC(=O)c2cc(N)ccc2N1C Amb22410693 [0,1,0,0,0,0|1,0,1]=3 642 B15R2.63814 CC1=CC(=O)c2cc(O)ccc2N1C Amb25759644 [0,1,0,0,0,0|1,0,1]=3 643 B15R2.63814 CC1CC(=O)N(C)c2ccc(Br)cc21 Amb18559267 [0,1,0,0,0,0|1,0,2]=4 644 B15R2.63814 CC1CC(=O)N(C)c2ccc(N)cc21 Amb18559265 [0,1,0,0,0,0|1,0,2]=4 645 B15R2.63814 CN1C(=O)C=C(O)c2cc(Cl)ccc12 Amb22751155 [0,1,0,0,0,0|0,0,0]=1 646 B15R2.63814 CN1c2[n]cc(N)cc2C(=O)NC1=O Amb18034219 [0,1,0,0,0,0|2,0,1]=4 647 B15R2.63814 CN1c2ccc(Br)cc2C(=O)OC1=O Amb18026189 [0,1,0,0,0,0|1,0,1]=3 648 B15R2.63814 CN1c2ccc(Cl)cc2C(=O)OC1=O Amb20240636 [0,1,0,0,0,0|1,0,1]=3 649 B15R2.63814 CN1c2ccc(F)cc2C(=O)OC1=O Amb24121319 [0,1,0,0,0,0|1,0,1]=3 650 B15R2.63814 CN1c2ccc(I)cc2C(=O)OC1=O Amb25184017 [0,1,0,0,0,0|1,0,1]=3 651 B15R2.63814 CN1c2ccc(N)cc2C(=O)NC1=O Amb18669585 [0,1,0,0,0,0|1,0,1]=3 652 B15R2.63814 CN1c2ccc(N)cc2C(=O)OC1=O Amb18538540 [0,1,0,0,0,0|1,0,1]=3 653 B15R2.63814 Cc1cc(=O)[n](C)c2ccc(O)cc12 Amb24091721 [0,1,0,0,0,0|1,0,0]=2 654 B15R2.63814 Cc1cc2C(O)=CC(=O)N(C)c2cc1 Amb20660818 [0,1,0,0,0,0|0,0,0]=1 655 B15R2.63814 Cc1cc2C(O)=CC(=O)N(N)c2cc1 Amb20660835 [0,1,0,0,0,0|1,0,0]=2 656 B15R2.63814 Cc1cc2c(cc1)N(C)C(=O)C=C2C Amb25672424 [0,1,0,0,0,0|1,0,0]=2 657 B15R2.63814 Cc1ccc2c([n]1)c(O)cc(F)c2C Amb23448767 [0,1,0,0,0,0|3,0,0]=4 658 B15R2.63814 Cc1ccc2c(c1)C(=O)N=C(N)N2C Amb24355351 [0,1,0,0,0,0|2,0,1]=4 659 B15R2.63814 Cc1ccc2c(c1)C(=O)OC(=O)N2C Amb19825655 [0,1,0,0,0,0|1,0,1]=3 660 B15R2.63814 Cc1ccc2c(c1)c(=O)cc(n2C)C Amb10976712 [0,1,0,0,0,0|1,0,1]=3 661 B15R2.63814 Clc1ccc2c(c1)c(=O)cc(n2C)C Amb10976716 [0,1,0,0,0,0|1,0,1]=3 662 B15R2.63814 Fc1ccc2c(c1)c(=O)cc(n2C)C Amb10976718 [0,1,0,0,0,0|1,0,1]=3 663 B15R2.63814 Oc1ccc2c(c1)c(O)cc(c2O)O Amb17595016 [0,1,0,0,0,0|2,0,1]=4 664 B15R2.63927 CC1=CC(=O)N(C)c2[n]c(N)ccc12 Amb18650172 [0,1,0,0,0,0|2,0,0]=3 665 B15R2.63927 CC1=CC(=O)c2ccc(N)cc2N1C Amb23569478 [0,1,0,0,0,0|1,0,1]=3 666 B15R2.63927 CN1C=2NC(=O)C=CC2C(=O)NC1=O Amb23451836 [0,1,0,0,0,0|2,0,1]=4 667 B15R2.63927 CN1c2cc(Br)ccc2S(=O)CC1=O Amb25218302 [0,1,0,0,0,0|1,0,2]=4 668 B15R2.63927 CN1c2cc(Cl)ccc2C(=O)OC1=O Amb25812609 [0,1,0,0,0,0|1,0,1]=3 669 B15R2.63927 CN1c2cc(I)ccc2C(=O)CC1=O Amb25162686 [0,1,0,0,0,0|0,0,2]=3 670 B15R2.63927 CN1c2cc(N)ccc2C(=O)CC1=O Amb25316178 [0,1,0,0,0,0|0,0,2]=3 671 B15R2.63927 CN1c2cc(N)ccc2C(=O)OC1=O Amb18035962 [0,1,0,0,0,0|1,0,1]=3 672 B15R2.63927 Cc1cc(=O)[n](C)c2cc(N)ccc12 Amb24091980 [0,1,0,0,0,0|1,0,0]=2 673 B15R2.63927 Cc1cc(=O)[n](C)c2cc(O)ccc12 Amb24092114 [0,1,0,0,0,0|1,0,0]=2 674 B15R2.63927 Cc1cc2c(cc1)c(N)cc(N)c2C Amb25060616 [0,1,0,0,0,0|3,0,0]=4 675 B15R2.63927 Cc1cc2c(cc1)c(O)cc(C)c2C Amb24357182 [0,1,0,0,0,0|2,0,0]=3 676 B15R2.63927 Cc1ccc2C(=O)NC(=O)N(C)c2[n]1 Amb19548889 [0,1,0,0,0,0|2,0,1]=4 677 B15R2.63927 Cc1ccc2C(O)=NC(=O)N(C)c2[n]1 Amb22571841 [0,1,0,0,0,0|2,0,0]=3 678 B15R2.63927 Cc1ccc2c([n]1)N(C)C(=O)OC2=O Amb19891247 [0,1,0,0,0,0|2,0,1]=4 679 B15R2.63927 Oc1ccc2c(c1)c(O)c(cc2O)O Amb17595017 [0,1,0,0,0,0|2,0,1]=4 680 B13R1.11 CCC(=O)NC(=N)c1ccccc1 Amb25855572 [0,0,1,0,0,0|3,0,0]=4 681 B13R1.11 CCC(=O)OC(=O)c1ccccc1 Amb22500123 [0,0,1,0,0,0|2,0,1]=4 682 B13R1.11 CN(CC(=O)NC)c1ccccc1 Amb19971421 [0,0,1,0,0,0|2,0,1]=4 683 B13R1.11 CNC(=N)CC(=O)c1ccccc1 Amb25275499 [0,0,1,0,0,0|1,0,2]=4 684 B13R1.11 CNC(=N)NC(=O)c1ccccc1 Amb25689630 [0,0,1,0,0,0|2,0,1]=4 685 B13R1.11 CNC(=O)CC(=O)c1ccccc1 Amb24361603 [0,0,1,0,0,0|0,0,2]=3 686 B13R1.11 CNC(=O)CC(=S)c1ccccc1 Amb25125271 [0,0,1,0,0,0|0,1,1]=3 687 B13R1.11 CNC(=O)CS(=O)c1ccccc1 Amb25807172 [0,0,1,0,0,0|1,0,2]=4 688 B13R1.11 CNC(=O)C[C@@H](O)c1ccccc1 Amb24490336 [0,0,1,0,0,0|0,0,2]=3 689 B13R1.11 CNC(=O)C[C@H](C)c1ccccc1 Amb25041089 [0,0,1,0,0,0|1,0,2]=4 690 B13R1.11 CNC(=O)C[C@H](N)c1ccccc1 Amb24637726 [0,0,1,0,0,0|1,0,2]=4 691 B13R1.11 CNC(=O)C[C@H](O)c1ccccc1 Amb24444391 [0,0,1,0,0,0|0,0,2]=3 692 B13R1.11 CNC(=O)NC(=N)c1cc[n]cc1 Amb25815755 [0,0,1,0,0,0|3,0,0]=4 693 B13R1.11 CNC(=O)NC(=N)c1ccc[n]c1 Amb25790559 [0,0,1,0,0,0|3,0,0]=4 694 B13R1.11 CNC(=O)NC(=N)c1ccccc1 Amb24441539 [0,0,1,0,0,0|2,0,0]=3 695 B13R1.11 CNC(=O)NC(=O)c1ccc[n]c1 Amb25733452 [0,0,1,0,0,0|2,0,1]=4 696 B13R1.11 CNC(=O)NC(C)c1ccccc1 Amb25324528 [0,0,1,0,0,0|2,0,1]=4 697 B13R1.11 CNC(=O)NN(C)c1ccccc1 Amb25137162 [0,0,1,0,0,0|3,0,0]=4 698 B13R1.11 CNC(=O)N[C@H](C)c1ccccc1 Amb25040008 [0,0,1,0,0,0|2,0,1]=4 699 B13R1.11 CNC(=S)NC(=N)c1ccccc1 Amb25778175 [0,0,1,0,0,0|2,1,0]=4 700 B13R1.11 CNC(=S)NC(=O)c1ccccc1 Amb1625173 [0,0,1,0,0,0|1,1,1]=4 701 B13R1.11 CNC(=S)NC(=S)c1ccccc1 Amb25034345 [0,0,1,0,0,0|1,2,0]=4 702 B13R1.11 CNC(=S)\C=C(\O)/c1ccccc1 Amb25270687 [0,0,1,0,0,0|0,1,0]=2 703 B13R1.11 CN\C(\N)=N\C(=S)c1ccccc1 Amb25055291 [0,0,1,0,0,0|2,1,0]=4 704 B13R1.11 COC(=O)CC(=O)c1ccccc1 Amb10553935 [0,0,1,0,0,0|1,0,2]=4 705 B13R1.11 COC(=O)CC(O)c1ccccc1 Amb22731500 [0,0,1,0,0,0|1,0,2]=4 706 B13R1.11 COC(=O)NC(=N)c1ccccc1 Amb25254191 [0,0,1,0,0,0|3,0,0]=4 707 B13R1.11 COC(=O)NC(=O)c1ccccc1 Amb25190157 [0,0,1,0,0,0|2,0,1]=4 708 B13R1.11 COC(=O)\C=C(/N)\c1ccc[n]c1 Amb24622421 [0,0,1,0,0,0|3,0,0]=4 709 B13R1.11 COC(=O)\C=C(\N)/c1ccccc1 Amb25258009 [0,0,1,0,0,0|2,0,0]=3 710 B13R1.11 CSC(=O)NC(=O)c1ccccc1 Amb25743426 [0,0,1,0,0,0|2,0,1]=4 711 B13R1.11 C\C(=C/C(=O)C#N)\c1ccccc1 Amb25050242 [0,0,1,0,0,0|3,0,0]=4 712 B13R1.11 C\C(=C/C(=O)OC)\c1cccc[n]1 Amb24555692 [0,0,1,0,0,0|3,0,0]=4 713 B13R1.11 C\C(=C/C(=O)c1ccccc1)\NC Amb24494958 [0,0,1,0,0,0|1,0,1]=3 714 B13R1.11 C\C(=C/C(C)NC)\c1ccccc1 Amb23555670 [0,0,1,0,0,0|2,0,1]=4 715 B13R1.11 C\C(=C\C(=O)C#N)\c1ccccc1 Amb24584484 [0,0,1,0,0,0|3,0,0]=4 716 B13R1.11 C\C(=C\C(=O)C=C)\c1ccccc1 Amb25377817 [0,0,1,0,0,0|2,0,1]=4 717 B13R1.11 C\C(=C\C(=O)CC)\c1ccccc1 Amb24553546 [0,0,1,0,0,0|2,0,0]=3 718 B13R1.11 C\C(=C\C(=O)NC)\c1ccccc1 Amb24369890 [0,0,1,0,0,0|1,0,0]=2 719 B13R1.11 C\C(=C\C(=O)NO)\c1cc[n]cc1 Amb25847576 [0,0,1,0,0,0|3,0,0]=4 720 B13R1.11 C\C(=C\C(=O)NO)\c1ccc[n]c1 Amb25130474 [0,0,1,0,0,0|3,0,0]=4 721 B13R1.11 C\C(=C\C(=O)OC)\c1c[n]ccc1 Amb25191857 [0,0,1,0,0,0|3,0,0]=4 722 B13R1.11 C\C(=C\C(=O)c1ccccc1)\NC Amb24418806 [0,0,1,0,0,0|1,0,1]=3 723 B13R1.11 C\C(=C\C(=O)c1ccccc1)\OC Amb25034479 [0,0,1,0,0,0|2,0,1]=4 724 B13R1.11 C\C(\CC)=C\C(=O)c1ccccc1 Amb24408334 [0,0,1,0,0,0|2,0,1]=4 725 B13R1.11 NNC(=O)CC(=O)c1ccccc1 Amb24416728 [0,0,1,0,0,0|1,0,2]=4 726 B13R1.11 NNC(=O)CC(O)c1ccccc1 Amb24720262 [0,0,1,0,0,0|1,0,2]=4 727 B13R1.11 NNC(=O)C[C@@H](O)c1ccccc1 Amb24533813 [0,0,1,0,0,0|1,0,2]=4 728 B13R1.11 ONC(=O)CC(=O)c1ccccc1 Amb24492649 [0,0,1,0,0,0|1,0,2]=4 729 B13R1.11 ONC(=O)NC(=O)c1ccccc1 Amb24534607 [0,0,1,0,0,0|2,0,1]=4 730 B13R1.47 BrCCC(=O)N(c1ccccc1)C Amb17324151 [0,0,1,0,0,0|1,0,2]=4 731 B13R1.47 C=CCC(=S)N(c1ccccc1)C Amb10573683 [0,0,1,0,0,0|1,1,1]=4 732 B13R1.47 CC(C(=O)\C=N\N)c1ccccc1 Amb24399076 [0,0,1,0,0,0|3,0,0]=4 733 B13R1.47 CN(C(=O)C#CBr)c1ccccc1 Amb25111412 [0,0,1,0,0,0|1,0,2]=4 734 B13R1.47 CN(C(=O)NCC)c1ccccc1 Amb25237616 [0,0,1,0,0,0|2,0,1]=4 735 B13R1.47 CN(C(=O)\C=C\Cl)c1ccccc1 Amb24739691 [0,0,1,0,0,0|1,0,0]=2 736 B13R1.47 C\C=C\C(=O)C(=C)c1ccccc1 Amb25190287 [0,0,1,0,0,0|2,0,1]=4 737 B13R1.47 C\C=C\C(=O)C(C)c1ccccc1 Amb24529691 [0,0,1,0,0,0|2,0,0]=3 738 B13R1.47 C\C=C\C(=O)C(O)c1ccccc1 Amb25179529 [0,0,1,0,0,0|3,0,0]=4 739 B13R1.47 C\C=C\C(=O)N(C)c1[n]ccc[n]1 Amb24532042 [0,0,1,0,0,0|3,0,0]=4 740 B13R1.47 C\C=C\C(=O)N(C)c1c[n]cc[n]1 Amb25098406 [0,0,1,0,0,0|3,0,0]=4 741 B13R1.47 C\C=C\C(=O)N(C)c1cc[n]cc1 Amb25320373 [0,0,1,0,0,0|2,0,0]=3 742 B13R1.47 C\C=C\C(=O)N(C)c1ccc[n]c1 Amb25764053 [0,0,1,0,0,0|2,0,0]=3 743 B13R1.47 C\C=C\C(=O)[C@@H](O)c1ccccc1 Amb24577753 [0,0,1,0,0,0|3,0,0]=4 744 B13R1.47 ClCCC(=O)N(c1ccccc1)C Amb1141646 [0,0,1,0,0,0|1,0,2]=4 745 B13R1.47 NCCC(=O)N(c1ccccc1)C Amb1134878 [0,0,1,0,0,0|1,0,2]=4 746 B13R1.47 OCCC(=O)N(c1ccccc1)C Amb17335302 [0,0,1,0,0,0|0,0,2]=3 747 B13R1.89 CC(=O)N(C)c1ccccc1C#N Amb18127267 [0,0,1,0,0,0|1,0,2]=4 748 B13R1.89 CC(=O)N(C)c1ccccc1CC Amb24510164 [0,0,1,0,0,0|1,0,2]=4 749 B13R1.89 CC(=O)N(C)c1ccccc1CN Amb18252417 [0,0,1,0,0,0|1,0,2]=4 750 B13R1.89 CC(=O)N(C)c1ccccc1OC Amb24388088 [0,0,1,0,0,0|2,0,1]=4 751 B13R1.89 CC(=O)N(O)c1ccccc1C=O Amb25290262 [0,0,1,0,0,0|1,0,2]=4 752 B13R1.89 CC(C(O)=O)c1ccccc1C=C Amb24387795 [0,0,1,0,0,0|3,0,0]=4 753 B13R1.89 CC(c1ccccc1CO)C(O)=O Amb24386323 [0,0,1,0,0,0|2,0,1]=4 754 B13R1.89 CN(C(N)=O)c1ccccc1C#N Amb18127437 [0,0,1,0,0,0|2,0,1]=4 755 B13R1.89 CN(C(N)=O)c1ccccc1C=O Amb24541217 [0,0,1,0,0,0|1,0,1]=3 756 B13R1.89 CN(c1ccccc1C=O)C(=O)Cl Amb25712205 [0,0,1,0,0,0|1,0,1]=3 757 B13R1.89 CN(c1ccccc1CN)C(N)=O Amb18252476 [0,0,1,0,0,0|2,0,1]=4 758 B13R1.89 COc1ccccc1N(C)C(N)=O Amb18181070 [0,0,1,0,0,0|3,0,0]=4 759 B13R1.123 CN1C(=O)C=C(O)N=C1SCC=C Amb19519877 [0,0,1,0,0,0|2,0,1]=4 760 B13R1.464 COc1ccccc1C(=O)C=C=O Amb25358834 [0,0,1,0,0,0|1,0,2]=4 761 B13R1.464 COc1ccccc1\C(\Cl)=C\C=O Amb25349326 [0,0,1,0,0,0|2,0,0]=3 762 B13R1.464 C\C=C\C(C)c1ccccc1NC Amb25691456 [0,0,1,0,0,0|2,0,1]=4 763 B13R1.464 C\C=C\C(O)c1ccccc1NC Amb24488925 [0,0,1,0,0,0|1,0,1]=3 764 B13R1.464 C\C=C\C(O)c1ccccc1OC Amb24430964 [0,0,1,0,0,0|2,0,1]=4 765 B13R1.464 O=CC=C(c1ccccc1OC)Cl Amb17236495 [0,0,1,0,0,0|2,0,0]=3 766 B13R1.547 CN(C=O)c1ccccc1C(O)=O Amb18281866 [0,0,1,0,0,0|1,0,0]=2 767 B13R1.547 CN(N=O)c1ccccc1C(N)=O Amb25210496 [0,0,1,0,0,0|2,0,1]=4 768 B13R1.547 CN(N=O)c1ccccc1C(O)=O Amb25677034 [0,0,1,0,0,0|2,0,0]=3 769 B13R1.547 C\C(=C\C)\c1ccccc1C(O)=O Amb25101533 [0,0,1,0,0,0|3,0,0]=4 770 B13R1.547 OC(=O)c1ccccc1C(=O)C=O Amb25783947 [0,0,1,0,0,0|3,0,0]=4 771 B13R1.1630 Cc1cc(O)c(\C=C\C=O)cc1C Amb25669378 [0,0,1,0,0,0|3,0,0]=4 772 B15R3.11938 Oc1c2Oc2c(O)c3ccccc13 Amb25807546 [0,0,0,1,0,0|2,0,1]=4 773 B13R2.3085 CC1C(=N)N(C)c2ccccc21 Amb22536459 [0,0,0,0,1,0|2,0,1]=4 774 B13R2.3085 CC1C(=O)N(C)c2ccccc21 Amb24273383 [0,0,0,0,1,0|1,0,1]=3 775 B13R2.3085 CC1C(O)c2ccccc2N1C Amb24362737 [0,0,0,0,1,0|1,0,2]=4 776 B13R2.3085 CC=1c2ccccc2C(C)C1Br Amb25849928 [0,0,0,0,1,0|3,0,0]=4 777 B13R2.3085 CN1C(=N)N(N)c2ccccc12 Amb19520788 [0,0,0,0,1,0|3,0,0]=4 778 B13R2.3085 CN1C(=O)C(Br)c2ccccc12 Amb22749190 [0,0,0,0,1,0|1,0,1]=3 779 B13R2.3085 CN1C(=O)C(N)c2ccccc12 Amb22586861 [0,0,0,0,1,0|1,0,1]=3 780 B13R2.3085 CN1C(=O)N(C)c2ccc[n]c12 Amb21884677 [0,0,0,0,1,0|3,0,0]=4 781 B13R2.3085 CN1C(=O)N(C)c2ccccc12 Amb18004177 [0,0,0,0,1,0|2,0,0]=3 782 B13R2.3085 CN1C(=O)N(O)c2ccccc12 Amb25174132 [0,0,0,0,1,0|1,0,0]=2 783 B13R2.3085 CN1C(=S)N(C)c2ccccc12 Amb20666683 [0,0,0,0,1,0|2,1,0]=4 784 B13R2.3085 CN1C(N)C(=O)c2ccccc12 Amb24078928 [0,0,0,0,1,0|1,0,2]=4 785 B13R2.3085 CN1c2[n]cccc2C(=O)C1=O Amb24465137 [0,0,0,0,1,0|1,0,1]=3 786 B13R2.3085 CN1c2cc[n]cc2C(=O)C1=O Amb24725354 [0,0,0,0,1,0|1,0,1]=3 787 B13R2.3085 C[n]1c(=C)[n](C)c2ccccc12 Amb24065291 [0,0,0,0,1,0|3,0,0]=4 788 B13R2.3085 C[n]1c(N)[n+](C)c2ccccc12 Amb25026044 [0,0,0,0,1,0|3,0,0]=4 789 B13R2.3085 C[n]1c2ccccc2c(I)c1I Amb24067527 [0,0,0,0,1,0|2,0,0]=3 790 B13R2.3085 Cc1c(Br)c2ccc[n]c2[n]1C Amb18161294 [0,0,0,0,1,0|3,0,0]=4 791 B13R2.3085 Cc1c(N)c2ccc[n]c2[n]1C Amb18829910 [0,0,0,0,1,0|3,0,0]=4 792 B13R2.3085 Cc1c(N)c2ccccc2[n]1C Amb18563503 [0,0,0,0,1,0|2,0,0]=3 793 B13R2.3085 Cc1c(S)c2ccccc2[n]1C Amb24361774 [0,0,0,0,1,0|1,1,0]=3 794 B13R2.3085 Cc1c2ccccc2[n](C)c1Cl Amb23569031 [0,0,0,0,1,0|2,0,0]=3 795 B13R2.3085 Cc1c2ccccc2[n](C)c1I Amb21963101 [0,0,0,0,1,0|2,0,0]=3 796 B13R2.3085 Cn1c2ccccc2c(c1C)Br Amb17133648 [0,0,0,0,1,0|2,0,0]=3 797 B13R2.3085 Cn1c2ccccc2c(c1C)I Amb17134454 [0,0,0,0,1,0|2,0,0]=3 798 B13R2.3085 N=C1N(C)c2c(C1C)cccc2 Amb16210593 [0,0,0,0,1,0|2,0,1]=4 799 B13R2.3085 NC1C(=O)N(O)c2ccccc21 Amb24073758 [0,0,0,0,1,0|2,0,1]=4 800 B13R2.3085 NC1C(=O)N(O)c2ccccc21 Amb25059235 [0,0,0,0,1,0|2,0,1]=4 801 B13R2.3085 N[n+]1c(C)n(c2c1cccc2)C Amb1032750 [0,0,0,0,1,0|3,0,0]=4 802 B13R2.3085 O=C1C(=O)c2ccccc2C1=O Amb18048474 [0,0,0,0,1,0|2,0,1]=4 803 B13R2.3085 O=C1C(=O)c2ccccc2C1=O Amb22001415 [0,0,0,0,1,0|2,0,1]=4 804 B13R2.3085 O=c1n(C)c2c(n1C)cccc2 Amb1778538 [0,0,0,0,1,0|2,0,0]=3 805 B13R2.3085 O=c1n(O)c2c(n1O)cccc2 Amb1042148 [0,0,0,0,1,0|2,0,0]=3 806 B13R2.3085 OC=1c2ccccc2C(=O)C1O Amb25667606 [0,0,0,0,1,0|2,0,1]=4 807 B13R2.3085 ON1C(=O)N(O)c2ccccc12 Amb19802633 [0,0,0,0,1,0|2,0,0]=3 808 B13R2.3085 O[C@@H]1C(=O)N(O)c2ccccc21 Amb24748466 [0,0,0,0,1,0|1,0,1]=3 809 B13R2.3085 O[C@H]1C(=O)N(O)c2ccccc21 Amb24524815 [0,0,0,0,1,0|1,0,1]=3 810 B13R2.5393 CC1=CC(=O)c2[s]ccc2N1C Amb25160238 [0,0,0,0,1,0|2,0,1]=4 811 B13R2.5393 CN1c2cc[s]c2C(=O)NC1=O Amb24645962 [0,0,0,0,1,0|2,0,1]=4 812 B13R2.5393 Cc1c(Cl)cc(O)c2cc[s]c21 Amb25230354 [0,0,0,0,1,0|3,0,0]=4 813 B13R2.5393 Cc1c(F)cc(O)c2[s]ccc21 Amb25214729 [0,0,0,0,1,0|3,0,0]=4 814 B13R2.5393 Cc1c(I)cc(O)c2[s]ccc21 Amb25377592 [0,0,0,0,1,0|3,0,0]=4 815 B13R2.5393 Cc1c(I)cc(O)c2cc[s]c21 Amb25365470 [0,0,0,0,1,0|3,0,0]=4 816 B13R2.5393 Cc1c(N)cc(O)c2[s]ccc21 Amb25197141 [0,0,0,0,1,0|3,0,0]=4 817 B13R2.5393 Cc1c(N)cc(O)c2cc[s]c21 Amb25313422 [0,0,0,0,1,0|3,0,0]=4 818 B13R2.5393 Cc1cc(O)c2cc[s]c2c1C Amb24683017 [0,0,0,0,1,0|3,0,0]=4 819 B15R2.7340 CC1NCC(=O)N(C)c2ccccc21 Amb25801815 [0,0,0,0,0,1|1,0,2]=4 820 B15R2.7340 CN1C(=C)CNC(=O)c2ccccc12 Amb25054680 [0,0,0,0,0,1|1,0,2]=4 821 B15R2.8448 CC1CC(=O)N(C)c2ccccc2N1 Amb19337762 [0,0,0,0,0,1|1,0,2]=4 822 B15R2.8448 CC1CC(=O)N(c2c(O1)cccc2)C Amb17570542 [0,0,0,0,0,1|1,0,2]=4 823 B15R2.8448 CC=1CC(=O)N(C)c2ccccc2N1 Amb24110597 [0,0,0,0,0,1|1,0,1]=3 824 B15R2.8448 CN1c2ccccc2NC(=O)CC1=O Amb24666753 [0,0,0,0,0,1|0,0,2]=3 825 B15R2.13167 O=C1NC(=O)c2c(OC1C)cccc2 Amb1765147 [0,0,0,0,0,1|2,0,1]=4 826 B12R1.27 BrCC(=O)\C=C\c1ccccc1 Amb17596167 [1,0,1,0,0,0|2,0,0]=4 827 B12R1.27 C#CC(=O)\C=C\c1ccccc1 Amb25706970 [1,0,1,0,0,0|1,0,1]=4 828 B12R1.27 CCC(=O)\C=C/c1ccccc1 Amb25271028 [1,0,1,0,0,0|1,0,0]=3 829 B12R1.27 CCC(=O)\C=C\c1ccc[n]c1 Amb25358914 [1,0,1,0,0,0|2,0,0]=4 830 B12R1.27 CCC(=O)\C=C\c1cccc[n]1 Amb24487185 [1,0,1,0,0,0|2,0,0]=4 831 B12R1.27 CCC(=O)\C=C\c1ccccc1 Amb10565332 [1,0,1,0,0,0|1,0,0]=3 832 B12R1.27 CNC(=O)C#Cc1ccccc1 Amb2106613 [1,0,1,0,0,0|0,0,2]=4 833 B12R1.27 CNC(=O)NCc1ccccc1 Amb2132763 [1,0,1,0,0,0|1,0,1]=4 834 B12R1.27 CNC(=O)NNc1ccccc1 Amb25751263 [1,0,1,0,0,0|2,0,0]=4 835 B12R1.27 CNC(=O)\C=C\c1c[n]cc[n]1 Amb24343779 [1,0,1,0,0,0|2,0,0]=4 836 B12R1.27 CNC(=O)\C=C\c1cccc[n]1 Amb24056147 [1,0,1,0,0,0|1,0,0]=3 837 B12R1.27 CNC(=O)\N=C\c1ccccc1 Amb24497304 [1,0,1,0,0,0|1,0,0]=3 838 B12R1.27 CNC(=O)\N=N\c1ccccc1 Amb25313077 [1,0,1,0,0,0|2,0,0]=4 839 B12R1.27 CNC(C)\C=C\c1ccccc1 Amb18126307 [1,0,1,0,0,0|1,0,1]=4 840 B12R1.27 COC(=O)/C=C/c1cccnc1 Amb17844385 [1,0,1,0,0,0|2,0,0]=4 841 B12R1.27 COC(=O)C=Cc1cc[n]cc1 Amb20668041 [1,0,1,0,0,0|2,0,0]=4 842 B12R1.27 COC(=O)C=Cc1cc[n]cc1 Amb24074160 [1,0,1,0,0,0|2,0,0]=4 843 B12R1.27 COC(=O)\C=C\c1cccc[n]1 Amb25036096 [1,0,1,0,0,0|2,0,0]=4 844 B12R1.27 COC(=O)\C=C\c1ccncc1 Amb10604946 [1,0,1,0,0,0|2,0,0]=4 845 B12R1.27 ClCC(=O)\C=C\c1ccccc1 Amb17594640 [1,0,1,0,0,0|2,0,0]=4 846 B12R1.27 N#CC(=O)\C=C\c1ccccc1 Amb10069227 [1,0,1,0,0,0|2,0,0]=4 847 B12R1.27 NCC(=O)\C=C\c1ccccc1 Amb18908593 [1,0,1,0,0,0|2,0,0]=4 848 B12R1.27 NNC(=O)\C=C\c1ccccc1 Amb25838381 [1,0,1,0,0,0|1,0,0]=3 849 B12R1.27 O=C(CF)\C=C\c1ccccc1 Amb24572849 [1,0,1,0,0,0|2,0,0]=4 850 B12R1.27 O=C(\C=C\c1ccccc1)C=O Amb18126247 [1,0,1,0,0,0|2,0,0]=4 851 B12R1.27 OCC(=O)\C=C\c1ccccc1 Amb25142729 [1,0,1,0,0,0|2,0,0]=4 852 B12R1.27 ONC(=O)\C=C\c1cc[n]cc1 Amb22346729 [1,0,1,0,0,0|2,0,0]=4 853 B12R1.27 ONC(=O)\C=C\c1cc[n]cc1 Amb24565929 [1,0,1,0,0,0|2,0,0]=4 854 B12R1.30 CC(\C=C\C=O)c1ccccc1 Amb24554527 [1,0,1,0,0,0|1,0,1]=4 855 B12R1.30 CC\C=C/C(=O)c1ccccc1 Amb24722785 [1,0,1,0,0,0|1,0,1]=4 856 B12R1.30 CC\C=C/N(C)c1ccccc1 Amb24072870 [1,0,1,0,0,0|1,0,1]=4 857 B12R1.30 CC\C=C\C(=O)c1ccccc1 Amb24532703 [1,0,1,0,0,0|1,0,1]=4 858 B12R1.30 CC\C=C\C(O)c1ccccc1 Amb22546781 [1,0,1,0,0,0|1,0,1]=4 859 B12R1.30 CC\C=C\N(C)c1ccccc1 Amb24575001 [1,0,1,0,0,0|1,0,1]=4 860 B12R1.30 CN(C=CC=C)c1ccccc1 Amb24092515 [1,0,1,0,0,0|1,0,0]=3 861 B12R1.30 CN(\C=C/C=C)c1ccccc1 Amb25279309 [1,0,1,0,0,0|1,0,0]=3 862 B12R1.30 CN(\C=C\C=O)c1cccc[n]1 Amb19889051 [1,0,1,0,0,0|1,0,1]=4 863 B12R1.30 CN\C=C/C(=O)c1ccccc1 Amb2386631 [1,0,1,0,0,0|0,0,1]=3 864 B12R1.30 CN\N=C\C(=O)c1ccccc1 Amb25202730 [1,0,1,0,0,0|1,0,1]=4 865 B12R1.30 CO\C=C/C(=O)c1ccccc1 Amb24523909 [1,0,1,0,0,0|1,0,1]=4 866 B12R1.30 CO\C=C\C(=O)c1ccccc1 Amb24370151 [1,0,1,0,0,0|1,0,1]=4 867 B12R1.30 CO\C=C\C(O)c1ccccc1 Amb25204750 [1,0,1,0,0,0|1,0,1]=4 868 B12R1.30 C\C(=C/C=C\Cl)\c1ccccc1 Amb24740702 [1,0,1,0,0,0|2,0,0]=4 869 B12R1.30 C\C(=C/CNC)\c1ccccc1 Amb23555664 [1,0,1,0,0,0|1,0,1]=4 870 B12R1.30 C\C(=C\C=CCl)\c1ccccc1 Amb24627050 [1,0,1,0,0,0|2,0,0]=4 871 B12R1.30 C\C=C\CN(C)c1ccccc1 Amb22546831 [1,0,1,0,0,0|1,0,1]=4 872 B12R1.107 Br\C(=C/C(=O)O)\c1ccccc1 Amb10069265 [1,0,1,0,0,0|2,0,0]=4 873 B12R1.107 C=C(CC(N)=O)c1ccccc1 Amb25798918 [1,0,1,0,0,0|1,0,1]=4 874 B12R1.107 C=C(NC(N)=O)c1ccccc1 Amb25258325 [1,0,1,0,0,0|2,0,0]=4 875 B12R1.107 CC(=O)NC(=O)c1ccccc1 Amb24073560 [1,0,1,0,0,0|1,0,1]=4 876 B12R1.107 CC(=O)NC(=S)c1ccccc1 Amb24073591 [1,0,1,0,0,0|1,1,0]=4 877 B12R1.107 CC(=O)OC(=C)c1ccccc1 Amb22730633 [1,0,1,0,0,0|2,0,0]=4 878 B12R1.107 CC(=O)OC(=O)c1ccccc1 Amb17678790 [1,0,1,0,0,0|1,0,1]=4 879 B12R1.107 CC(=O)\C=C(/O)\c1cccc[n]1 Amb24309430 [1,0,1,0,0,0|1,0,0]=3 880 B12R1.107 CC(=O)\C=C(/S)\c1ccccc1 Amb25730212 [1,0,1,0,0,0|0,1,0]=3 881 B12R1.107 CC(=O)\C=C(\N)/c1cc[n]cc1 Amb25059228 [1,0,1,0,0,0|2,0,0]=4 882 B12R1.107 CC(=O)\C=C(\N)/c1ccccc1 Amb25309296 [1,0,1,0,0,0|1,0,0]=3 883 B12R1.107 CC(=O)\C=C(\O)/c1c[n][n]cc1 Amb25179545 [1,0,1,0,0,0|2,0,0]=4 884 B12R1.107 CC(=O)\N=C(\N)/c1ccccc1 Amb25150972 [1,0,1,0,0,0|2,0,0]=4 885 B12R1.107 CC([O-])=CC(=O)c1ccccc1 Amb22446280 [1,0,1,0,0,0|0,0,2]=4 886 B12R1.107 CC([O-])=CC(=O)c1ccccc1 Amb22446311 [1,0,1,0,0,0|0,0,2]=4 887 B12R1.107 CC([O-])=CC(=O)c1ccccc1 Amb22474103 [1,0,1,0,0,0|0,0,2]=4 888 B12R1.107 CC([O-])=CC(=O)c1ccccc1 Amb22474104 [1,0,1,0,0,0|0,0,2]=4 889 B12R1.107 CN(C)\C=C(/O)\c1ccccc1 Amb24068870 [1,0,1,0,0,0|2,0,0]=4 890 B12R1.107 C\C(=C/C(=O)Cl)\c1ccccc1 Amb25195673 [1,0,1,0,0,0|2,0,0]=4 891 B12R1.107 C\C(=C/C(N)=O)\c1ccccc1 Amb24648875 [1,0,1,0,0,0|1,0,0]=3 892 B12R1.107 C\C(=C\C(=O)Cl)\c1ccccc1 Amb25220154 [1,0,1,0,0,0|2,0,0]=4 893 B12R1.107 C\C(=C\C(C)=O)\c1c[n]ccc1 Amb25308395 [1,0,1,0,0,0|2,0,0]=4 894 B12R1.107 C\C(=C\C(C)=O)\c1cc[n]cc1 Amb25783222 [1,0,1,0,0,0|2,0,0]=4 895 B12R1.107 C\C(=C\C(C)=O)\c1ccccc1 Amb24367599 [1,0,1,0,0,0|1,0,0]=3 896 B12R1.107 C\C(=C\C(N)=O)\c1ccc[n]c1 Amb25296908 [1,0,1,0,0,0|2,0,0]=4 897 B12R1.107 C\C(=C\C(O)=O)\c1ccccc1 Amb24271190 [1,0,1,0,0,0|2,0,0]=4 898 B12R1.107 C\C(\Cl)=C\C(O)c1ccccc1 Amb25681436 [1,0,1,0,0,0|1,0,1]=4 899 B12R1.107 C\C(\F)=C/C(=O)c1ccccc1 Amb24497135 [1,0,1,0,0,0|1,0,1]=4 900 B12R1.107 C\C(\F)=C\C(=O)c1ccccc1 Amb24631194 [1,0,1,0,0,0|1,0,1]=4 901 B12R1.107 C\C(\N)=C\C(=S)c1ccccc1 Amb25264968 [1,0,1,0,0,0|1,1,0]=4 902 B12R1.107 C\C(\[O-])=C/C(=O)c1ccccc1 Amb22043283 [1,0,1,0,0,0|0,0,2]=4 903 B12R1.107 C\C(\[O-])=C/C(=O)c1ccccc1 Amb22729931 [1,0,1,0,0,0|0,0,2]=4 904 B12R1.107 C\C(\[O-])=C/C(=O)c1ccccc1 Amb22729983 [1,0,1,0,0,0|0,0,2]=4 905 B12R1.107 C\C(\[O-])=C/C(=O)c1ccccc1 Amb22733686 [1,0,1,0,0,0|0,0,2]=4 906 B12R1.107 C\C(\[O-])=C\C(=O)c1ccccc1 Amb22729984 [1,0,1,0,0,0|0,0,2]=4 907 B12R1.107 Cl\C(=C/C(=O)O)\c1ccccc1 Amb17594707 [1,0,1,0,0,0|2,0,0]=4 908 B12R1.107 NC(=CC(N)=S)c1ccccc1 Amb19374001 [1,0,1,0,0,0|1,1,0]=4 909 B12R1.107 NC(=N)\C=C(\O)/c1ccccc1 Amb25327780 [1,0,1,0,0,0|1,0,0]=3 910 B12R1.107 NC(=O)C[C@@H](O)c1ccccc1 Amb25751170 [1,0,1,0,0,0|0,0,2]=4 911 B12R1.107 NC(=O)C[C@H](O)c1ccccc1 Amb25150965 [1,0,1,0,0,0|0,0,2]=4 912 B12R1.107 NC(=O)NC(=N)c1ccccc1 Amb25337571 [1,0,1,0,0,0|2,0,0]=4 913 B12R1.107 NC(=O)NC(=S)c1ccccc1 Amb24532795 [1,0,1,0,0,0|1,1,0]=4 914 B12R1.107 NC(=O)\C=C(\O)/c1cccc[n]1 Amb25150829 [1,0,1,0,0,0|1,0,0]=3 915 B12R1.107 NC(=O)\C=C(\O)/c1ccccc1 Amb24580412 [1,0,1,0,0,0|0,0,0]=2 916 B12R1.107 NC(=S)\C=C(/S)\c1ccccc1 Amb24637728 [1,0,1,0,0,0|0,2,0]=4 917 B12R1.107 NC(=S)\C=C(\S)/c1ccccc1 Amb25223139 [1,0,1,0,0,0|0,2,0]=4 918 B12R1.107 NC(N)=CC(=O)c1ccccc1 Amb25108111 [1,0,1,0,0,0|1,0,1]=4 919 B12R1.107 N\C(=C/C(O)=O)\c1ccccc1 Amb22054873 [1,0,1,0,0,0|2,0,0]=4 920 B12R1.107 N\C(=C\C(N)=S)\c1ccccc1 Amb22225089 [1,0,1,0,0,0|1,1,0]=4 921 B12R1.107 N\C(=C\C(O)=O)\c1ccccc1 Amb25274098 [1,0,1,0,0,0|2,0,0]=4 922 B12R1.107 O=C(c1ccccc1)C=C(C)C Amb10874044 [1,0,1,0,0,0|1,0,1]=4 923 B12R1.107 O=C(c1ccccc1)\C=C(/N)\C Amb2386640 [1,0,1,0,0,0|1,0,1]=4 924 B12R1.107 OC(=O)\C=C(\F)/c1ccccc1 Amb24426178 [1,0,1,0,0,0|2,0,0]=4 925 B12R1.107 [OH2+]\C(=C/C(=O)C)\c1ccccc1 Amb1395651 [1,0,1,0,0,0|0,0,1]=3 926 B12R1.107 [OH2+]\C(=C/C(=O)C)\c1ccccc1 Amb2563772 [1,0,1,0,0,0|0,0,1]=3 927 B12R1.32 C=CCC(=O)Nc1ccccc1 Amb25123880 [1,0,1,0,0,0|1,0,1]=4 928 B12R1.32 C\C(=C/C=O)\Nc1ccccc1 Amb18645507 [1,0,1,0,0,0|1,0,1]=4 929 B12R1.32 C\C(=C\C=O)\Nc1ccccc1 Amb24611198 [1,0,1,0,0,0|1,0,1]=4 930 B12R1.32 C\C=C\C(=O)Nc1cccc[n]1 Amb25785202 [1,0,1,0,0,0|2,0,0]=4 931 B12R1.32 C\C=C\C(=O)Nc1ccccc1 Amb24497299 [1,0,1,0,0,0|1,0,0]=3 932 B12R1.32 O=C(C=C=O)Nc1ccccc1 Amb24441652 [1,0,1,0,0,0|0,0,2]=4 933 B12R1.32 O=C(Cc1ccccc1)\C=C\Cl Amb25216983 [1,0,1,0,0,0|2,0,0]=4 934 B12R1.32 O=C(NC=O)Nc1ccccc1 Amb22347423 [1,0,1,0,0,0|1,0,1]=4 935 B12R1.32 O=C(\C=C\F)Nc1ccccc1 Amb24386157 [1,0,1,0,0,0|1,0,0]=3 936 B12R1.32 ONCC(=O)Nc1ccccc1 Amb24495972 [1,0,1,0,0,0|1,0,1]=4 937 B12R1.32 O\C=C/C(=S)Nc1ccccc1 Amb24495245 [1,0,1,0,0,0|0,1,0]=3 938 B12R1.32 O\C=C\C(=O)Cc1ccccc1 Amb25093804 [1,0,1,0,0,0|1,0,0]=3 939 B12R1.32 O\C=C\C(=S)Nc1ccccc1 Amb24592387 [1,0,1,0,0,0|0,1,0]=3 940 B12R1.32 O\N=C\C(=O)Cc1ccccc1 Amb24577781 [1,0,1,0,0,0|2,0,0]=4 941 B12R1.32 O\N=C\C(=O)Nc1ccccc1 Amb1205570 [1,0,1,0,0,0|1,0,0]=3 942 B12R1.34 BrCC(=O)N(c1ccccc1)C Amb2081957 [1,0,1,0,0,0|1,0,1]=4 943 B12R1.34 C=C(C(=O)C=C)c1ccccc1 Amb24559066 [1,0,1,0,0,0|1,0,1]=4 944 B12R1.34 C=CC(=O)N(c1cccnc1)C Amb16192560 [1,0,1,0,0,0|1,0,0]=3 945 B12R1.34 C=CC(=O)[C@H](F)c1ccccc1 Amb24676844 [1,0,1,0,0,0|2,0,0]=4 946 B12R1.34 CC(C(=O)C=C)c1ccccc1 Amb24537754 [1,0,1,0,0,0|1,0,0]=3 947 B12R1.34 CC(C(=O)NO)c1ccccc1 Amb25800798 [1,0,1,0,0,0|2,0,0]=4 948 B12R1.34 CN(C(=O)C#C)c1ccccc1 Amb24705229 [1,0,1,0,0,0|0,0,2]=4 949 B12R1.34 CN(C(=O)CI)c1ccccc1 Amb23447342 [1,0,1,0,0,0|1,0,1]=4 950 B12R1.34 CN(C(=O)CS)c1ccccc1 Amb24096794 [1,0,1,0,0,0|0,1,1]=4 951 B12R1.34 CN(C(=O)NC)c1ccccc1 Amb24488531 [1,0,1,0,0,0|1,0,1]=4 952 B12R1.34 CN(C(=O)OC)c1ccccc1 Amb24612519 [1,0,1,0,0,0|1,0,1]=4 953 B12R1.34 CN(C(N)=NO)c1ccccc1 Amb18800911 [1,0,1,0,0,0|2,0,0]=4 954 B12R1.34 C[C@@H](C(=O)NO)c1ccccc1 Amb24722255 [1,0,1,0,0,0|2,0,0]=4 955 B12R1.34 C[C@H](C(=O)NO)c1ccccc1 Amb24459061 [1,0,1,0,0,0|2,0,0]=4 956 B12R1.34 ClCC(=O)N(c1ccccc1)C Amb1207237 [1,0,1,0,0,0|1,0,1]=4 957 B12R1.75 C=Cc1ccccc1NC(N)=O Amb24726165 [1,0,1,0,0,0|2,0,0]=4 958 B12R1.75 CC(=O)Nc1ccccc1NO Amb25678573 [1,0,1,0,0,0|1,0,1]=4 959 B12R1.75 NC(=O)Nc1ccccc1CO Amb18792741 [1,0,1,0,0,0|1,0,1]=4 960 B12R1.75 OCc1ccccc1NC(=O)C Amb13952729 [1,0,1,0,0,0|0,0,2]=4 961 B12R1.77 CC(C=C)c1ccccc1CO Amb24719510 [1,0,1,0,0,0|1,0,1]=4 962 B12R1.77 CCc1ccccc1C(=O)C=C Amb25692004 [1,0,1,0,0,0|1,0,1]=4 963 B12R1.77 CCc1ccccc1C(O)C=C Amb24532684 [1,0,1,0,0,0|1,0,1]=4 964 B12R1.77 CCc1ccccc1C(O)C=O Amb25341843 [1,0,1,0,0,0|1,0,1]=4 965 B12R1.77 CN(C=O)c1ccccc1C=O Amb24084249 [1,0,1,0,0,0|0,0,1]=3 966 B12R1.77 CNc1ccc[n]c1C(=C)C=C Amb25835562 [1,0,1,0,0,0|2,0,0]=4 967 B12R1.77 CNc1ccccc1C(=C)C=C Amb25072748 [1,0,1,0,0,0|1,0,0]=3 968 B12R1.77 CNc1ccccc1C(C)C=C Amb25667051 [1,0,1,0,0,0|1,0,1]=4 969 B12R1.77 CNc1ccccc1N(C)C=O Amb25375772 [1,0,1,0,0,0|1,0,1]=4 970 B12R1.77 COc1ccccc1C(=O)C=C Amb18563546 [1,0,1,0,0,0|1,0,1]=4 971 B12R1.77 COc1ccccc1C(=O)C=O Amb22228874 [1,0,1,0,0,0|1,0,1]=4 972 B12R1.77 COc1ccccc1C(O)C=O Amb25107227 [1,0,1,0,0,0|1,0,1]=4 973 B12R1.77 COc1ccccc1N(C)C=O Amb25736171 [1,0,1,0,0,0|1,0,1]=4 974 B12R1.77 CSc1ccccc1C(O)C=C Amb25787609 [1,0,1,0,0,0|1,0,1]=4 975 B12R1.124 CC(=O)N(C)c1ccccc1Br Amb24462353 [1,0,1,0,0,0|1,0,1]=4 976 B12R1.124 CC(=O)N(C)c1ccccc1F Amb25151063 [1,0,1,0,0,0|1,0,1]=4 977 B12R1.124 CC(=O)N(C)c1ccccc1O Amb18646273 [1,0,1,0,0,0|0,0,1]=3 978 B12R1.124 CC(=O)N(c1ccccc1N)C Amb2444993 [1,0,1,0,0,0|1,0,1]=4 979 B12R1.124 CC(c1ccccc1O)C(O)=O Amb22228079 [1,0,1,0,0,0|2,0,0]=4 980 B12R1.124 CN(C(N)=O)c1ccccc1F Amb18788752 [1,0,1,0,0,0|2,0,0]=4 981 B12R1.124 CN(C(N)=O)c1ccccc1O Amb18646492 [1,0,1,0,0,0|1,0,0]=3 982 B12R1.124 CN(C(N)=O)c1ccccc1S Amb25095886 [1,0,1,0,0,0|1,1,0]=4 983 B12R1.124 CN(c1ccccc1N)C(N)=O Amb18279536 [1,0,1,0,0,0|2,0,0]=4 984 B12R1.124 Cc1ccccc1N(C)C(=O)Cl Amb25034673 [1,0,1,0,0,0|1,0,1]=4 985 B12R1.124 Cc1ccccc1N(C)C(C)=O Amb24085648 [1,0,1,0,0,0|0,0,2]=4 986 B12R1.124 Cc1ccccc1N(C)C(N)=O Amb18788281 [1,0,1,0,0,0|1,0,1]=4 987 B12R1.374 Cc1cc(\C=C\C=O)c(O)cc1 Amb24653613 [1,0,1,0,0,0|2,0,0]=4 988 B12R1.121 C#Cc1ccccc1\C=C\C=O Amb25683471 [1,0,1,0,0,0|1,0,1]=4 989 B12R1.121 CCc1ccccc1\C=C\C=O Amb25779337 [1,0,1,0,0,0|1,0,0]=3 990 B12R1.121 CNc1ccc[n]c1\C=C\C=C Amb25046868 [1,0,1,0,0,0|2,0,0]=4 991 B12R1.121 COc1ccccc1\C=C/C=O Amb25798308 [1,0,1,0,0,0|1,0,0]=3 992 B12R1.121 COc1ccccc1\C=C\C=C Amb24574093 [1,0,1,0,0,0|2,0,0]=4 993 B12R1.121 N#Cc1ccccc1\C=C\C=O Amb25205506 [1,0,1,0,0,0|2,0,0]=4 994 B12R1.121 O=Cc1ccccc1\C=C/C=O Amb18645280 [1,0,1,0,0,0|2,0,0]=4 995 B12R1.121 O=Cc1ccccc1\C=C\C=O Amb24558640 [1,0,1,0,0,0|2,0,0]=4 996 B12R1.308 C\C(=C\C=C)\c1ccccc1N Amb24379609 [1,0,1,0,0,0|2,0,0]=4 997 B12R1.308 C\C(=C\C=O)\c1ccccc1Cl Amb25302195 [1,0,1,0,0,0|2,0,0]=4 998 B12R1.308 Cc1ccccc1C(=O)\C=C\C Amb24360336 [1,0,1,0,0,0|1,0,1]=4 999 B12R1.308 Cc1ccccc1C(=O)\C=C\Cl Amb25151142 [1,0,1,0,0,0|1,0,1]=4 1000 B12R1.308 Cc1ccccc1C(O)\C=C\C Amb25112696 [1,0,1,0,0,0|1,0,1]=4 1001 B12R1.308 Cc1ccccc1\C(\Cl)=C\C=O Amb24435372 [1,0,1,0,0,0|1,0,0]=3 1002 B12R1.308 Nc1ccccc1C(=O)CC=O Amb25299151 [1,0,1,0,0,0|0,0,2]=4 1003 B12R1.308 O=C\C=C(/Cl)\c1ccccc1F Amb25674459 [1,0,1,0,0,0|2,0,0]=4 1004 B12R1.261 CC(=C)c1ccccc1C(O)=O Amb18126330 [1,0,1,0,0,0|2,0,0]=4 1005 B12R1.261 CC(=O)c1ccccc1C(O)=O Amb22337995 [1,0,1,0,0,0|2,0,0]=4 1006 B12R1.261 CN(C)c1ccccc1C(O)=O Amb21964350 [1,0,1,0,0,0|1,0,1]=4 1007 B12R1.261 CN(O)c1ccccc1C(O)=O Amb24470136 [1,0,1,0,0,0|1,0,1]=4 1008 B12R1.261 CS(=O)c1ccccc1C(=O)O Amb1216535 [1,0,1,0,0,0|2,0,0]=4 1009 B12R1.283 CC(=C)c1ccccc1NC=O Amb24381922 [1,0,1,0,0,0|1,0,0]=3 1010 B12R1.283 CC(O)c1ccccc1NC=O Amb18792637 [1,0,1,0,0,0|0,0,2]=4 1011 B12R1.283 O=CCc1ccccc1C(=O)O Amb17594062 [1,0,1,0,0,0|2,0,0]=4 1012 B12R1.283 OC(=O)c1c[n]ccc1NC=O Amb24561920 [1,0,1,0,0,0|2,0,0]=4 1013 B12R2.24 Brc1ccc2c(c1)cccc2 Amb1159157 [2,0,0,0,0,0|2,0,0]=4 1014 B12R2.24 CC1C=Cc2c(N1)cccc2 Amb17593644 [2,0,0,0,0,0|1,0,1]=4 1015 B12R2.24 Cc1ccc2c(n1)cccc2 Amb1151967 [2,0,0,0,0,0|1,0,1]=4 1016 B12R2.24 Cc1ccc2ccccc2[n]1 Amb24097096 [2,0,0,0,0,0|1,0,1]=4 1017 B12R2.24 ClC1=CCc2c(N1)cccc2 Amb15691607 [2,0,0,0,0,0|1,0,1]=4 1018 B12R2.24 Fc1ccc2ccccc2[n]1 Amb20171185 [2,0,0,0,0,0|1,0,1]=4 1019 B12R2.24 Ic1ccc2c(n1)cccc2 Amb10604284 [2,0,0,0,0,0|1,0,1]=4 1020 B12R2.24 Nc1cc2ccccc2cc1 Amb22057457 [2,0,0,0,0,0|2,0,0]=4 1021 B12R2.24 Nc1cc[13c]2[13c](c1)[13cH][13cH][13cH][13cH]2 Amb17618259 [2,0,0,0,0,0|2,0,0]=4 1022 B12R2.24 Nc1ccc2c(n1)cccc2 Amb1152993 [2,0,0,0,0,0|1,0,1]=4 1023 B12R2.24 O=C1C=C2C=CC=CC2=CN1 Amb19958596 [2,0,0,0,0,0|2,0,0]=4 1024 B12R2.24 O=C1C=C2C=CC=CC2=CO1 Amb25242585 [2,0,0,0,0,0|2,0,0]=4 1025 B12R2.24 O=C1C=Cc2[n]c[n]cc2N1 Amb21811941 [2,0,0,0,0,0|2,0,0]=4 1026 B12R2.24 O=C1C=Cc2[n]cc[n]c2N1 Amb19957771 [2,0,0,0,0,0|2,0,0]=4 1027 B12R2.24 O=C1C=Cc2[n]cccc2N1 Amb21856966 [2,0,0,0,0,0|1,0,0]=3 1028 B12R2.24 O=C1C=Cc2c[n]ccc2N1 Amb21618693 [2,0,0,0,0,0|1,0,0]=3 1029 B12R2.24 O=C1C=Cc2cc[n]cc2N1 Amb22493786 [2,0,0,0,0,0|1,0,0]=3 1030 B12R2.24 O=C1C=Cc2cc[n]cc2O1 Amb24395883 [2,0,0,0,0,0|2,0,0]=4 1031 B12R2.24 O=C1C=Cc2ccc[n]c2N1 Amb22001403 [2,0,0,0,0,0|1,0,0]=3 1032 B12R2.24 O=C1C=Cc2ccccc2N1 Amb18546039 [2,0,0,0,0,0|0,0,0]=2 1033 B12R2.24 O=C1C=Cc2ccccc2O1 Amb18511466 [2,0,0,0,0,0|1,0,0]=3 1034 B12R2.24 O=C1C=Cc2ccccc2S1 Amb20663396 [2,0,0,0,0,0|1,0,0]=3 1035 B12R2.24 O=C1C=Cc2ccccc2[N-]1 Amb21940629 [2,0,0,0,0,0|0,0,1]=3 1036 B12R2.24 O=C1C=Nc2cc[n]cc2N1 Amb18016830 [2,0,0,0,0,0|2,0,0]=4 1037 B12R2.24 O=C1C=Nc2ccc[n]c2N1 Amb20461570 [2,0,0,0,0,0|2,0,0]=4 1038 B12R2.24 O=C1C=Nc2ccccc2N1 Amb18372452 [2,0,0,0,0,0|1,0,0]=3 1039 B12R2.24 O=C1COc2c(N1)cccc2 Amb1011836 [2,0,0,0,0,0|1,0,1]=4 1040 B12R2.24 O=C1CSc2c(N1)cccc2 Amb1007458 [2,0,0,0,0,0|1,0,1]=4 1041 B12R2.24 O=C1Cc2ccccc2N=C1 Amb24078566 [2,0,0,0,0,0|2,0,0]=4 1042 B12R2.24 O=C1N=Cc2ccccc2O1 Amb22054765 [2,0,0,0,0,0|2,0,0]=4 1043 B12R2.24 O=C1NCc2c(N1)cccc2 Amb10603974 [2,0,0,0,0,0|1,0,1]=4 1044 B12R2.24 O=C1Nc2ccccc2C=N1 Amb20653982 [2,0,0,0,0,0|1,0,0]=3 1045 B12R2.24 O=C1Nc2ccccc2C=N1 Amb22752711 [2,0,0,0,0,0|1,0,0]=3 1046 B12R2.24 O=C1Nc2ccccc2CO1 Amb19516356 [2,0,0,0,0,0|1,0,1]=4 1047 B12R2.24 O=C1Nc2ccccc2CS1 Amb24509578 [2,0,0,0,0,0|1,0,1]=4 1048 B12R2.24 O=[n]1cc2ccccc2cc1 Amb20247039 [2,0,0,0,0,0|2,0,0]=4 1049 B12R2.24 O=c1c[n]c2[n]cccc2[nH]1 Amb24082016 [2,0,0,0,0,0|2,0,0]=4 1050 B12R2.24 O=c1ccc2c(o1)cccc2 Amb1802468 [2,0,0,0,0,0|1,0,0]=3 1051 B12R2.24 O=c1ccc2c[n]ccc2o1 Amb24100794 [2,0,0,0,0,0|2,0,0]=4 1052 B12R2.24 O=c1cnc2c([nH]1)cccc2 Amb1352017 [2,0,0,0,0,0|1,0,0]=3 1053 B12R2.24 O=c1ncc2c([nH]1)cccc2 Amb2569659 [2,0,0,0,0,0|1,0,0]=3 1054 B12R2.24 O[13c]1[13cH][13c]2[13cH][13cH][13cH][13cH][13c]2[13cH][13cH]1 Amb22055903 [2,0,0,0,0,0|1,0,1]=4 1055 B12R2.24 Oc1cc2ccccc2cc1 Amb21973568 [2,0,0,0,0,0|1,0,1]=4 1056 B12R2.24 Oc1ccc2c(n1)cccc2 Amb1818223 [2,0,0,0,0,0|0,0,2]=4 1057 B12R2.24 S=C1C=Cc2ccccc2N1 Amb18526983 [2,0,0,0,0,0|0,1,0]=3 1058 B12R2.24 S=C1C=Cc2ccccc2O1 Amb21884783 [2,0,0,0,0,0|1,1,0]=4 1059 B12R2.24 S=C1C=Nc2ccccc2N1 Amb18043605 [2,0,0,0,0,0|1,1,0]=4 1060 B12R2.24 S=c1ccc2ccccc2[s]1 Amb24065643 [2,0,0,0,0,0|1,1,0]=4 1061 B12R2.24 Sc1ccc2c(c1)cccc2 Amb1152959 [2,0,0,0,0,0|1,1,0]=4 1062 B12R2.24 Sc1ccc2c(n1)cccc2 Amb1151737 [2,0,0,0,0,0|0,1,1]=4 1063 B12R2.24 [13CH3][13c]1[13cH][13cH][13c]2[13c]([13cH]1)[13cH][13cH][13cH][13cH]2 Amb17617622 [2,0,0,0,0,0|2,0,0]=4 1064 B12R2.24 [Mg+]c1cc2ccccc2cc1 Amb22044011 [2,0,0,0,0,0|2,0,0]=4 1065 B12R2.24 [NH3+]c1cc2[13cH][13cH][13cH][13cH]c2cc1 Amb22057458 [2,0,0,0,0,0|2,0,0]=4 1066 B12R2.24 [O-]c1ccc2ccccc2[n]1 Amb22474102 [2,0,0,0,0,0|0,0,2]=4 1067 B12R2.24 c1([2H])ccc2c(n1)cccc2 Amb10573520 [2,0,0,0,0,0|1,0,1]=4 1068 B12R2.1081 Bc1cccc2ccccc21 Amb24572623 [2,0,0,0,0,0|2,0,0]=4 1069 B12R2.1081 Brc1ccnc2c1cccc2 Amb2447564 [2,0,0,0,0,0|1,0,1]=4 1070 B12R2.1081 C=C1C=CNc2ccc[n]c21 Amb24407157 [2,0,0,0,0,0|2,0,0]=4 1071 B12R2.1081 C=C1C=CNc2ccccc21 Amb24070554 [2,0,0,0,0,0|1,0,0]=3 1072 B12R2.1081 CC1SC=Cc2ccccc21 Amb24485795 [2,0,0,0,0,0|2,0,0]=4 1073 B12R2.1081 C[n+]1cccc2c1cccc2 Amb10553831 [2,0,0,0,0,0|0,0,1]=3 1074 B12R2.1081 C[n+]1cccc2c1cccc2 Amb2540187 [2,0,0,0,0,0|0,0,1]=3 1075 B12R2.1081 C[n+]1cccc2ccccc12 Amb22360002 [2,0,0,0,0,0|0,0,1]=3 1076 B12R2.1081 C[n+]1ccnc2c1cccc2 Amb2229303 [2,0,0,0,0,0|1,0,1]=4 1077 B12R2.1081 C[n+]1ccnc2c1cccc2 Amb2519210 [2,0,0,0,0,0|1,0,1]=4 1078 B12R2.1081 Cc1[n]ccc2ccccc21 Amb24074119 [2,0,0,0,0,0|2,0,0]=4 1079 B12R2.1081 Cc1cccc2c1cccn2 Amb2447286 [2,0,0,0,0,0|2,0,0]=4 1080 B12R2.1081 Cc1cccc2c1ccnc2 Amb2447327 [2,0,0,0,0,0|2,0,0]=4 1081 B12R2.1081 Cc1cccc2c1cncc2 Amb10070397 [2,0,0,0,0,0|2,0,0]=4 1082 B12R2.1081 Cc1cccc2c1nccc2 Amb1229978 [2,0,0,0,0,0|2,0,0]=4 1083 B12R2.1081 Cc1cncc2c1cccc2 Amb15691609 [2,0,0,0,0,0|2,0,0]=4 1084 B12R2.1081 Cc1nccc2ccccc12 Amb17672018 [2,0,0,0,0,0|2,0,0]=4 1085 B12R2.1081 Clc1ccnc2c1cccc2 Amb1033000 [2,0,0,0,0,0|1,0,1]=4 1086 B12R2.1081 Fc1cc[n]c2ccccc21 Amb21960885 [2,0,0,0,0,0|1,0,1]=4 1087 B12R2.1081 Fc1ccnc2c1cccc2 Amb10067580 [2,0,0,0,0,0|1,0,1]=4 1088 B12R2.1081 NN1CC=Cc2ccccc12 Amb24060055 [2,0,0,0,0,0|1,0,1]=4 1089 B12R2.1081 N[13c]1[13cH][13cH][13cH][13c]2[13cH][13cH][13cH][13cH][13c]21 Amb22057463 [2,0,0,0,0,0|2,0,0]=4 1090 B12R2.1081 N[n+]1cccc2c1cccc2 Amb10553640 [2,0,0,0,0,0|1,0,1]=4 1091 B12R2.1081 N[n+]1cccc2c1cccc2 Amb10553663 [2,0,0,0,0,0|1,0,1]=4 1092 B12R2.1081 N[n+]1cccc2c1cccc2 Amb2237833 [2,0,0,0,0,0|1,0,1]=4 1093 B12R2.1081 Nc1cccc2c1cccc2 Amb1935098 [2,0,0,0,0,0|2,0,0]=4 1094 B12R2.1081 Nc1ccnc2c1cccc2 Amb1102727 [2,0,0,0,0,0|1,0,1]=4 1095 B12R2.1081 O=C1C=CCc2c1cccc2 Amb2388336 [2,0,0,0,0,0|1,0,1]=4 1096 B12R2.1081 O=C1C=CNc2[n]cccc21 Amb22490480 [2,0,0,0,0,0|1,0,1]=4 1097 B12R2.1081 O=C1C=CNc2[n]cccc21 Amb22490488 [2,0,0,0,0,0|1,0,1]=4 1098 B12R2.1081 O=C1C=CNc2c[n]ccc21 Amb22055906 [2,0,0,0,0,0|1,0,1]=4 1099 B12R2.1081 O=C1C=CNc2cc[n]cc21 Amb20623103 [2,0,0,0,0,0|1,0,1]=4 1100 B12R2.1081 O=C1C=CNc2ccc[n]c21 Amb22489921 [2,0,0,0,0,0|1,0,1]=4 1101 B12R2.1081 O=C1C=CNc2ccccc21 Amb18369085 [2,0,0,0,0,0|0,0,1]=3 1102 B12R2.1081 O=C1C=COc2ccccc21 Amb19894749 [2,0,0,0,0,0|1,0,1]=4 1103 B12R2.1081 O=C1C=CSc2ccccc21 Amb22347337 [2,0,0,0,0,0|1,0,1]=4 1104 B12R2.1081 O=C1C=C[Se]c2ccccc21 Amb22551504 [2,0,0,0,0,0|1,0,1]=4 1105 B12R2.1081 O=C1C=NNc2ccccc21 Amb18528334 [2,0,0,0,0,0|1,0,1]=4 1106 B12R2.1081 OC1=C2C=CC=CN2CC=C1 Amb17835332 [2,0,0,0,0,0|2,0,0]=4 1107 B12R2.1081 OC1=CNNc2ccccc21 Amb22057612 [2,0,0,0,0,0|1,0,0]=3 1108 B12R2.1081 OC1=COCc2c1cccc2 Amb10603427 [2,0,0,0,0,0|2,0,0]=4 1109 B12R2.1081 OC1C=COc2ccccc21 Amb25758786 [2,0,0,0,0,0|1,0,1]=4 1110 B12R2.1081 O[13c]1[13cH][13cH][13cH][13c]2[13c]1[13cH][13cH][13cH][13cH]2 Amb17618239 [2,0,0,0,0,0|1,0,0]=3 1111 B12R2.1081 O[14c]1cccc2ccccc12 Amb22352351 [2,0,0,0,0,0|1,0,0]=3 1112 B12R2.1081 O[C@@H]1C=CCc2ccccc21 Amb25149702 [2,0,0,0,0,0|1,0,1]=4 1113 B12R2.1081 O[C@@H]1C=COc2ccccc21 Amb25108504 [2,0,0,0,0,0|1,0,1]=4 1114 B12R2.1081 Oc1[n]ccc2ccccc21 Amb22347767 [2,0,0,0,0,0|2,0,0]=4 1115 B12R2.1081 Oc1c[n]cc2ccccc21 Amb21964404 [2,0,0,0,0,0|2,0,0]=4 1116 B12R2.1081 Oc1cc[n]c2[n]cccc21 Amb18124767 [2,0,0,0,0,0|1,0,1]=4 1117 B12R2.1081 Oc1cc[n]c2ccccc21 Amb22450352 [2,0,0,0,0,0|0,0,1]=3 1118 B12R2.1081 Oc1cccc2c1[nH+]ccc2 Amb10807807 [2,0,0,0,0,0|2,0,0]=4 1119 B12R2.1081 Oc1cccc2c1nccc2 Amb10071350 [2,0,0,0,0,0|2,0,0]=4 1120 B12R2.1081 Oc1cccc2c1nccc2 Amb10843705 [2,0,0,0,0,0|2,0,0]=4 1121 B12R2.1081 Oc1cccc2c1nccc2 Amb1151957 [2,0,0,0,0,0|2,0,0]=4 1122 B12R2.1081 Oc1cccc2ccc[nH+]c21 Amb20246575 [2,0,0,0,0,0|2,0,0]=4 1123 B12R2.1081 Oc1cccc2ccc[n]c12 Amb22167517 [2,0,0,0,0,0|2,0,0]=4 1124 B12R2.1081 Oc1cccc2ccc[n]c12 Amb24096675 [2,0,0,0,0,0|2,0,0]=4 1125 B12R2.1081 Oc1cccc2ccc[n]c21 Amb20621451 [2,0,0,0,0,0|2,0,0]=4 1126 B12R2.1081 Oc1cccc2ccc[n]c21 Amb24062965 [2,0,0,0,0,0|2,0,0]=4 1127 B12R2.1081 Oc1cccc2cccnc12 Amb17942951 [2,0,0,0,0,0|2,0,0]=4 1128 B12R2.1081 Oc1cncc2c1cccc2 Amb10553148 [2,0,0,0,0,0|2,0,0]=4 1129 B12R2.1081 Oc1cnnc2c1cccc2 Amb2371264 [2,0,0,0,0,0|1,0,1]=4 1130 B12R2.1081 Pc1cccc2ccccc21 Amb24739753 [2,0,0,0,0,0|2,0,0]=4 1131 B12R2.1081 S=C1C=CNc2ccccc21 Amb19414493 [2,0,0,0,0,0|0,1,0]=3 1132 B12R2.1081 S=C1C=NNc2ccccc21 Amb18043628 [2,0,0,0,0,0|1,1,0]=4 1133 B12R2.1081 S=c1cc[nH]c2c1cccc2 Amb10553628 [2,0,0,0,0,0|0,1,0]=3 1134 B12R2.1081 Sc1ccnc2c1cccc2 Amb10603792 [2,0,0,0,0,0|0,1,1]=4 1135 B12R2.1081 [Mg+]c1cccc2ccccc21 Amb22044005 [2,0,0,0,0,0|2,0,0]=4 1136 B12R2.1081 [Na]c1cccc2ccccc21 Amb24485785 [2,0,0,0,0,0|2,0,0]=4 1137 B14R1.10 CNC(=O)CC(O)c1ccc(F)cc1 Amb25166087 [0,1,1,0,0,0|0,0,2]=4 1138 B14R1.10 CN\C(\C)=C/C(=O)c1ccc(C)cc1 Amb25691475 [0,1,1,0,0,0|1,0,1]=4 1139 B14R1.10 COC(=O)\C=C(\N)/c1ccc(F)cc1 Amb25799414 [0,1,1,0,0,0|2,0,0]=4 1140 B14R1.10 C\C(=C/C(=O)OC)\c1ccc(Br)cc1 Amb25256042 [0,1,1,0,0,0|2,0,0]=4 1141 B14R1.10 C\C(=C\C(=O)OC)\c1ccc(Br)cc1 Amb25717231 [0,1,1,0,0,0|2,0,0]=4 1142 B14R1.10 Cc1ccc(cc1)C(O)CC(=O)NC Amb24566206 [0,1,1,0,0,0|0,0,2]=4 1143 B14R1.10 Cc1ccc(cc1)\C(\C)=C/C(=O)NC Amb25690812 [0,1,1,0,0,0|1,0,0]=3 1144 B14R1.10 Cc1ccc(cc1)\C(\C)=C/C(=O)OC Amb24635465 [0,1,1,0,0,0|2,0,0]=4 1145 B14R1.10 Cc1ccc(cc1)\C(\C)=C\C(=O)OC Amb25049394 [0,1,1,0,0,0|2,0,0]=4 1146 B14R1.11 CNC(=O)NC(=O)c1cccc(N)c1 Amb25351503 [0,1,1,0,0,0|1,0,1]=4 1147 B14R1.11 COC(=O)\C=C(\N)/c1cccc(F)c1 Amb25317935 [0,1,1,0,0,0|2,0,0]=4 1148 B14R1.11 C\C(=C\C(=O)OC)\c1cc(Cl)ccc1 Amb25850659 [0,1,1,0,0,0|2,0,0]=4 1149 B14R1.29 CCNC(=O)NC(=N)c1ccccc1 Amb25081406 [0,1,1,0,0,0|2,0,0]=4 1150 B14R1.29 CCOC(=O)\C=C(/N)\c1ccccc1 Amb22285050 [0,1,1,0,0,0|2,0,0]=4 1151 B14R1.29 CCOC(=O)\C=C(/c1ccccc1)\C Amb10566527 [0,1,1,0,0,0|2,0,0]=4 1152 B14R1.58 CC\C(=C\C(=O)c1ccccc1)\NC Amb25664183 [0,1,1,0,0,0|1,0,1]=4 1153 B14R1.85 CC(C(O)c1ccccc1)C(=O)NC Amb25166106 [0,1,1,0,0,0|0,0,2]=4 1154 B14R1.85 CNC(=O)C(Cl)C(O)c1ccccc1 Amb25790564 [0,1,1,0,0,0|0,0,2]=4 1155 B14R1.85 CNC(=O)C(O)C(O)c1ccccc1 Amb25035731 [0,1,1,0,0,0|0,0,2]=4 1156 B14R1.85 CNC(=O)N(C)C(=O)c1ccccc1 Amb24551879 [0,1,1,0,0,0|1,0,1]=4 1157 B14R1.85 CN\C(\C)=C(\C)/C(=O)c1ccccc1 Amb25366557 [0,1,1,0,0,0|1,0,1]=4 1158 B14R1.85 C\C(\C(=O)OC)=C(\N)/c1ccccc1 Amb24711435 [0,1,1,0,0,0|2,0,0]=4 1159 B14R1.85 C\C(\NC)=C(/Cl)\C(=O)c1ccccc1 Amb24336448 [0,1,1,0,0,0|1,0,1]=4 1160 B14R1.290 C\C(=C\S(=O)(=O)NC)\c1ccccc1 Amb25079697 [0,1,1,0,0,0|2,0,0]=4 1161 B14R1.415 CC(C)C(=O)\C=C(\N)/c1ccccc1 Amb24536316 [0,1,1,0,0,0|2,0,0]=4 1162 B14R1.415 CN(C)C(=O)NC(=O)c1ccccc1 Amb25237559 [0,1,1,0,0,0|1,0,1]=4 1163 B14R1.415 CN(C)C(=O)NC(=S)c1ccccc1 Amb24398694 [0,1,1,0,0,0|1,1,0]=4 1164 B14R1.587 CNC(=O)CC(=O)c1ccccc1Cl Amb25166136 [0,1,1,0,0,0|0,0,2]=4 1165 B14R1.587 CNC(=O)\C=C(\O)/c1ccccc1Cl Amb24563874 [0,1,1,0,0,0|0,0,0]=2 1166 B14R1.587 C\C(=C/C(=O)OC)\c1ccccc1Cl Amb25776873 [0,1,1,0,0,0|2,0,0]=4 1167 B14R1.587 C\C(=C/C(=O)OC)\c1ccccc1O Amb25094328 [0,1,1,0,0,0|2,0,0]=4 1168 B14R1.587 C\C(=C\C(=O)OC)\c1ccccc1Br Amb24687209 [0,1,1,0,0,0|2,0,0]=4 1169 B14R1.587 C\C(=C\C(=O)OC)\c1ccccc1Cl Amb24463095 [0,1,1,0,0,0|2,0,0]=4 1170 B14R1.587 C\C(=C\C(=O)OC)\c1ccccc1F Amb25856433 [0,1,1,0,0,0|2,0,0]=4 1171 B14R1.587 Cc1ccccc1\C(\C)=C/C(=O)OC Amb24701693 [0,1,1,0,0,0|2,0,0]=4 1172 B14R1.587 Cc1ccccc1\C(\C)=C\C(=O)OC Amb25228450 [0,1,1,0,0,0|2,0,0]=4 1173 B14R1.587 Cc1ccccc1\C(\N)=C/C(=O)OC Amb24634141 [0,1,1,0,0,0|2,0,0]=4 1174 B14R1.741 CC(O)(CC(=O)NC)c1ccccc1 Amb25800022 [0,1,1,0,0,0|0,0,2]=4 1175 B14R1.3297 CNC(=O)\C=C(\SC)/c1ccccc1 Amb25243048 [0,1,1,0,0,0|0,1,0]=3 1176 B14R1.3297 CN\C(=C/C(=S)NC)\c1ccccc1 Amb25289078 [0,1,1,0,0,0|1,1,0]=4 1177 B14R1.3297 CN\C(=C\C(=O)NC)\c1ccccc1 Amb24571935 [0,1,1,0,0,0|1,0,0]=3 1178 B14R1.3297 C\C=C(\CC(=O)NC)/c1ccccc1 Amb25201547 [0,1,1,0,0,0|1,0,1]=4 1179 B14R1.35 C\C=C\C(=O)N(C)c1ccc(F)cc1 Amb25372394 [0,1,1,0,0,0|1,0,0]=3 1180 B14R1.36 C\C=C\C(=O)N(C)c1cccc(O)c1 Amb24670990 [0,1,1,0,0,0|1,0,0]=3 1181 B14R1.166 OCCCC(=O)N(c1ccccc1)C Amb17235619 [0,1,1,0,0,0|0,0,2]=4 1182 B14R1.417 CC(C)=CC(=O)N(C)c1ccc[n]c1 Amb24645533 [0,1,1,0,0,0|2,0,0]=4 1183 B14R1.417 CN(c1ccccc1)C(=O)CC(=O)O Amb17401705 [0,1,1,0,0,0|0,0,1]=3 1184 B14R1.417 C\C(=C/C(O)=O)\C(C)c1ccccc1 Amb25074635 [0,1,1,0,0,0|2,0,0]=4 1185 B14R1.417 C\C(\O)=C\C(=O)C(O)c1ccccc1 Amb24354377 [0,1,1,0,0,0|2,0,0]=4 1186 B14R1.604 CCN(c1ccccc1)C(=O)CCO Amb17336617 [0,1,1,0,0,0|0,0,2]=4 1187 B14R1.3348 Cc1ccccc1N(C)C(=O)\C=C\C Amb24645523 [0,1,1,0,0,0|1,0,0]=3 1188 B14R1.95 CN(C(=O)C=C)c1ccccc1C#N Amb24469070 [0,1,1,0,0,0|1,0,1]=4 1189 B14R1.429 CC(=O)C(C)c1ccccc1C(O)=O Amb25779999 [0,1,1,0,0,0|1,0,1]=4 1190 B14R1.429 CC(=O)N(C)c1ccccc1B(O)O Amb25076823 [0,1,1,0,0,0|1,0,1]=4 1191 B14R1.429 CC(=O)N(c1ccccc1C(=O)O)C Amb1235492 [0,1,1,0,0,0|0,0,1]=3 1192 B14R1.429 CC(O)c1ccccc1N(C)C(N)=O Amb25311440 [0,1,1,0,0,0|1,0,1]=4 1193 B14R1.429 CC(c1ccccc1C(O)=O)C(O)=O Amb18651689 [0,1,1,0,0,0|2,0,0]=4 1194 B14R1.429 CN(c1ccccc1C(N)=S)C(N)=O Amb25752782 [0,1,1,0,0,0|1,1,0]=4 1195 B14R1.429 NC(=O)N(c1ccccc1C(=O)O)C Amb1117915 [0,1,1,0,0,0|1,0,0]=3 1196 B14R1.481 CC(=O)N(C)c1ccccc1CC=C Amb24096437 [0,1,1,0,0,0|1,0,1]=4 1197 B14R1.599 COc1ccc(Br)cc1\C(\Cl)=C\C=O Amb24611611 [0,1,1,0,0,0|2,0,0]=4 1198 B14R1.599 COc1ccc(Cl)cc1\C(\Cl)=C\C=O Amb24756462 [0,1,1,0,0,0|2,0,0]=4 1199 B14R1.599 COc1ccc(cc1C(=CC=O)Cl)Br Amb17278770 [0,1,1,0,0,0|2,0,0]=4 1200 B14R1.599 COc1ccc(cc1C(=CC=O)Cl)Cl Amb17249274 [0,1,1,0,0,0|2,0,0]=4 1201 B14R1.599 COc1ccc(cc1C(=CC=O)Cl)F Amb17241778 [0,1,1,0,0,0|2,0,0]=4 1202 B14R1.599 Cc1cc(\C(\Cl)=C\C=O)c(cc1)OC Amb24741601 [0,1,1,0,0,0|2,0,0]=4 1203 B14R1.599 O=CC=C(c1cc(C)ccc1OC)Cl Amb17240739 [0,1,1,0,0,0|2,0,0]=4 1204 B14R1.840 CC(=C)\C=C(/O)\c1ccccc1NC Amb24695213 [0,1,1,0,0,0|1,0,0]=3 1205 B14R1.840 C\C(=C/C(C)=C)\c1ccccc1NC Amb24550535 [0,1,1,0,0,0|2,0,0]=4 1206 B14R1.840 C\C(=C/C(O)=O)\c1ccccc1OC Amb24271448 [0,1,1,0,0,0|2,0,0]=4 1207 B14R1.840 C\C(=C/C(O)=O)\c1ccccc1SC Amb25827554 [0,1,1,0,0,0|2,0,0]=4 1208 B14R1.840 C\C(=C\C(C)=C)\c1ccccc1NC Amb25377159 [0,1,1,0,0,0|2,0,0]=4 1209 B14R1.7233 C\C(=C/C=C)\c1ccc(Cl)cc1NC Amb24419965 [0,1,1,0,0,0|2,0,0]=4 1210 B14R1.7233 Cc1ccc(c(c1)OC)\C(\C)=C\C=O Amb25179887 [0,1,1,0,0,0|2,0,0]=4 1211 B14R1.7276 COc1cccc(F)c1\C(\Cl)=C\C=O Amb24680807 [0,1,1,0,0,0|2,0,0]=4 1212 B14R1.746 CN(C=O)c1ccccc1C(=O)CCl Amb24073095 [0,1,1,0,0,0|0,0,2]=4 1213 B14R1.1153 CN(C=O)c1cccc(Cl)c1C(O)=O Amb25123906 [0,1,1,0,0,0|1,0,0]=3 1214 B14R2.92 CCc1ccc2ccccc2[n+]1C Amb24631895 [1,1,0,0,0,0|1,0,1]=4 1215 B14R2.92 COC1C=Cc2ccccc2N1C Amb24084529 [1,1,0,0,0,0|0,0,2]=4 1216 B14R2.92 COc1ccc2ccccc2[n+]1C Amb24621441 [1,1,0,0,0,0|0,0,2]=4 1217 B14R2.92 COc1ccc2ccccc2c1C Amb17743960 [1,1,0,0,0,0|1,0,1]=4 1218 B14R2.92 CSc1ccc2ccccc2[n+]1C Amb17845236 [1,1,0,0,0,0|0,1,1]=4 1219 B14R2.92 Cc1c(C=O)ccc2[n]cccc21 Amb24418526 [1,1,0,0,0,0|2,0,0]=4 1220 B14R2.92 Cc1c(CN)ccc2ccccc21 Amb25815347 [1,1,0,0,0,0|2,0,0]=4 1221 B14R2.92 Cc1c(CO)ccc2ccccc21 Amb24415352 [1,1,0,0,0,0|1,0,1]=4 1222 B14R2.92 Cc1c2ccccc2ccc1C#C Amb24536447 [1,1,0,0,0,0|2,0,0]=4 1223 B14R2.92 Cc1c2ccccc2ccc1NN Amb25727291 [1,1,0,0,0,0|2,0,0]=4 1224 B14R2.92 N#Cc1ccc2c(c1C)cccc2 Amb17594178 [1,1,0,0,0,0|2,0,0]=4 1225 B14R2.92 O=Cc1ccc2c(c1C)cccc2 Amb17594259 [1,1,0,0,0,0|1,0,0]=3 1226 B14R2.92 O=Cc1ccc2ccccc2c1S Amb25668854 [1,1,0,0,0,0|2,0,0]=4 1227 B14R2.203 BrCc1c(I)ccc2ccccc21 Amb25351584 [1,1,0,0,0,0|2,0,0]=4 1228 B14R2.203 Brc1ccc2ccccc2c1CBr Amb22040437 [1,1,0,0,0,0|2,0,0]=4 1229 B14R2.203 C=C1C=Cc2ccccc2C1CO Amb24404781 [1,1,0,0,0,0|2,0,0]=4 1230 B14R2.203 CCN1C(=O)C=Cc2ccccc12 Amb22360524 [1,1,0,0,0,0|0,0,0]=2 1231 B14R2.203 CCN1C(=O)COc2c1cccc2 Amb17096162 [1,1,0,0,0,0|1,0,1]=4 1232 B14R2.203 CCN1C(=S)C=Cc2ccccc12 Amb20247294 [1,1,0,0,0,0|0,1,0]=3 1233 B14R2.203 CC[n+]1c(C)ccc2c1cccc2 Amb1144527 [1,1,0,0,0,0|1,0,1]=4 1234 B14R2.203 CCc1c(O)ccc2ccccc21 Amb25833618 [1,1,0,0,0,0|1,0,1]=4 1235 B14R2.203 CNc1c(N)ccc2ccccc21 Amb18126932 [1,1,0,0,0,0|2,0,0]=4 1236 B14R2.203 CNc1c(O)ccc2ccccc21 Amb18553328 [1,1,0,0,0,0|1,0,1]=4 1237 B14R2.203 CON1C(=O)C=Cc2ccccc12 Amb25064680 [1,1,0,0,0,0|0,0,0]=2 1238 B14R2.203 CON1C(=O)CCc2ccccc12 Amb25359795 [1,1,0,0,0,0|0,0,2]=4 1239 B14R2.203 COc1c(Br)ccc2ccccc21 Amb18559387 [1,1,0,0,0,0|2,0,0]=4 1240 B14R2.203 COc1c(I)ccc2ccccc21 Amb25237394 [1,1,0,0,0,0|2,0,0]=4 1241 B14R2.203 COc1c(N)ccc2ccccc21 Amb18127046 [1,1,0,0,0,0|2,0,0]=4 1242 B14R2.203 COc1c(O)ccc2ccccc21 Amb18127193 [1,1,0,0,0,0|1,0,1]=4 1243 B14R2.203 Cc1ccc2ccccc2c1CBr Amb24080215 [1,1,0,0,0,0|2,0,0]=4 1244 B14R2.203 Cc1ccc2ccccc2c1CN Amb18051856 [1,1,0,0,0,0|2,0,0]=4 1245 B14R2.203 Cc1ccc2ccccc2c1NC Amb18553377 [1,1,0,0,0,0|2,0,0]=4 1246 B14R2.203 Cc1ccc2ccccc2c1OC Amb25829445 [1,1,0,0,0,0|2,0,0]=4 1247 B14R2.203 ClCc1c(O)ccc2c1cccc2 Amb17477547 [1,1,0,0,0,0|1,0,1]=4 1248 B14R2.203 Fc1ccc2ccccc2c1CCl Amb24055306 [1,1,0,0,0,0|2,0,0]=4 1249 B14R2.203 NCc1c(Br)ccc2ccccc21 Amb25091804 [1,1,0,0,0,0|2,0,0]=4 1250 B14R2.203 NCc1c(F)ccc2ccccc21 Amb24054596 [1,1,0,0,0,0|2,0,0]=4 1251 B14R2.203 NCc1c(I)ccc2ccccc21 Amb25324000 [1,1,0,0,0,0|2,0,0]=4 1252 B14R2.203 NCc1c(O)ccc2c1cccc2 Amb1133018 [1,1,0,0,0,0|1,0,1]=4 1253 B14R2.203 NCc1c(O)ccc2c1cccc2 Amb1993926 [1,1,0,0,0,0|1,0,1]=4 1254 B14R2.203 O=C1COc2ccccc2N1CCl Amb25111209 [1,1,0,0,0,0|1,0,1]=4 1255 B14R2.203 OCc1c(Br)ccc2ccccc21 Amb25778121 [1,1,0,0,0,0|2,0,0]=4 1256 B14R2.203 OCc1c(Cl)ccc2ccccc21 Amb25808641 [1,1,0,0,0,0|2,0,0]=4 1257 B14R2.203 OCc1c(O)ccc2c1cccc2 Amb1111444 [1,1,0,0,0,0|1,0,1]=4 1258 B14R2.203 O\N=C/1\C(=O)C=Cc2ccccc21 Amb19748272 [1,1,0,0,0,0|2,0,0]=4 1259 B14R2.203 Oc1ccc2ccccc2c1CBr Amb25211050 [1,1,0,0,0,0|1,0,1]=4 1260 B14R2.4513 CN1C(=O)C=Cc2ccc(Br)cc12 Amb22495249 [1,1,0,0,0,0|0,0,0]=2 1261 B14R2.4513 CN1C(=O)C=Nc2ccc(Br)cc12 Amb19957640 [1,1,0,0,0,0|1,0,0]=3 1262 B14R2.4513 CN1C(=O)C=Nc2ccc(F)cc12 Amb25718883 [1,1,0,0,0,0|1,0,0]=3 1263 B14R2.4513 CN1C(=O)C=Nc2ccc(N)[n]c12 Amb25273973 [1,1,0,0,0,0|2,0,0]=4 1264 B14R2.4513 CN1C(=O)CCc2c1cc(N)cc2 Amb13881434 [1,1,0,0,0,0|0,0,2]=4 1265 B14R2.4513 CN1C(=O)CCc2ccc(F)cc12 Amb25045654 [1,1,0,0,0,0|0,0,2]=4 1266 B14R2.4513 CN1C(=O)COc2c1cc(Br)cc2 Amb17572941 [1,1,0,0,0,0|1,0,1]=4 1267 B14R2.4513 CN1C(=O)COc2c1cc(F)cc2 Amb17570331 [1,1,0,0,0,0|1,0,1]=4 1268 B14R2.4513 CN1C(=O)COc2c1cc(N)cc2 Amb1397750 [1,1,0,0,0,0|1,0,1]=4 1269 B14R2.4513 CN1C(=O)COc2c1cc(N)cc2 Amb2579340 [1,1,0,0,0,0|1,0,1]=4 1270 B14R2.4513 CN1C(=O)COc2c1cc(O)cc2 Amb17217523 [1,1,0,0,0,0|1,0,1]=4 1271 B14R2.4513 CN1C(=O)COc2ccc(I)cc12 Amb24489465 [1,1,0,0,0,0|1,0,1]=4 1272 B14R2.4513 CN1C(=O)COc2ccc(S)cc12 Amb25191629 [1,1,0,0,0,0|1,0,1]=4 1273 B14R2.4513 CN1C(=O)CSc2ccc(N)cc12 Amb24635874 [1,1,0,0,0,0|1,0,1]=4 1274 B14R2.4513 CN1C(=O)NCc2ccc(N)cc12 Amb24537376 [1,1,0,0,0,0|1,0,1]=4 1275 B14R2.4513 Cc1c2cc(O)ccc2ccc1O Amb24534174 [1,1,0,0,0,0|1,0,1]=4 1276 B14R2.4513 Cc1cc2c(cc1)C=CC(=O)C2=O Amb25318901 [1,1,0,0,0,0|2,0,0]=4 1277 B14R2.4513 Cc1cc2c(cc1)C=CC(=O)N2O Amb25793546 [1,1,0,0,0,0|1,0,0]=3 1278 B14R2.4513 Cc1cc2c(cc1)ccc(C)[n+]2C Amb22473931 [1,1,0,0,0,0|1,0,1]=4 1279 B14R2.4513 Cc1ccc2ccc(F)cc2c1C Amb24526863 [1,1,0,0,0,0|2,0,0]=4 1280 B14R2.4513 Nc1ncc2c(n1)n(C)c(=O)cc2 Amb16233881 [1,1,0,0,0,0|2,0,0]=4 1281 B14R2.4513 Oc1cc2C(=O)C(=O)C=Cc2cc1 Amb17594375 [1,1,0,0,0,0|2,0,0]=4 1282 B14R2.6175 CN1c2ccccc2C=CC1(C)N Amb25216937 [1,1,0,0,0,0|1,0,1]=4 1283 B14R2.8038 CN1C(=O)C=Cc2c(Cl)[n]ccc12 Amb23592151 [1,1,0,0,0,0|1,0,0]=3 1284 B14R2.8038 CN1C(=O)C=Cc2c(F)cccc12 Amb23448941 [1,1,0,0,0,0|0,0,0]=2 1285 B14R2.8038 CN1C(=O)C=Cc2c(N)[n]ccc12 Amb23592153 [1,1,0,0,0,0|1,0,0]=3 1286 B14R2.8038 CN1C(=O)C=Nc2c(Cl)cccc12 Amb25697085 [1,1,0,0,0,0|1,0,0]=3 1287 B14R2.8038 CN1C(=O)C=Nc2c(O)cccc12 Amb24614234 [1,1,0,0,0,0|1,0,0]=3 1288 B14R2.8038 CN1C(=O)CCc2c(Cl)cccc12 Amb23401463 [1,1,0,0,0,0|0,0,2]=4 1289 B14R2.8038 CN1C(=O)CCc2c(N)cccc12 Amb22755472 [1,1,0,0,0,0|0,0,2]=4 1290 B14R2.8038 CN1C(=O)CCc2c(O)cccc12 Amb25348587 [1,1,0,0,0,0|0,0,2]=4 1291 B14R2.8038 CN1C(=O)COc2c1cccc2Br Amb17572944 [1,1,0,0,0,0|1,0,1]=4 1292 B14R2.8038 CN1C(=O)COc2c1cccc2C Amb17570219 [1,1,0,0,0,0|1,0,1]=4 1293 B14R2.8038 CN1C(=O)COc2c1cccc2Cl Amb17570782 [1,1,0,0,0,0|1,0,1]=4 1294 B14R2.8038 CN1C(=O)COc2c1cccc2F Amb17570332 [1,1,0,0,0,0|1,0,1]=4 1295 B14R2.8038 CN1C(=O)COc2c1cccc2N Amb10068366 [1,1,0,0,0,0|1,0,1]=4 1296 B14R2.8038 CN1C(=O)NCc2c(N)cccc12 Amb24413927 [1,1,0,0,0,0|1,0,1]=4 1297 B14R2.8038 CN1C=2C=CNC(=O)C2C=CC1=O Amb23592126 [1,1,0,0,0,0|1,0,0]=3 1298 B14R2.8038 Cc1c(O)ccc2c(N)cccc21 Amb25100961 [1,1,0,0,0,0|1,0,1]=4 1299 B14R2.8038 Cc1ccc2c(c1C)cccc2C Amb16192708 [1,1,0,0,0,0|2,0,0]=4 1300 B14R2.8038 Cc1cccc2c1C=CC(=O)C2=O Amb25821464 [1,1,0,0,0,0|2,0,0]=4 1301 B14R2.8038 Cc1cccc2c1NCC(=O)N2C Amb25158334 [1,1,0,0,0,0|1,0,1]=4 1302 B14R2.8038 O=C1c2cccc(Br)c2C=CC1=O Amb25826727 [1,1,0,0,0,0|2,0,0]=4 1303 B14R2.8038 O=C1c2cccc(Cl)c2C=CC1=O Amb25039362 [1,1,0,0,0,0|2,0,0]=4 1304 B14R2.8038 O=C1c2cccc(F)c2C=CC1=O Amb25709227 [1,1,0,0,0,0|2,0,0]=4 1305 B14R2.8038 Oc1cccc2c1C=CC(=O)C2=O Amb18647791 [1,1,0,0,0,0|2,0,0]=4 1306 B14R2.8188 CC1=Cc2ccccc2N(C)C1=O Amb22904186 [1,1,0,0,0,0|0,0,0]=2 1307 B14R2.8188 CC1=Nc2cc[n]cc2N(C)C1=O Amb24097012 [1,1,0,0,0,0|2,0,0]=4 1308 B14R2.8188 CC1=Nc2ccccc2N(C)C1=O Amb19652902 [1,1,0,0,0,0|1,0,0]=3 1309 B14R2.8188 CN1C(=N)C(N)=Nc2ccccc12 Amb25337483 [1,1,0,0,0,0|2,0,0]=4 1310 B14R2.8188 CN1C(=O)C(Br)=Cc2ccccc12 Amb20246919 [1,1,0,0,0,0|0,0,0]=2 1311 B14R2.8188 CN1C(=O)C(C)Cc2ccccc12 Amb18061650 [1,1,0,0,0,0|0,0,2]=4 1312 B14R2.8188 CN1C(=O)C(Cl)=Nc2[n]cccc12 Amb23557989 [1,1,0,0,0,0|2,0,0]=4 1313 B14R2.8188 CN1C(=O)C(Cl)=Nc2ccc[n]c12 Amb21937163 [1,1,0,0,0,0|2,0,0]=4 1314 B14R2.8188 CN1C(=O)C(Cl)=Nc2ccccc12 Amb21926980 [1,1,0,0,0,0|1,0,0]=3 1315 B14R2.8188 CN1C(=O)C(F)=Cc2ccccc12 Amb22547226 [1,1,0,0,0,0|0,0,0]=2 1316 B14R2.8188 CN1C(=O)C(N)=Cc2ccc[n]c12 Amb23456040 [1,1,0,0,0,0|1,0,0]=3 1317 B14R2.8188 CN1C(=O)C(N)=Cc2ccccc12 Amb18065259 [1,1,0,0,0,0|0,0,0]=2 1318 B14R2.8188 CN1C(=O)C(N)Cc2ccccc12 Amb18559243 [1,1,0,0,0,0|0,0,2]=4 1319 B14R2.8188 CN1C(=O)C(N)Sc2ccccc12 Amb18636521 [1,1,0,0,0,0|1,0,1]=4 1320 B14R2.8188 CN1C(=O)C(O)=Cc2ccccc12 Amb22751143 [1,1,0,0,0,0|0,0,0]=2 1321 B14R2.8188 CN1C(=O)C(O)=Nc2[n]cccc12 Amb23557988 [1,1,0,0,0,0|2,0,0]=4 1322 B14R2.8188 CN1C(=O)C(O)Cc2ccccc12 Amb25788945 [1,1,0,0,0,0|0,0,2]=4 1323 B14R2.8188 CN1C(=O)[C@@H](N)Cc2ccccc12 Amb25691482 [1,1,0,0,0,0|0,0,2]=4 1324 B14R2.8188 CN1C(=O)[C@H](N)Cc2ccccc12 Amb25035451 [1,1,0,0,0,0|0,0,2]=4 1325 B14R2.8188 CN1c2[n]cccc2NC(=O)C1=O Amb21940098 [1,1,0,0,0,0|2,0,0]=4 1326 B14R2.8188 CN1c2ccccc2CC(=O)C1=O Amb24492727 [1,1,0,0,0,0|0,0,1]=3 1327 B14R2.8188 CN1c2ccccc2NC(=O)C1=O Amb19516760 [1,1,0,0,0,0|1,0,0]=3 1328 B14R2.8188 C[C@@H]1Nc2ccccc2N(C)C1=O Amb25111188 [1,1,0,0,0,0|1,0,1]=4 1329 B14R2.8188 C[n]1c(=O)c(Cl)cc2ccccc12 Amb24085901 [1,1,0,0,0,0|0,0,0]=2 1330 B14R2.8188 C[n]1c(=O)c(I)cc2ccccc12 Amb24102257 [1,1,0,0,0,0|0,0,0]=2 1331 B14R2.8188 Cc1c2ccccc2cc(N)c1N Amb24663153 [1,1,0,0,0,0|2,0,0]=4 1332 B14R2.8188 Cc1c2ccccc2cc(O)c1C Amb24309351 [1,1,0,0,0,0|2,0,0]=4 1333 B14R2.8188 Cc1nc2ccccc2n(c1=O)C Amb1677472 [1,1,0,0,0,0|1,0,0]=3 1334 B14R2.8188 NN1c2ccccc2NC(=O)C1=O Amb25828466 [1,1,0,0,0,0|2,0,0]=4 1335 B14R2.8188 O=C1C(=Cc2c(C1=O)cccc2)O Amb17594373 [1,1,0,0,0,0|2,0,0]=4 1336 B14R2.8188 O=C1C(C)Nc2c(N1C)cccc2 Amb17468988 [1,1,0,0,0,0|1,0,1]=4 1337 B14R2.8188 ON1c2ccccc2OC(=O)C1=O Amb20663543 [1,1,0,0,0,0|2,0,0]=4 1338 B14R2.8188 Oc1nc2ccccc2n(c1=O)C Amb10553642 [1,1,0,0,0,0|1,0,0]=3 1339 B14R2.28523 CN1C(=O)C=Cc2cccc(N)c12 Amb25689714 [1,1,0,0,0,0|0,0,0]=2 1340 B14R2.28523 CN1C(=O)C=Cc2cccc(O)c12 Amb22751142 [1,1,0,0,0,0|0,0,0]=2 1341 B14R2.28523 CN1C(=O)C=Nc2cccc(Br)c12 Amb25689656 [1,1,0,0,0,0|1,0,0]=3 1342 B14R2.28523 CN1C(=O)C=Nc2cccc(F)c12 Amb25689772 [1,1,0,0,0,0|1,0,0]=3 1343 B14R2.28523 CN1C(=O)CCc2cccc(Cl)c12 Amb25755285 [1,1,0,0,0,0|0,0,2]=4 1344 B14R2.28523 CN1C(=O)CCc2cccc(O)c12 Amb25318862 [1,1,0,0,0,0|0,0,2]=4 1345 B14R2.28523 CN1C(=O)COc2cccc(F)c12 Amb25191597 [1,1,0,0,0,0|1,0,1]=4 1346 B14R2.28523 CN1C(=O)COc2cccc(N)c12 Amb18559335 [1,1,0,0,0,0|1,0,1]=4 1347 B14R2.28523 CN1C(=O)NCc2cccc(N)c12 Amb25669397 [1,1,0,0,0,0|1,0,1]=4 1348 B14R2.28523 CN1C(=O)OCc2cccc(O)c12 Amb18128314 [1,1,0,0,0,0|1,0,1]=4 1349 B14R2.28523 C[n]1c(=O)ccc2cccc(Br)c12 Amb24092279 [1,1,0,0,0,0|0,0,0]=2 1350 B14R2.28523 C[n]1c(=O)ccc2cccc(Cl)c12 Amb24092281 [1,1,0,0,0,0|0,0,0]=2 1351 B14R2.28523 C[n]1c(=O)ccc2cccc(F)c12 Amb24092305 [1,1,0,0,0,0|0,0,0]=2 1352 B14R2.28523 Cc1cccc2C=CC(=O)N(C)c12 Amb22263192 [1,1,0,0,0,0|0,0,0]=2 1353 B14R2.28523 Cc1cccc2OCC(=O)N(C)c12 Amb25737758 [1,1,0,0,0,0|1,0,1]=4 1354 B14R2.28523 Oc1cccc2C=CC(=O)C(=O)c21 Amb25723819 [1,1,0,0,0,0|2,0,0]=4 1355 B14R2.29369 Brc1ccc2c(c1)C=CC(=O)C2=O Amb1783962 [1,1,0,0,0,0|2,0,0]=4 1356 B14R2.29369 Brc1ccc2c(c1)CCC(=O)N2C Amb17348339 [1,1,0,0,0,0|0,0,2]=4 1357 B14R2.29369 Brc1ccc2c(c1)OCC(=O)N2C Amb17572942 [1,1,0,0,0,0|1,0,1]=4 1358 B14R2.29369 CN1C(=O)C=Cc2cc(Br)ccc12 Amb22522657 [1,1,0,0,0,0|0,0,0]=2 1359 B14R2.29369 CN1C(=O)C=Cc2cc(N)ccc12 Amb23504087 [1,1,0,0,0,0|0,0,0]=2 1360 B14R2.29369 CN1C(=O)C=Cc2cc(O)ccc12 Amb18127365 [1,1,0,0,0,0|0,0,0]=2 1361 B14R2.29369 CN1C(=O)C=Nc2cc(F)ccc12 Amb24559947 [1,1,0,0,0,0|1,0,0]=3 1362 B14R2.29369 CN1C(=O)CCc2cc(Cl)ccc12 Amb24341256 [1,1,0,0,0,0|0,0,2]=4 1363 B14R2.29369 CN1C(=O)CCc2cc(O)ccc12 Amb18243684 [1,1,0,0,0,0|0,0,2]=4 1364 B14R2.29369 CN1C(=O)CNc2cc(Cl)ccc12 Amb22494793 [1,1,0,0,0,0|1,0,1]=4 1365 B14R2.29369 CN1C(=O)COc2cc(Cl)ccc12 Amb22586296 [1,1,0,0,0,0|1,0,1]=4 1366 B14R2.29369 CN1C(=O)CSc2cc(N)ccc12 Amb25088421 [1,1,0,0,0,0|1,0,1]=4 1367 B14R2.29369 CN1C(=O)NCc2cc(Br)ccc12 Amb25239676 [1,1,0,0,0,0|1,0,1]=4 1368 B14R2.29369 CN1C(=O)OCc2cc(N)ccc12 Amb25804687 [1,1,0,0,0,0|1,0,1]=4 1369 B14R2.29369 C[n]1c(=S)ccc2cc(Cl)ccc12 Amb24071930 [1,1,0,0,0,0|0,1,0]=3 1370 B14R2.29369 Cc1c(O)ccc2cc(Br)ccc21 Amb25696643 [1,1,0,0,0,0|1,0,1]=4 1371 B14R2.29369 Cc1c2ccc(O)cc2ccc1O Amb25231305 [1,1,0,0,0,0|1,0,1]=4 1372 B14R2.29369 Cc1cc2C=CC(=O)C(=O)c2cc1 Amb25727706 [1,1,0,0,0,0|2,0,0]=4 1373 B14R2.29369 Cc1cc2C=CC(=O)N(C)c2cc1 Amb21994767 [1,1,0,0,0,0|0,0,0]=2 1374 B14R2.29369 Cc1cc2ccc(C)[n+](C)c2cc1 Amb22473930 [1,1,0,0,0,0|1,0,1]=4 1375 B14R2.29369 Cc1ccc2c(COC(=O)N2C)c1 Amb25089316 [1,1,0,0,0,0|1,0,1]=4 1376 B14R2.29369 Cc1ccc2cc(F)ccc2[n+]1C Amb22473934 [1,1,0,0,0,0|1,0,1]=4 1377 B14R2.29369 Cc1ccc2cc(N)ccc2[n+]1C Amb24342610 [1,1,0,0,0,0|1,0,1]=4 1378 B14R2.29369 Cc1ccc2cc(N)ccc2c1C Amb25667906 [1,1,0,0,0,0|2,0,0]=4 1379 B14R2.29369 Fc1ccc2c(c1)SCC(=O)N2C Amb2444880 [1,1,0,0,0,0|1,0,1]=4 1380 B14R2.29369 O=C1C=Cc2cc(Cl)ccc2C1=O Amb25128014 [1,1,0,0,0,0|2,0,0]=4 1381 B14R2.29369 Oc1ccc2c(c1)C=CC(=O)C2=O Amb17594374 [1,1,0,0,0,0|2,0,0]=4 1382 B14R2.29369 Oc1ccc2c(c1)OCC(=O)N2C Amb17217740 [1,1,0,0,0,0|1,0,1]=4 1383 B14R2.1019 CCC1=CC(=O)c2ccccc2N1 Amb18790004 [1,1,0,0,0,0|1,0,1]=4 1384 B14R2.1019 CCc1cc(O)c2ccccc2[n]1 Amb22410671 [1,1,0,0,0,0|1,0,1]=4 1385 B14R2.1019 COc1cc(O)c2ccccc2[n]1 Amb18127378 [1,1,0,0,0,0|0,0,2]=4 1386 B14R2.1019 COc1cc2ccccc2c(O)c1 Amb18127199 [1,1,0,0,0,0|1,0,1]=4 1387 B14R2.1019 Cc1cc(C=O)[n]c2ccccc21 Amb18126771 [1,1,0,0,0,0|1,0,1]=4 1388 B14R2.1019 Cc1cc(C=O)cc2ccccc21 Amb18126680 [1,1,0,0,0,0|2,0,0]=4 1389 B14R2.1019 N#CC1=CC(=O)c2ccccc2N1 Amb18547572 [1,1,0,0,0,0|1,0,1]=4 1390 B14R2.1019 N#Cc1cc2ccccc2c(O)c1 Amb25065212 [1,1,0,0,0,0|2,0,0]=4 1391 B14R2.1019 NCC1=CC(=O)c2ccccc2N1 Amb18252218 [1,1,0,0,0,0|1,0,1]=4 1392 B14R2.1019 NNc1cc2ccccc2c(O)c1 Amb24733603 [1,1,0,0,0,0|2,0,0]=4 1393 B14R2.1019 Nc1cc(C=O)[n]c2ccccc21 Amb24748801 [1,1,0,0,0,0|1,0,1]=4 1394 B14R2.1019 O=C1C=C(C=O)Oc2ccccc12 Amb18127147 [1,1,0,0,0,0|1,0,1]=4 1395 B14R2.1019 O=C1C=C(C=O)Sc2ccccc12 Amb18129854 [1,1,0,0,0,0|1,0,1]=4 1396 B14R2.1019 O=C1C=C(CCl)Nc2ccccc21 Amb19516708 [1,1,0,0,0,0|1,0,1]=4 1397 B14R2.1019 O=Cc1cc(Br)c2ccccc2[n]1 Amb18662625 [1,1,0,0,0,0|1,0,1]=4 1398 B14R2.1019 O=Cc1cc2ccccc2c(Cl)c1 Amb25279349 [1,1,0,0,0,0|2,0,0]=4 1399 B14R2.1019 OC1=C\C(=N\O)\Oc2ccccc12 Amb24664784 [1,1,0,0,0,0|1,0,1]=4 1400 B14R2.1019 OCC1=CC(=O)c2ccccc2N1 Amb22372303 [1,1,0,0,0,0|0,0,2]=4 1401 B14R2.1019 Oc1cc(C=O)cc2ccc[n]c21 Amb18127017 [1,1,0,0,0,0|2,0,0]=4 1402 B14R2.1019 Oc1cc(CO)cc2ccccc12 Amb23570400 [1,1,0,0,0,0|1,0,1]=4 1403 B14R2.1146 C#CC1=CC(=O)Oc2ccccc12 Amb23598950 [1,1,0,0,0,0|2,0,0]=4 1404 B14R2.1146 CCC1=CC(=O)Nc2ccccc21 Amb23438871 [1,1,0,0,0,0|1,0,0]=3 1405 B14R2.1146 CCC1=NC(=O)Nc2ccccc21 Amb25270489 [1,1,0,0,0,0|2,0,0]=4 1406 B14R2.1146 CNC1=CC(=O)Oc2ccccc12 Amb21948594 [1,1,0,0,0,0|2,0,0]=4 1407 B14R2.1146 COC1=CC(=O)Nc2ccccc12 Amb21856838 [1,1,0,0,0,0|0,0,0]=2 1408 B14R2.1146 COC1=CC(=O)Oc2ccccc12 Amb18511495 [1,1,0,0,0,0|1,0,0]=3 1409 B14R2.1146 COc1cc(Br)[n]c2ccccc12 Amb22500805 [1,1,0,0,0,0|1,0,1]=4 1410 B14R2.1146 COc1cc(Br)cc2ccccc21 Amb24520830 [1,1,0,0,0,0|2,0,0]=4 1411 B14R2.1146 COc1cc(Cl)[n]c2ccccc12 Amb22500806 [1,1,0,0,0,0|1,0,1]=4 1412 B14R2.1146 COc1cc(N)[n]c2ccccc12 Amb18127230 [1,1,0,0,0,0|1,0,1]=4 1413 B14R2.1146 COc1cc(N)cc2c1cccc2 Amb10603793 [1,1,0,0,0,0|2,0,0]=4 1414 B14R2.1146 COc1cc([NH3+])cc2ccccc21 Amb22360701 [1,1,0,0,0,0|2,0,0]=4 1415 B14R2.1146 CSC1=CC(=O)Oc2ccccc12 Amb24611074 [1,1,0,0,0,0|1,1,0]=4 1416 B14R2.1146 N#CC1=CC(=O)Nc2ccccc12 Amb18126659 [1,1,0,0,0,0|1,0,0]=3 1417 B14R2.1146 NCC1=CC(=O)Nc2ccccc21 Amb18023966 [1,1,0,0,0,0|1,0,0]=3 1418 B14R2.1146 NCC1=CC(=O)Nc2ccccc21 Amb19361592 [1,1,0,0,0,0|1,0,0]=3 1419 B14R2.1146 NCC1=CC(=O)Oc2ccccc21 Amb18560585 [1,1,0,0,0,0|2,0,0]=4 1420 B14R2.1146 NNC1=CC(=O)Nc2ccccc12 Amb24119550 [1,1,0,0,0,0|1,0,0]=3 1421 B14R2.1146 NNC1=CC(=O)Oc2ccccc12 Amb19116123 [1,1,0,0,0,0|2,0,0]=4 1422 B14R2.1146 NNc1cc(=O)oc2c1cccc2 Amb2567982 [1,1,0,0,0,0|2,0,0]=4 1423 B14R2.1146 Nc1cc(CO)c2ccccc2[n]1 Amb20248865 [1,1,0,0,0,0|1,0,1]=4 1424 B14R2.1146 Nc1cc2ccccc2c(CO)c1 Amb25099616 [1,1,0,0,0,0|2,0,0]=4 1425 B14R2.1146 O=C1C=C(C=O)c2ccccc2N1 Amb24749077 [1,1,0,0,0,0|0,0,1]=3 1426 B14R2.1146 O=C1C=C(C=O)c2ccccc2O1 Amb18127145 [1,1,0,0,0,0|1,0,1]=4 1427 B14R2.1146 O=C1C=C(CBr)c2ccccc2N1 Amb18015278 [1,1,0,0,0,0|1,0,0]=3 1428 B14R2.1146 O=C1C=C(CBr)c2ccccc2O1 Amb24717057 [1,1,0,0,0,0|2,0,0]=4 1429 B14R2.1146 O=C1C=C(CCl)c2ccccc2O1 Amb24121470 [1,1,0,0,0,0|2,0,0]=4 1430 B14R2.1146 O=C1C=C(CF)c2ccccc2N1 Amb25334829 [1,1,0,0,0,0|1,0,0]=3 1431 B14R2.1146 O=C1C=C(CI)c2ccccc2N1 Amb25208645 [1,1,0,0,0,0|1,0,0]=3 1432 B14R2.1146 O=C1C=C(CS)c2ccccc2O1 Amb24519086 [1,1,0,0,0,0|1,1,0]=4 1433 B14R2.1146 O=C1C=C([Zn]Br)c2ccccc2O1 Amb22000516 [1,1,0,0,0,0|2,0,0]=4 1434 B14R2.1146 O=C1Cc2ccccc2C(=C1)C=O Amb24722849 [1,1,0,0,0,0|1,0,1]=4 1435 B14R2.1146 OCC1=CC(=O)Oc2ccccc21 Amb24353175 [1,1,0,0,0,0|1,0,0]=3 1436 B14R2.1146 OCC1CC(=O)Nc2c1cccc2 Amb17138809 [1,1,0,0,0,0|0,0,2]=4 1437 B14R2.1146 OCC1OC(=O)Nc2ccccc21 Amb25757992 [1,1,0,0,0,0|1,0,1]=4 1438 B14R2.1146 OCc1cc(Br)[n]c2ccccc21 Amb20248851 [1,1,0,0,0,0|1,0,1]=4 1439 B14R2.1146 OCc1cc(Br)cc2ccccc21 Amb24697542 [1,1,0,0,0,0|2,0,0]=4 1440 B14R2.1146 OCc1cc(Cl)[n]c2ccccc21 Amb23400037 [1,1,0,0,0,0|1,0,1]=4 1441 B14R2.1146 OCc1cc(Cl)cc2ccccc21 Amb25123973 [1,1,0,0,0,0|2,0,0]=4 1442 B14R2.1146 OCc1cc(F)[n]c2ccccc21 Amb25058524 [1,1,0,0,0,0|1,0,1]=4 1443 B14R2.1146 OCc1cc(I)cc2ccccc21 Amb25737695 [1,1,0,0,0,0|2,0,0]=4 1444 B14R2.1146 ONC1=CC(=O)Oc2ccccc12 Amb25377243 [1,1,0,0,0,0|1,0,0]=3 1445 B14R2.1146 O\N=C/1\CC(=O)Oc2ccccc21 Amb25208589 [1,1,0,0,0,0|1,0,1]=4 1446 B14R2.8045 CC1=CC(=O)Nc2c(Br)cccc21 Amb22522960 [1,1,0,0,0,0|1,0,0]=3 1447 B14R2.8045 CC1=CC(=O)Nc2c(Cl)cccc21 Amb21864632 [1,1,0,0,0,0|1,0,0]=3 1448 B14R2.8045 CC1=CC(=O)Nc2c(O)cccc21 Amb18127367 [1,1,0,0,0,0|1,0,0]=3 1449 B14R2.8045 CC1=CC(=O)Nc2c1cccc2C Amb19789098 [1,1,0,0,0,0|1,0,0]=3 1450 B14R2.8045 CC1=CC(=O)Oc2c(F)cccc21 Amb24496405 [1,1,0,0,0,0|2,0,0]=4 1451 B14R2.8045 CC1=CC(=O)Oc2c(I)cccc21 Amb25819804 [1,1,0,0,0,0|2,0,0]=4 1452 B14R2.8045 CC1=CC(=O)Oc2c(O)cccc21 Amb20250024 [1,1,0,0,0,0|2,0,0]=4 1453 B14R2.8045 CC1=CC(=O)c2cccc(C)c2N1 Amb18178053 [1,1,0,0,0,0|1,0,1]=4 1454 B14R2.8045 CC1=CC(=O)c2cccc(Cl)c2N1 Amb19079891 [1,1,0,0,0,0|1,0,1]=4 1455 B14R2.8045 CC1=CC(=O)c2cccc(F)c2N1 Amb18178344 [1,1,0,0,0,0|1,0,1]=4 1456 B14R2.8045 CC1=CC(=S)Nc2c(Br)cccc21 Amb18540325 [1,1,0,0,0,0|1,1,0]=4 1457 B14R2.8045 CC1=CC(=S)Nc2c(Cl)cccc21 Amb18540324 [1,1,0,0,0,0|1,1,0]=4 1458 B14R2.8045 CC1=CC(=S)Nc2c(F)cccc21 Amb18540326 [1,1,0,0,0,0|1,1,0]=4 1459 B14R2.8045 CC1=CC(=S)Nc2c1cccc2C Amb18372526 [1,1,0,0,0,0|1,1,0]=4 1460 B14R2.8045 CC1=CC=CN2C(O)=CC(=O)N=C21 Amb19897831 [1,1,0,0,0,0|1,0,1]=4 1461 B14R2.8045 CC1=NC(=O)Nc2c(F)cccc21 Amb25322392 [1,1,0,0,0,0|2,0,0]=4 1462 B14R2.8045 CC1=NC(=O)Nc2c(O)cccc21 Amb18127611 [1,1,0,0,0,0|2,0,0]=4 1463 B14R2.8045 Cc1cc(O)c2c(n1)c(Br)ccc2 Amb1778627 [1,1,0,0,0,0|1,0,1]=4 1464 B14R2.8045 Cc1cc(O)c2c(n1)c(C)ccc2 Amb1099190 [1,1,0,0,0,0|1,0,1]=4 1465 B14R2.8045 Cc1cc(O)c2c(n1)c(Cl)ccc2 Amb1199154 [1,1,0,0,0,0|1,0,1]=4 1466 B14R2.8045 Cc1cc(O)c2c(n1)c(F)ccc2 Amb1994266 [1,1,0,0,0,0|1,0,1]=4 1467 B14R2.8045 Cc1cc(O)c2c(n1)c(O)ccc2 Amb1283841 [1,1,0,0,0,0|1,0,1]=4 1468 B14R2.8045 Cc1cc(O)c2cccc(C)c2c1 Amb25282819 [1,1,0,0,0,0|2,0,0]=4 1469 B14R2.8045 Cc1cc(O)c2cccc(Cl)c2c1 Amb25319973 [1,1,0,0,0,0|2,0,0]=4 1470 B14R2.8045 Cc1cc(O)c2cccc(N)c2[n]1 Amb24558224 [1,1,0,0,0,0|1,0,1]=4 1471 B14R2.8045 Cc1cccc2C(Cl)=CC(=O)Nc21 Amb21951841 [1,1,0,0,0,0|1,0,0]=3 1472 B14R2.8045 Cc1cccc2C(N)=CC(=S)Nc21 Amb25691543 [1,1,0,0,0,0|1,1,0]=4 1473 B14R2.8045 Cc1cccc2C(O)=CC(=O)Nc21 Amb19517153 [1,1,0,0,0,0|0,0,0]=2 1474 B14R2.8045 Cc1cccc2C(O)=CC(=O)Oc21 Amb19667408 [1,1,0,0,0,0|1,0,0]=3 1475 B14R2.8045 Cc1cccc2c1NC(=O)NC2=O Amb20243383 [1,1,0,0,0,0|1,0,1]=4 1476 B14R2.8045 Cc1cccc2c1NC(=O)OC2=O Amb18061619 [1,1,0,0,0,0|1,0,1]=4 1477 B14R2.8045 O=C1CC(=O)c2cccc(Cl)c2N1 Amb24366738 [1,1,0,0,0,0|0,0,2]=4 1478 B14R2.8045 O=C1Nc2c(Br)cccc2C(=O)N1 Amb20243334 [1,1,0,0,0,0|1,0,1]=4 1479 B14R2.8045 O=C1Nc2c(Br)cccc2C(=O)O1 Amb19888498 [1,1,0,0,0,0|1,0,1]=4 1480 B14R2.8045 O=C1Nc2c(Cl)cccc2C(=O)N1 Amb20243332 [1,1,0,0,0,0|1,0,1]=4 1481 B14R2.8045 O=C1Nc2c(Cl)cccc2C(=O)O1 Amb19815980 [1,1,0,0,0,0|1,0,1]=4 1482 B14R2.8045 O=C1Nc2c(F)cccc2C(=O)N1 Amb19958576 [1,1,0,0,0,0|1,0,1]=4 1483 B14R2.8045 O=C1Nc2c(F)cccc2C(=O)O1 Amb19888390 [1,1,0,0,0,0|1,0,1]=4 1484 B14R2.8045 O=C1Nc2c(I)cccc2C(=O)N1 Amb19958580 [1,1,0,0,0,0|1,0,1]=4 1485 B14R2.8045 O=c1oc(=O)c2c([nH]1)c(C)ccc2 Amb2540358 [1,1,0,0,0,0|1,0,1]=4 1486 B14R2.8045 OC1=CC(=O)Nc2c(Br)cccc21 Amb23571494 [1,1,0,0,0,0|0,0,0]=2 1487 B14R2.8045 OC1=CC(=O)Nc2c(F)cccc21 Amb24662699 [1,1,0,0,0,0|0,0,0]=2 1488 B14R2.8045 OC1=CC(=O)Nc2c1cccc2O Amb18127814 [1,1,0,0,0,0|0,0,0]=2 1489 B14R2.8045 OC1=CC(=O)Oc2c(Cl)cccc21 Amb22476854 [1,1,0,0,0,0|1,0,0]=3 1490 B14R2.8045 OC1=CC(=O)Oc2c1cccc2O Amb18128038 [1,1,0,0,0,0|1,0,0]=3 1491 B14R2.8045 Oc1cc(O)c2cccc(Cl)c2[n]1 Amb23449371 [1,1,0,0,0,0|0,0,2]=4 1492 B14R2.8235 Brc1ccc2c(c1)c(O)cc(n2)C Amb1395387 [1,1,0,0,0,0|1,0,1]=4 1493 B14R2.8235 CC1=CC(=O)Nc2ccc(Br)cc21 Amb19517145 [1,1,0,0,0,0|1,0,0]=3 1494 B14R2.8235 CC1=CC(=O)Nc2ccc(Cl)cc21 Amb18372520 [1,1,0,0,0,0|1,0,0]=3 1495 B14R2.8235 CC1=CC(=O)Nc2ccc(F)cc21 Amb19655102 [1,1,0,0,0,0|1,0,0]=3 1496 B14R2.8235 CC1=CC(=O)Nc2ccc(I)cc21 Amb23448573 [1,1,0,0,0,0|1,0,0]=3 1497 B14R2.8235 CC1=CC(=O)Nc2ccc(N)cc21 Amb19655547 [1,1,0,0,0,0|1,0,0]=3 1498 B14R2.8235 CC1=CC(=O)Nc2ccc(O)cc21 Amb19988355 [1,1,0,0,0,0|1,0,0]=3 1499 B14R2.8235 CC1=CC(=O)Oc2ccc(N)cc21 Amb20247052 [1,1,0,0,0,0|2,0,0]=4 1500 B14R2.8235 CC1=CC(=O)Oc2ccc(O)cc21 Amb19666777 [1,1,0,0,0,0|2,0,0]=4 1501 B14R2.8235 CC1=CC(=O)c2cc(Br)ccc2N1 Amb18368792 [1,1,0,0,0,0|1,0,1]=4 1502 B14R2.8235 CC1=CC(=O)c2cc(Cl)ccc2N1 Amb18317783 [1,1,0,0,0,0|1,0,1]=4 1503 B14R2.8235 CC1=CC(=O)c2cc(F)ccc2N1 Amb18184133 [1,1,0,0,0,0|1,0,1]=4 1504 B14R2.8235 CC1=CC(=O)c2cc([NH3+])ccc2N1 Amb22565389 [1,1,0,0,0,0|1,0,1]=4 1505 B14R2.8235 CC1=CC(=S)Nc2ccc(Br)cc21 Amb18038016 [1,1,0,0,0,0|1,1,0]=4 1506 B14R2.8235 CC1=CC(=S)Nc2ccc(Cl)cc21 Amb18037995 [1,1,0,0,0,0|1,1,0]=4 1507 B14R2.8235 CC1=CC(=S)Nc2ccc(F)cc21 Amb18037987 [1,1,0,0,0,0|1,1,0]=4 1508 B14R2.8235 CC1=NC(=O)Nc2ccc(F)cc21 Amb25733055 [1,1,0,0,0,0|2,0,0]=4 1509 B14R2.8235 CC1=NC(=O)Nc2ccc(O)cc21 Amb20661027 [1,1,0,0,0,0|2,0,0]=4 1510 B14R2.8235 Cc1cc2C(=O)C=C(C)Nc2cc1 Amb18178052 [1,1,0,0,0,0|1,0,1]=4 1511 B14R2.8235 Cc1cc2C(=O)C=C(O)Nc2cc1 Amb22492451 [1,1,0,0,0,0|0,0,2]=4 1512 B14R2.8235 Cc1cc2C(Cl)=CC(=O)Nc2cc1 Amb20662027 [1,1,0,0,0,0|1,0,0]=3 1513 B14R2.8235 Cc1cc2C(Cl)=CC(=O)Oc2cc1 Amb18525204 [1,1,0,0,0,0|2,0,0]=4 1514 B14R2.8235 Cc1cc2C(N)=NC(=O)Nc2cc1 Amb25139575 [1,1,0,0,0,0|2,0,0]=4 1515 B14R2.8235 Cc1cc2C(O)=CC(=O)Nc2[n]c1 Amb24390749 [1,1,0,0,0,0|1,0,0]=3 1516 B14R2.8235 Cc1cc2C(O)=CC(=O)Nc2cc1 Amb21948621 [1,1,0,0,0,0|0,0,0]=2 1517 B14R2.8235 Cc1cc2C(O)=CC(=O)Oc2cc1 Amb17992884 [1,1,0,0,0,0|1,0,0]=3 1518 B14R2.8235 Cc1cc2c(O)cc(Cl)[n]c2cc1 Amb25117872 [1,1,0,0,0,0|1,0,1]=4 1519 B14R2.8235 Cc1cc2c(O)cc(N)[n]c2cc1 Amb18127238 [1,1,0,0,0,0|1,0,1]=4 1520 B14R2.8235 Cc1cc2c(cc1)NC(=O)C=C2C Amb19768113 [1,1,0,0,0,0|1,0,0]=3 1521 B14R2.8235 Cc1cc2c(cc1)NC(=O)C=[N+]2[O-] Amb24604603 [1,1,0,0,0,0|1,0,1]=4 1522 B14R2.8235 Cc1cc2c(cc1)NC(=O)CC2=O Amb22490755 [1,1,0,0,0,0|0,0,2]=4 1523 B14R2.8235 Cc1cc2c(cc1)NC(=O)NC2=O Amb19667593 [1,1,0,0,0,0|1,0,1]=4 1524 B14R2.8235 Cc1cc2c(cc1)NC(=O)OC2=O Amb19373930 [1,1,0,0,0,0|1,0,1]=4 1525 B14R2.8235 Cc1cc2c(cc1)NC(=S)C=C2C Amb18540320 [1,1,0,0,0,0|1,1,0]=4 1526 B14R2.8235 Cc1cc2c(cc1)OC(=O)C=C2C Amb19748166 [1,1,0,0,0,0|2,0,0]=4 1527 B14R2.8235 Cc1cc2ccc(C)cc2c(O)c1 Amb25322847 [1,1,0,0,0,0|2,0,0]=4 1528 B14R2.8235 Cc1ccc2c(c1)c(C)cc(=O)[nH]2 Amb2221660 [1,1,0,0,0,0|1,0,0]=3 1529 B14R2.8235 Cc1ccc2c(c1)c(O)cc(=O)o2 Amb1967460 [1,1,0,0,0,0|1,0,0]=3 1530 B14R2.8235 Cc1ccc2c(c1)c(O)cc(n2)C Amb1094118 [1,1,0,0,0,0|1,0,1]=4 1531 B14R2.8235 Clc1ccc2c(c1)c(O)cc(n2)C Amb1269355 [1,1,0,0,0,0|1,0,1]=4 1532 B14R2.8235 Fc1ccc2c(c1)c(O)cc(n2)C Amb1395674 [1,1,0,0,0,0|1,0,1]=4 1533 B14R2.8235 NC1=CC(=O)c2cc(Br)ccc2N1 Amb18663121 [1,1,0,0,0,0|1,0,1]=4 1534 B14R2.8235 NC1=NC(=O)Nc2ccc(Br)cc21 Amb22263284 [1,1,0,0,0,0|2,0,0]=4 1535 B14R2.8235 Nc1cc(=O)oc2ccc(Cl)cc21 Amb24065804 [1,1,0,0,0,0|2,0,0]=4 1536 B14R2.8235 Nc1cc(O)c2cc(Cl)ccc2[n]1 Amb18130145 [1,1,0,0,0,0|1,0,1]=4 1537 B14R2.8235 Nc1cc(O)c2cc(F)ccc2[n]1 Amb24417709 [1,1,0,0,0,0|1,0,1]=4 1538 B14R2.8235 Nc1cc(O)c2cc(O)ccc2[n]1 Amb25759686 [1,1,0,0,0,0|1,0,1]=4 1539 B14R2.8235 Nc1cc2B(O)NC(=O)Nc2cc1 Amb24083589 [1,1,0,0,0,0|2,0,0]=4 1540 B14R2.8235 Nc1cc2C(O)=CC(=O)Nc2cc1 Amb22372296 [1,1,0,0,0,0|0,0,0]=2 1541 B14R2.8235 Nc1cc2c(cc1)NC(=O)NC2=O Amb18943709 [1,1,0,0,0,0|1,0,1]=4 1542 B14R2.8235 Nc1cc2c(cc1)NC(=O)OC2=O Amb18538506 [1,1,0,0,0,0|1,0,1]=4 1543 B14R2.8235 O=C1C=C(F)c2cc(F)ccc2O1 Amb24084285 [1,1,0,0,0,0|2,0,0]=4 1544 B14R2.8235 O=C1Nc2ccc(Br)cc2C(=O)N1 Amb19894628 [1,1,0,0,0,0|1,0,1]=4 1545 B14R2.8235 O=C1Nc2ccc(Cl)cc2C(=O)N1 Amb19894625 [1,1,0,0,0,0|1,0,1]=4 1546 B14R2.8235 O=C1Nc2ccc(F)cc2C(=O)N1 Amb20241387 [1,1,0,0,0,0|1,0,1]=4 1547 B14R2.8235 O=C1Nc2ccc(I)cc2C(=O)N1 Amb20243320 [1,1,0,0,0,0|1,0,1]=4 1548 B14R2.8235 O=C1Nc2ccc(S)cc2C(=O)N1 Amb25153676 [1,1,0,0,0,0|1,0,1]=4 1549 B14R2.8235 O=C1OC(=O)Nc2ccc(Br)cc12 Amb18026188 [1,1,0,0,0,0|1,0,1]=4 1550 B14R2.8235 O=C1OC(=O)Nc2ccc(Cl)cc12 Amb19748226 [1,1,0,0,0,0|1,0,1]=4 1551 B14R2.8235 O=C1OC(=O)Nc2ccc(F)cc12 Amb19761701 [1,1,0,0,0,0|1,0,1]=4 1552 B14R2.8235 O=C1OC(=O)Nc2ccc(I)cc12 Amb19650646 [1,1,0,0,0,0|1,0,1]=4 1553 B14R2.8235 OC1=CC(=O)Nc2ccc(Br)cc21 Amb19958762 [1,1,0,0,0,0|0,0,0]=2 1554 B14R2.8235 OC1=CC(=O)Nc2ccc(Cl)cc21 Amb22489948 [1,1,0,0,0,0|0,0,0]=2 1555 B14R2.8235 OC1=CC(=O)Nc2ccc(I)cc21 Amb24427559 [1,1,0,0,0,0|0,0,0]=2 1556 B14R2.8235 OC1=CC(=O)Oc2ccc(Br)cc21 Amb19665431 [1,1,0,0,0,0|1,0,0]=3 1557 B14R2.8235 OC1=CC(=O)Oc2ccc(Cl)cc21 Amb19665435 [1,1,0,0,0,0|1,0,0]=3 1558 B14R2.8235 OC1=CC(=O)Oc2ccc(F)cc21 Amb19895520 [1,1,0,0,0,0|1,0,0]=3 1559 B14R2.8235 OC1=CC(=S)Nc2ccc(Cl)cc21 Amb24490058 [1,1,0,0,0,0|0,1,0]=3 1560 B14R2.8235 OC1=CC(=S)Oc2ccc(Br)cc21 Amb25192022 [1,1,0,0,0,0|1,1,0]=4 1561 B14R2.8235 OC1CC(=O)Nc2ccc(Cl)cc21 Amb25309671 [1,1,0,0,0,0|0,0,2]=4 1562 B14R2.8235 Oc1cc(O)[n]c2ccc(Br)cc12 Amb22057661 [1,1,0,0,0,0|0,0,2]=4 1563 B14R2.8235 Oc1cc(O)[n]c2ccc(F)cc12 Amb22496118 [1,1,0,0,0,0|0,0,2]=4 1564 B14R2.8235 Oc1cc2c(cc1)NC(=O)NC2=O Amb24489150 [1,1,0,0,0,0|1,0,1]=4 1565 B14R2.8235 Oc1cc2c(cc1)NC(=O)OC2=O Amb19330379 [1,1,0,0,0,0|1,0,1]=4 1566 B14R2.8235 Oc1cc2c(cc1)OC(=O)C=C2O Amb18648094 [1,1,0,0,0,0|1,0,0]=3 1567 B14R2.8235 Oc1ccc2c(c1)c(C)cc(=O)o2 Amb1041165 [1,1,0,0,0,0|2,0,0]=4 1568 B14R2.8235 Oc1ccc2c(c1)c(O)cc(n2)C Amb17602608 [1,1,0,0,0,0|1,0,1]=4 1569 B14R2.28480 CC1=CC(=O)Nc2cccc(O)c21 Amb22752591 [1,1,0,0,0,0|1,0,0]=3 1570 B14R2.28480 CC1=CC(=O)Oc2cccc(O)c21 Amb25707483 [1,1,0,0,0,0|2,0,0]=4 1571 B14R2.28480 Cc1cc(O)c2c(I)cccc2[n]1 Amb24496170 [1,1,0,0,0,0|1,0,1]=4 1572 B14R2.28480 Cc1cc(O)c2c(cccc2O)[n]1 Amb24492624 [1,1,0,0,0,0|1,0,1]=4 1573 B14R2.28480 Cc1cc2cccc(O)c2c(O)c1 Amb25370600 [1,1,0,0,0,0|2,0,0]=4 1574 B14R2.28480 Cc1cccc2NC(=O)N=C(N)c21 Amb24558311 [1,1,0,0,0,0|2,0,0]=4 1575 B14R2.28480 Cc1cccc2NC(=O)NC(=O)c21 Amb22170370 [1,1,0,0,0,0|1,0,1]=4 1576 B14R2.28480 Cc1cccc2NC(=O)OC(=O)c21 Amb22059420 [1,1,0,0,0,0|1,0,1]=4 1577 B14R2.28480 Cc1cccc2[n]c(O)cc(O)c21 Amb23401106 [1,1,0,0,0,0|0,0,2]=4 1578 B14R2.28480 Nc1cc(O)c2c(Cl)cccc2[n]1 Amb25689856 [1,1,0,0,0,0|1,0,1]=4 1579 B14R2.28480 Nc1cccc2NC(=O)OC(=O)c21 Amb25702514 [1,1,0,0,0,0|1,0,1]=4 1580 B14R2.28480 O=C1Nc2cccc(Br)c2C(=O)N1 Amb19958571 [1,1,0,0,0,0|1,0,1]=4 1581 B14R2.28480 O=C1Nc2cccc(Cl)c2C(=O)N1 Amb20240939 [1,1,0,0,0,0|1,0,1]=4 1582 B14R2.28480 O=C1Nc2cccc(F)c2C(=O)N1 Amb20243331 [1,1,0,0,0,0|1,0,1]=4 1583 B14R2.28480 O=C1Nc2cccc(I)c2C(=O)N1 Amb20240947 [1,1,0,0,0,0|1,0,1]=4 1584 B14R2.28480 O=C1OC(=O)Nc2cccc(Br)c12 Amb19984918 [1,1,0,0,0,0|1,0,1]=4 1585 B14R2.28480 O=C1OC(=O)Nc2cccc(Cl)c12 Amb20247072 [1,1,0,0,0,0|1,0,1]=4 1586 B14R2.28480 O=C1OC(=O)Nc2cccc(F)c12 Amb21926885 [1,1,0,0,0,0|1,0,1]=4 1587 B14R2.28480 OC1=CC(=O)Nc2cccc(F)c21 Amb25738208 [1,1,0,0,0,0|0,0,0]=2 1588 B14R2.28480 OC1=CC(=O)Oc2cccc(Cl)c21 Amb22481193 [1,1,0,0,0,0|1,0,0]=3 1589 B14R2.28480 OC1=CC(=O)Oc2cccc(F)c21 Amb25761169 [1,1,0,0,0,0|1,0,0]=3 1590 B14R2.28480 OC1=CC(=O)Oc2cccc(O)c12 Amb18128041 [1,1,0,0,0,0|1,0,0]=3 1591 B14R2.28480 Oc1cc(Cl)cc2cccc(F)c21 Amb25706917 [1,1,0,0,0,0|2,0,0]=4 1592 B14R2.28480 Oc1cc2cccc(O)c2c(O)c1 Amb18127562 [1,1,0,0,0,0|1,0,1]=4 1593 B14R2.29365 CC1=CC(=O)Nc2[n]c(C)ccc12 Amb22753692 [1,1,0,0,0,0|2,0,0]=4 1594 B14R2.29365 CC1=CC(=O)Nc2[n]c(N)ccc21 Amb18127420 [1,1,0,0,0,0|2,0,0]=4 1595 B14R2.29365 CC1=CC(=O)Nc2cc(Br)ccc21 Amb22039453 [1,1,0,0,0,0|1,0,0]=3 1596 B14R2.29365 CC1=CC(=O)Nc2cc(Cl)ccc21 Amb22000082 [1,1,0,0,0,0|1,0,0]=3 1597 B14R2.29365 CC1=CC(=O)Nc2cc(F)c[n]c21 Amb25046111 [1,1,0,0,0,0|2,0,0]=4 1598 B14R2.29365 CC1=CC(=O)Nc2cc(N)ccc21 Amb19131103 [1,1,0,0,0,0|1,0,0]=3 1599 B14R2.29365 CC1=CC(=O)Nc2cc(O)ccc21 Amb19816738 [1,1,0,0,0,0|1,0,0]=3 1600 B14R2.29365 CC1=CC(=O)Oc2cc(Br)ccc21 Amb18007256 [1,1,0,0,0,0|2,0,0]=4 1601 B14R2.29365 CC1=CC(=O)Oc2cc(Cl)ccc21 Amb25036049 [1,1,0,0,0,0|2,0,0]=4 1602 B14R2.29365 CC1=CC(=O)Oc2cc(F)ccc21 Amb24077233 [1,1,0,0,0,0|2,0,0]=4 1603 B14R2.29365 CC1=CC(=O)Oc2cc(N)ccc21 Amb18197479 [1,1,0,0,0,0|2,0,0]=4 1604 B14R2.29365 CC1=CC(=O)Oc2cc(O)ccc21 Amb18012848 [1,1,0,0,0,0|2,0,0]=4 1605 B14R2.29365 CC1=CC(=O)Oc2cc(O)ccc21 Amb22348141 [1,1,0,0,0,0|2,0,0]=4 1606 B14R2.29365 CC1=CC(=O)Oc2cc(S)ccc21 Amb20662809 [1,1,0,0,0,0|2,0,0]=4 1607 B14R2.29365 CC1=CC(=O)Oc2cc([O-])ccc21 Amb22265072 [1,1,0,0,0,0|2,0,0]=4 1608 B14R2.29365 CC1=CC(=O)c2ccc(Br)cc2N1 Amb22343119 [1,1,0,0,0,0|1,0,1]=4 1609 B14R2.29365 CC1=CC(=O)c2ccc(Cl)cc2N1 Amb20415295 [1,1,0,0,0,0|1,0,1]=4 1610 B14R2.29365 CC1=CC(=S)Nc2cc(Br)ccc21 Amb18012458 [1,1,0,0,0,0|1,1,0]=4 1611 B14R2.29365 CC1=CC(=S)c2ccc(Cl)cc2N1 Amb25799513 [1,1,0,0,0,0|1,1,0]=4 1612 B14R2.29365 Cc1cc2NC(=O)C=C(C)c2cc1 Amb19514337 [1,1,0,0,0,0|1,0,0]=3 1613 B14R2.29365 Cc1cc2NC(=O)C=C(O)c2cc1 Amb22752587 [1,1,0,0,0,0|0,0,0]=2 1614 B14R2.29365 Cc1cc2NC(=O)NC(=O)c2cc1 Amb20243382 [1,1,0,0,0,0|1,0,1]=4 1615 B14R2.29365 Cc1cc2NC(=O)OC(=O)c2cc1 Amb20247291 [1,1,0,0,0,0|1,0,1]=4 1616 B14R2.29365 Cc1cc2NC(C)=CC(=O)c2cc1 Amb20258515 [1,1,0,0,0,0|1,0,1]=4 1617 B14R2.29365 Cc1cc2NC(C)=CC(=O)c2cc1 Amb22343121 [1,1,0,0,0,0|1,0,1]=4 1618 B14R2.29365 Cc1cc2OC(=O)C=C(C)c2cc1 Amb20670275 [1,1,0,0,0,0|2,0,0]=4 1619 B14R2.29365 Cc1cc2OC(=O)C=C(O)c2cc1 Amb19894643 [1,1,0,0,0,0|1,0,0]=3 1620 B14R2.29365 Cc1cc2cc(Cl)ccc2c(O)c1 Amb25201647 [1,1,0,0,0,0|2,0,0]=4 1621 B14R2.29365 Cc1ccc2C(O)=CC(=O)Nc2[n]1 Amb20660417 [1,1,0,0,0,0|1,0,0]=3 1622 B14R2.29365 Cc1ccc2c(c1)nc(cc2O)O Amb2227286 [1,1,0,0,0,0|0,0,2]=4 1623 B14R2.29365 Cc1ccc2c(c1)oc(=O)cc2C Amb1968030 [1,1,0,0,0,0|2,0,0]=4 1624 B14R2.29365 Clc1ccc2c(c1)nc(cc2O)C Amb1994304 [1,1,0,0,0,0|1,0,1]=4 1625 B14R2.29365 Clc1ccc2c(c1)nc(cc2O)O Amb1787317 [1,1,0,0,0,0|0,0,2]=4 1626 B14R2.29365 Fc1ccc2c(c1)nc(cc2O)C Amb1994812 [1,1,0,0,0,0|1,0,1]=4 1627 B14R2.29365 NC1=CC(=O)Oc2cc(O)ccc21 Amb19887231 [1,1,0,0,0,0|2,0,0]=4 1628 B14R2.29365 Nc1cc(O)c2ccc(O)cc2[n]1 Amb24557756 [1,1,0,0,0,0|1,0,1]=4 1629 B14R2.29365 Nc1cc2NC(=O)NC(=O)c2cc1 Amb19958566 [1,1,0,0,0,0|1,0,1]=4 1630 B14R2.29365 Nc1cc2NC(=O)OC(=O)c2cc1 Amb18538507 [1,1,0,0,0,0|1,0,1]=4 1631 B14R2.29365 Nc1ccc2c(n1)[nH]c(=O)cc2C Amb1007483 [1,1,0,0,0,0|2,0,0]=4 1632 B14R2.29365 O=C1C=C(Cl)c2ccc(Cl)cc2N1 Amb24682099 [1,1,0,0,0,0|1,0,0]=3 1633 B14R2.29365 O=C1C=C(Cl)c2ccc(Cl)cc2O1 Amb21997875 [1,1,0,0,0,0|2,0,0]=4 1634 B14R2.29365 O=C1C=C(Cl)c2ccc(F)cc2N1 Amb25315323 [1,1,0,0,0,0|1,0,0]=3 1635 B14R2.29365 O=C1CC(=O)Nc2cc(Br)ccc12 Amb22495040 [1,1,0,0,0,0|0,0,2]=4 1636 B14R2.29365 O=C1Nc2cc(Br)ccc2C(=O)N1 Amb20243333 [1,1,0,0,0,0|1,0,1]=4 1637 B14R2.29365 O=C1Nc2cc(Cl)ccc2C(=O)N1 Amb19667592 [1,1,0,0,0,0|1,0,1]=4 1638 B14R2.29365 O=C1Nc2cc(F)ccc2C(=O)N1 Amb19958559 [1,1,0,0,0,0|1,0,1]=4 1639 B14R2.29365 O=C1Nc2cc(I)ccc2C(=O)N1 Amb20243321 [1,1,0,0,0,0|1,0,1]=4 1640 B14R2.29365 O=C1OC(=O)Nc2cc(Br)ccc12 Amb20241650 [1,1,0,0,0,0|1,0,1]=4 1641 B14R2.29365 O=C1OC(=O)Nc2cc(Cl)ccc12 Amb19372879 [1,1,0,0,0,0|1,0,1]=4 1642 B14R2.29365 O=C1OC(=O)Nc2cc(F)ccc12 Amb19372866 [1,1,0,0,0,0|1,0,1]=4 1643 B14R2.29365 O=C1OC(=O)Nc2cc(I)ccc12 Amb22263944 [1,1,0,0,0,0|1,0,1]=4 1644 B14R2.29365 OC1=CC(=O)Nc2cc(Cl)c[n]c21 Amb25721847 [1,1,0,0,0,0|1,0,0]=3 1645 B14R2.29365 OC1=CC(=O)Oc2cc(Br)ccc21 Amb24452712 [1,1,0,0,0,0|1,0,0]=3 1646 B14R2.29365 OC1=CC(=O)Oc2cc(Cl)ccc21 Amb22472325 [1,1,0,0,0,0|1,0,0]=3 1647 B14R2.29365 OC1=CC(=O)Oc2cc(F)ccc21 Amb24084296 [1,1,0,0,0,0|1,0,0]=3 1648 B14R2.29365 OC1=CC(=S)Nc2cc(Cl)ccc21 Amb25034135 [1,1,0,0,0,0|0,1,0]=3 1649 B14R2.29365 Oc1cc2OC(=O)C=C(O)c2cc1 Amb18648095 [1,1,0,0,0,0|1,0,0]=3 1650 B14R2.29365 Oc1ccc2c(c1)[nH]c(=O)nc2C Amb16203436 [1,1,0,0,0,0|2,0,0]=4 1651 B14R2.29365 Oc1ccc2c(c1)cc(cc2O)O Amb17594463 [1,1,0,0,0,0|1,0,1]=4 1652 B14R2.29365 Oc1ccc2c(c1)oc(=O)cc2C Amb1153057 [1,1,0,0,0,0|2,0,0]=4 1653 B14R2.1131 Brc1ccc(CBr)c2ccccc12 Amb19868316 [1,1,0,0,0,0|2,0,0]=4 1654 B14R2.1131 C=CN1C=CC(=O)c2ccccc12 Amb25783442 [1,1,0,0,0,0|0,0,2]=4 1655 B14R2.1131 CCN1C=NC(=O)c2ccccc12 Amb22752701 [1,1,0,0,0,0|1,0,1]=4 1656 B14R2.1131 CCN1N=CC(=O)c2ccccc12 Amb24625808 [1,1,0,0,0,0|1,0,1]=4 1657 B14R2.1131 CCc1ccc(Br)c2ccccc21 Amb25735789 [1,1,0,0,0,0|2,0,0]=4 1658 B14R2.1131 CCc1ccc(F)c2ccccc21 Amb25330873 [1,1,0,0,0,0|2,0,0]=4 1659 B14R2.1131 CCc1ccc(I)c2ccccc21 Amb25070676 [1,1,0,0,0,0|2,0,0]=4 1660 B14R2.1131 CCc1ccc(N)c2ccccc21 Amb23556445 [1,1,0,0,0,0|2,0,0]=4 1661 B14R2.1131 CCc1ccc(O)c2[n]cccc21 Amb18127054 [1,1,0,0,0,0|2,0,0]=4 1662 B14R2.1131 CCn1ccc(=O)c2c1cccc2 Amb10976752 [1,1,0,0,0,0|0,0,1]=3 1663 B14R2.1131 CN1C=CC(C#N)c2ccccc12 Amb18126697 [1,1,0,0,0,0|1,0,1]=4 1664 B14R2.1131 CNc1cc[n+](O)c2ccccc21 Amb25315229 [1,1,0,0,0,0|2,0,0]=4 1665 B14R2.1131 CNc1ccc(Br)c2ccccc21 Amb18275340 [1,1,0,0,0,0|2,0,0]=4 1666 B14R2.1131 CNc1ccc(Cl)c2ccccc21 Amb18055521 [1,1,0,0,0,0|2,0,0]=4 1667 B14R2.1131 CNc1ccc(O)c2[n]cccc12 Amb18554408 [1,1,0,0,0,0|2,0,0]=4 1668 B14R2.1131 CNc1ccc(O)c2ccccc21 Amb18553406 [1,1,0,0,0,0|1,0,0]=3 1669 B14R2.1131 CON1C=CC(=O)c2ccccc12 Amb24582564 [1,1,0,0,0,0|0,0,1]=3 1670 B14R2.1131 COc1ccc(Cl)c2ccccc21 Amb23402063 [1,1,0,0,0,0|2,0,0]=4 1671 B14R2.1131 COc1ccc(N)c2ccccc21 Amb19959322 [1,1,0,0,0,0|2,0,0]=4 1672 B14R2.1131 COc1ccc(O)c2[n]cccc12 Amb22491509 [1,1,0,0,0,0|2,0,0]=4 1673 B14R2.1131 COc1ccc(O)c2c[n]ccc21 Amb24411026 [1,1,0,0,0,0|2,0,0]=4 1674 B14R2.1131 COc1ccc(O)c2cc[n]cc12 Amb24355264 [1,1,0,0,0,0|2,0,0]=4 1675 B14R2.1131 COc1ccc(c2c1nccc2)O Amb17202568 [1,1,0,0,0,0|2,0,0]=4 1676 B14R2.1131 CSc1ccc(O)c2[n]cccc12 Amb18129908 [1,1,0,0,0,0|2,0,0]=4 1677 B14R2.1131 CSc1ccc(O)c2ccccc21 Amb18129863 [1,1,0,0,0,0|1,0,0]=3 1678 B14R2.1131 C\C=C/1\C=CC(=O)c2ccccc21 Amb25807553 [1,1,0,0,0,0|1,0,1]=4 1679 B14R2.1131 Cc1[n]cc(OC)c2ccccc12 Amb24070434 [1,1,0,0,0,0|2,0,0]=4 1680 B14R2.1131 Cc1c[n]c(CO)c2ccccc21 Amb19104953 [1,1,0,0,0,0|2,0,0]=4 1681 B14R2.1131 Cc1ccc(CBr)c2ccccc21 Amb23556464 [1,1,0,0,0,0|2,0,0]=4 1682 B14R2.1131 Cc1ccc(CC)c2ccccc12 Amb24658690 [1,1,0,0,0,0|2,0,0]=4 1683 B14R2.1131 Cc1ccc(CN)c2ccccc21 Amb18553390 [1,1,0,0,0,0|2,0,0]=4 1684 B14R2.1131 Cc1ccc(CO)c2[n]cccc21 Amb22498534 [1,1,0,0,0,0|2,0,0]=4 1685 B14R2.1131 Cc1ccc(CO)c2c[n]ccc21 Amb18353007 [1,1,0,0,0,0|2,0,0]=4 1686 B14R2.1131 Cc1ccc(CO)c2cc[n]cc21 Amb19104925 [1,1,0,0,0,0|2,0,0]=4 1687 B14R2.1131 Cc1ccc(NC)c2ccccc12 Amb18553385 [1,1,0,0,0,0|2,0,0]=4 1688 B14R2.1131 Cc1ccc(NN)c2ccccc21 Amb23580565 [1,1,0,0,0,0|2,0,0]=4 1689 B14R2.1131 Cc1ccc(OC)c2c[n]ccc12 Amb25250049 [1,1,0,0,0,0|2,0,0]=4 1690 B14R2.1131 Cc1ccc(OC)c2ccc[n]c12 Amb23412262 [1,1,0,0,0,0|2,0,0]=4 1691 B14R2.1131 Cc1ccc([Mg]Br)c2ccccc21 Amb22000530 [1,1,0,0,0,0|2,0,0]=4 1692 B14R2.1131 Cc1ccc([Zn]Br)c2ccccc21 Amb22897839 [1,1,0,0,0,0|2,0,0]=4 1693 B14R2.1131 ClCc1ccc(I)c2ccccc21 Amb25130259 [1,1,0,0,0,0|2,0,0]=4 1694 B14R2.1131 ClCc1ccc(c2c1cccc2)F Amb2099566 [1,1,0,0,0,0|2,0,0]=4 1695 B14R2.1131 ClCc1ccc(c2c1cccn2)O Amb1105007 [1,1,0,0,0,0|2,0,0]=4 1696 B14R2.1131 ClCc1ccc(c2c1cccn2)O Amb1154133 [1,1,0,0,0,0|2,0,0]=4 1697 B14R2.1131 Clc1ccc(CCl)c2ccccc12 Amb25075550 [1,1,0,0,0,0|2,0,0]=4 1698 B14R2.1131 Fc1ccc(CBr)c2ccccc21 Amb23537909 [1,1,0,0,0,0|2,0,0]=4 1699 B14R2.1131 N#Cc1ccc(O)c2ccccc21 Amb18553403 [1,1,0,0,0,0|1,0,1]=4 1700 B14R2.1131 N=Cc1ccc(O)c2ccccc21 Amb25252162 [1,1,0,0,0,0|1,0,1]=4 1701 B14R2.1131 NCc1ccc(Br)c2ccccc21 Amb23537354 [1,1,0,0,0,0|2,0,0]=4 1702 B14R2.1131 NCc1ccc(Cl)c2ccccc21 Amb18055451 [1,1,0,0,0,0|2,0,0]=4 1703 B14R2.1131 NCc1ccc(F)c2ccccc21 Amb22584199 [1,1,0,0,0,0|2,0,0]=4 1704 B14R2.1131 NCc1ccc(I)c2ccccc21 Amb24427761 [1,1,0,0,0,0|2,0,0]=4 1705 B14R2.1131 NCc1ccc(O)c2[n]cccc21 Amb23440939 [1,1,0,0,0,0|2,0,0]=4 1706 B14R2.1131 NCc1ccc(O)c2[n]cccc21 Amb24121233 [1,1,0,0,0,0|2,0,0]=4 1707 B14R2.1131 NCc1ccc(O)c2ccccc21 Amb18053776 [1,1,0,0,0,0|1,0,0]=3 1708 B14R2.1131 NCc1ccc(c2c1cccc2)Br Amb10975996 [1,1,0,0,0,0|2,0,0]=4 1709 B14R2.1131 NNc1ccc(O)c2ccccc21 Amb24377995 [1,1,0,0,0,0|2,0,0]=4 1710 B14R2.1131 NOc1ccc(Cl)c2ccccc21 Amb25133185 [1,1,0,0,0,0|2,0,0]=4 1711 B14R2.1131 Nc1ccc(CBr)c2ccccc21 Amb24468889 [1,1,0,0,0,0|2,0,0]=4 1712 B14R2.1131 Nc1ccc(CN)c2ccccc12 Amb25789521 [1,1,0,0,0,0|2,0,0]=4 1713 B14R2.1131 O=Nc1ccc(c2c1cccc2)O Amb17594340 [1,1,0,0,0,0|2,0,0]=4 1714 B14R2.1131 OCc1ccc(Br)c2ccccc21 Amb22227908 [1,1,0,0,0,0|2,0,0]=4 1715 B14R2.1131 OCc1ccc(Cl)c2ccccc21 Amb22481368 [1,1,0,0,0,0|2,0,0]=4 1716 B14R2.1131 OCc1ccc(F)c2ccccc21 Amb25778382 [1,1,0,0,0,0|2,0,0]=4 1717 B14R2.1131 OCc1ccc(c2c1cccn2)C Amb16186926 [1,1,0,0,0,0|2,0,0]=4 1718 B14R2.1131 O\N=C/1\C=CC(=O)c2ccccc12 Amb25358873 [1,1,0,0,0,0|2,0,0]=4 1719 B14R2.1131 Oc1ccc(CBr)c2ccc[n]c21 Amb24388572 [1,1,0,0,0,0|2,0,0]=4 1720 B14R2.1131 Oc1ccc(CCl)c2ccccc21 Amb24391780 [1,1,0,0,0,0|1,0,0]=3 1721 B14R2.1131 Oc1ccc(CO)c2ccccc12 Amb24763770 [1,1,0,0,0,0|1,0,0]=3 1722 B14R2.1131 Oc1ccc(CS)c2ccc[n]c21 Amb23559264 [1,1,0,0,0,0|2,0,0]=4 1723 B14R2.1131 Oc1ccc(NO)c2ccccc12 Amb25850925 [1,1,0,0,0,0|2,0,0]=4 1724 B14R2.1131 [O-][n+]1ccc(NO)c2ccccc12 Amb22731754 [1,1,0,0,0,0|1,0,1]=4 1725 B14R2.8051 CN1C=CC(=O)c2cccc(N)c12 Amb23569352 [1,1,0,0,0,0|0,0,1]=3 1726 B14R2.8051 Cc1cc[n]c2c(O)ccc(C)c12 Amb25767036 [1,1,0,0,0,0|2,0,0]=4 1727 B14R2.8051 Cc1ccc(C)c2cccc(O)c12 Amb25370717 [1,1,0,0,0,0|2,0,0]=4 1728 B14R2.8051 Cc1ccc(F)c2cccc(O)c21 Amb25059687 [1,1,0,0,0,0|2,0,0]=4 1729 B14R2.8051 Cc1ccc(N)c2c1cccc2N Amb18126938 [1,1,0,0,0,0|2,0,0]=4 1730 B14R2.8051 Cc1ccc(N)c2cccc(C)c12 Amb22751125 [1,1,0,0,0,0|2,0,0]=4 1731 B14R2.8051 Cc1ccc(O)c2C(=O)C=CNc21 Amb22752598 [1,1,0,0,0,0|2,0,0]=4 1732 B14R2.8051 Cc1ccc(O)c2cccc(C)c12 Amb25286686 [1,1,0,0,0,0|1,0,0]=3 1733 B14R2.8051 Cc1ccc(O)c2cccc(F)c21 Amb24344016 [1,1,0,0,0,0|1,0,0]=3 1734 B14R2.8051 Cc1ccc(O)c2cccc(O)c21 Amb25128219 [1,1,0,0,0,0|1,0,0]=3 1735 B14R2.8051 Cc1cccc2c1c(O)c[n]c2C Amb25801929 [1,1,0,0,0,0|2,0,0]=4 1736 B14R2.8051 Cc1cccc2c1c(O)ccc2O Amb18127192 [1,1,0,0,0,0|2,0,0]=4 1737 B14R2.8051 Cc1cccc2c1n(C)ccc2=O Amb10976721 [1,1,0,0,0,0|0,0,1]=3 1738 B14R2.8051 Cn1ccc(=O)c2c1c(Cl)ccc2 Amb10976724 [1,1,0,0,0,0|0,0,1]=3 1739 B14R2.8051 Cn1ccc(=O)c2c1c(F)ccc2 Amb10976726 [1,1,0,0,0,0|0,0,1]=3 1740 B14R2.8051 Nc1ccc(c2c1cccc2O)O Amb17594434 [1,1,0,0,0,0|2,0,0]=4 1741 B14R2.8051 Nc1cccc2c1c(O)ccc2N Amb17594391 [1,1,0,0,0,0|2,0,0]=4 1742 B14R2.8051 Nc1cccc2c1c(O)ccc2O Amb17594430 [1,1,0,0,0,0|2,0,0]=4 1743 B14R2.8051 OC=1C=CC(=O)C2=CC=CC(=O)C21 Amb24492474 [1,1,0,0,0,0|2,0,0]=4 1744 B14R2.8051 Oc1ccc(O)c2cccc(Cl)c12 Amb18130136 [1,1,0,0,0,0|2,0,0]=4 1745 B14R2.8051 Oc1ccc(c2c1cccc2N)N Amb17594390 [1,1,0,0,0,0|2,0,0]=4 1746 B14R2.8051 Oc1ccc(c2c1cccc2O)O Amb17594464 [1,1,0,0,0,0|2,0,0]=4 1747 B14R2.8751 CN1C=CC(=O)c2cc(Br)ccc12 Amb21972216 [1,1,0,0,0,0|0,0,1]=3 1748 B14R2.8751 CN1C=CC(=O)c2ccc(F)cc12 Amb22750766 [1,1,0,0,0,0|0,0,1]=3 1749 B14R2.8751 CN1C=NC(=O)c2cc(N)ccc12 Amb25157011 [1,1,0,0,0,0|1,0,1]=4 1750 B14R2.8751 CN1N=CC(=O)c2ccc(F)cc12 Amb24658041 [1,1,0,0,0,0|1,0,1]=4 1751 B14R2.8751 Cc1cc2C(=O)C=CN(C)c2cc1 Amb20414845 [1,1,0,0,0,0|0,0,1]=3 1752 B14R2.8751 Cc1cc2C(=O)N=CN(C)c2cc1 Amb22753724 [1,1,0,0,0,0|1,0,1]=4 1753 B14R2.8751 Cc1cc2c(cc1)C(=O)C=CN2C Amb24451928 [1,1,0,0,0,0|0,0,1]=3 1754 B14R2.8751 Cc1cc2c(cc1)c(O)ccc2C Amb25320097 [1,1,0,0,0,0|1,0,0]=3 1755 B14R2.8751 Cc1cc2c(cc1)c(O)ccc2O Amb18127194 [1,1,0,0,0,0|2,0,0]=4 1756 B14R2.8751 Cc1ccc(O)c2C=CC(=O)Nc21 Amb22752600 [1,1,0,0,0,0|2,0,0]=4 1757 B14R2.8751 Cc1ccc(O)c2ccc(C)[n]c12 Amb23401099 [1,1,0,0,0,0|2,0,0]=4 1758 B14R2.8751 Cc1ccc2C(=O)C=CN(C)c2[n]1 Amb25717700 [1,1,0,0,0,0|1,0,1]=4 1759 B14R2.8751 Cc1ccc2c(n1)c(O)ccc2C Amb11032488 [1,1,0,0,0,0|2,0,0]=4 1760 B14R2.8751 Clc1ccc2c(c1)c(=O)ccn2C Amb10976725 [1,1,0,0,0,0|0,0,1]=3 1761 B14R2.8751 Fc1ccc2c(c1)c(=O)ccn2C Amb10976727 [1,1,0,0,0,0|0,0,1]=3 1762 B14R2.8751 O=c1ccc2c(c1)n(C)ccc2C Amb16203127 [1,1,0,0,0,0|1,0,0]=3 1763 B14R2.8751 Oc1ccc(Cl)c2cc(Cl)ccc21 Amb22473430 [1,1,0,0,0,0|2,0,0]=4 1764 B14R2.8751 Oc1ccc(Cl)c2ccc(Cl)cc21 Amb22473429 [1,1,0,0,0,0|2,0,0]=4 1765 B14R2.8751 Oc1ccc2c(c1)[n+](C)ccc2C Amb16202456 [1,1,0,0,0,0|1,0,1]=4 1766 B14R2.8751 Oc1ccc2c(c1)c(N)ccc2O Amb17594433 [1,1,0,0,0,0|2,0,0]=4 1767 B14R2.8751 Oc1ccc2c(c1)c(O)ccc2O Amb17594465 [1,1,0,0,0,0|2,0,0]=4 1768 B14R2.29285 CC1(O)C=CC(=O)c2ccccc12 Amb24388645 [1,1,0,0,0,0|1,0,1]=4 1769 B14R2.29285 O=C1C=CC(c2c1cccc2)(C)C Amb17594321 [1,1,0,0,0,0|1,0,1]=4 1770 B14R2.215 CC=1c2ccccc2C(C)C1C=O Amb24490320 [0,1,0,0,1,0|2,0,0]=4 1771 B14R2.215 CN1\C(=C/O)\C(=O)c2ccccc12 Amb25100883 [0,1,0,0,1,0|0,0,2]=4 1772 B14R2.215 CN1\C(=C\O)\C(=O)c2ccccc12 Amb24078913 [0,1,0,0,1,0|0,0,2]=4 1773 B14R2.215 C[n]1c(C=O)c(Br)c2[n]cccc12 Amb18157397 [0,1,0,0,1,0|2,0,0]=4 1774 B14R2.215 C[n]1c(C=O)c(Br)c2c[n]ccc12 Amb18157400 [0,1,0,0,1,0|2,0,0]=4 1775 B14R2.215 C[n]1c(C=O)c(Br)c2ccc[n]c12 Amb18157394 [0,1,0,0,1,0|2,0,0]=4 1776 B14R2.215 C[n]1c(C=O)c(Cl)c2c[n]ccc12 Amb18189638 [0,1,0,0,1,0|2,0,0]=4 1777 B14R2.215 C[n]1c(C=O)c(Cl)c2ccc[n]c12 Amb18189637 [0,1,0,0,1,0|2,0,0]=4 1778 B14R2.215 C[n]1c(C=O)c(N)c2ccccc12 Amb18197693 [0,1,0,0,1,0|1,0,0]=3 1779 B14R2.215 C[n]1c(CO)c(Br)c2ccccc12 Amb25377122 [0,1,0,0,1,0|1,0,1]=4 1780 B14R2.215 Cc1c(C#N)n(C)c2ccccc12 Amb17778653 [0,1,0,0,1,0|2,0,0]=4 1781 B14R2.215 Cc1c([Hg]Cl)n(C)c2ccccc12 Amb17940489 [0,1,0,0,1,0|2,0,0]=4 1782 B14R2.215 Cc1c2ccc[n]c2[n](C)c1C=O Amb24394484 [0,1,0,0,1,0|2,0,0]=4 1783 B14R2.215 Cc1c2ccccc2[n](C)c1C#C Amb25046470 [0,1,0,0,1,0|2,0,0]=4 1784 B14R2.215 Cc1c2ccccc2[n](C)c1CC Amb25317769 [0,1,0,0,1,0|2,0,0]=4 1785 B14R2.215 Cc1c2ccccc2[n](C)c1CO Amb25787369 [0,1,0,0,1,0|1,0,1]=4 1786 B14R2.215 O=Cc1c(C)c2c(n1C)cccc2 Amb1980939 [0,1,0,0,1,0|1,0,0]=3 1787 B14R2.215 OC1=C(C=O)C(=O)c2ccccc21 Amb24444887 [0,1,0,0,1,0|2,0,0]=4 1788 B14R2.8716 Brc1ccc2c(c1)C(N)C(=O)N2C Amb17597806 [0,1,0,0,1,0|1,0,1]=4 1789 B14R2.8716 Brc1ccc2c(c1)c(C)c(n2C)C Amb17506904 [0,1,0,0,1,0|2,0,0]=4 1790 B14R2.8716 CC1C(=O)N(C)c2cc(O)ccc21 Amb24467103 [0,1,0,0,1,0|1,0,1]=4 1791 B14R2.8716 CC1C(=O)N(C)c2ccc(O)cc21 Amb18127876 [0,1,0,0,1,0|1,0,1]=4 1792 B14R2.8716 CN1C(=O)C(N)c2cc(Cl)ccc12 Amb21896796 [0,1,0,0,1,0|1,0,1]=4 1793 B14R2.8716 CN1C(=O)C(O)c2cc(F)ccc12 Amb24466186 [0,1,0,0,1,0|0,0,1]=3 1794 B14R2.8716 CN1C(=O)N(C)c2cc(Br)ccc12 Amb18034502 [0,1,0,0,1,0|2,0,0]=4 1795 B14R2.8716 CN1C(=O)N(C)c2cc(Cl)ccc12 Amb19654293 [0,1,0,0,1,0|2,0,0]=4 1796 B14R2.8716 CN1C(=O)N(C)c2cc(I)ccc12 Amb25246050 [0,1,0,0,1,0|2,0,0]=4 1797 B14R2.8716 CN1C(=O)N(C)c2cc(N)ccc12 Amb18046747 [0,1,0,0,1,0|2,0,0]=4 1798 B14R2.8716 CN1C(=O)N(C)c2cc(N)ccc12 Amb20228588 [0,1,0,0,1,0|2,0,0]=4 1799 B14R2.8716 CN1C(=O)N(C)c2cc(O)ccc12 Amb18046749 [0,1,0,0,1,0|2,0,0]=4 1800 B14R2.8716 CN1C(=O)N(C)c2cc(S)ccc12 Amb18330478 [0,1,0,0,1,0|2,0,0]=4 1801 B14R2.8716 CN1c2[n]cc(Br)cc2C(=O)C1=O Amb21963064 [0,1,0,0,1,0|1,0,1]=4 1802 B14R2.8716 CN1c2[n]cc(Cl)cc2C(=O)C1=O Amb24090850 [0,1,0,0,1,0|1,0,1]=4 1803 B14R2.8716 CN1c2cc(Cl)ccc2C(=O)C1=O Amb19043526 [0,1,0,0,1,0|0,0,1]=3 1804 B14R2.8716 CN1c2ccc(I)cc2C(=O)C1=O Amb23401103 [0,1,0,0,1,0|0,0,1]=3 1805 B14R2.8716 CN1c2ccc(N)cc2C(=O)C1=O Amb23401104 [0,1,0,0,1,0|0,0,1]=3 1806 B14R2.8716 Cc1c(Br)c2cc(Cl)ccc2[n]1C Amb18563294 [0,1,0,0,1,0|2,0,0]=4 1807 B14R2.8716 Cc1c(Br)c2cc(F)ccc2[n]1C Amb18563293 [0,1,0,0,1,0|2,0,0]=4 1808 B14R2.8716 Cc1c(Br)c2ccc(Cl)cc2[n]1C Amb18563297 [0,1,0,0,1,0|2,0,0]=4 1809 B14R2.8716 Cc1c(Br)c2ccc(F)cc2[n]1C Amb18065249 [0,1,0,0,1,0|2,0,0]=4 1810 B14R2.8716 Cc1cc2c(Br)c(C)[n](C)c2cc1 Amb18563289 [0,1,0,0,1,0|2,0,0]=4 1811 B14R2.8716 Cc1ccc2C(N)C(=O)N(C)c2c1 Amb18243659 [0,1,0,0,1,0|1,0,1]=4 1812 B14R2.8716 Cc1ccc2c(c1)C(N)C(=O)N2C Amb19373635 [0,1,0,0,1,0|1,0,1]=4 1813 B14R2.8716 Cc1ccc2c(c1)C(N)C(=O)N2C Amb19373662 [0,1,0,0,1,0|1,0,1]=4 1814 B14R2.8716 Cc1ccc2c(c1)N(C)C(=O)C2=O Amb18243609 [0,1,0,0,1,0|0,0,1]=3 1815 B14R2.8716 Cc1ccc2c(c1)N(C)C(=O)N2C Amb19654181 [0,1,0,0,1,0|2,0,0]=4 1816 B14R2.8716 Clc1ccc2c(c1)C(=O)C(=O)N2C Amb1917073 [0,1,0,0,1,0|0,0,1]=3 1817 B14R2.8716 Fc1ccc2c(c1)C(=O)C(=O)N2C Amb1080954 [0,1,0,0,1,0|0,0,1]=3 1818 B14R2.8716 Nc1ccc2c(c1)C(C)C(=O)N2C Amb17101115 [0,1,0,0,1,0|1,0,1]=4 1819 B14R2.8716 O=C1C(=O)c2cc(Cl)ccc2N1Cl Amb25857619 [0,1,0,0,1,0|1,0,1]=4 1820 B14R2.19306 C#CN1c2ccccc2C(=O)C1=O Amb25034463 [0,1,0,0,1,0|0,0,2]=4 1821 B14R2.19306 CC=C1C(=O)N(C)c2[n]cccc21 Amb24082513 [0,1,0,0,1,0|2,0,0]=4 1822 B14R2.19306 CCC1c2ccccc2N(C1=O)C Amb15693467 [0,1,0,0,1,0|1,0,1]=4 1823 B14R2.19306 CCN1C(=O)C(O)c2ccccc12 Amb24496957 [0,1,0,0,1,0|0,0,1]=3 1824 B14R2.19306 CCN1c2[n]cccc2C(=O)C1=O Amb24090842 [0,1,0,0,1,0|1,0,1]=4 1825 B14R2.19306 CCN1c2ccccc2C(C1=O)N Amb13949076 [0,1,0,0,1,0|1,0,1]=4 1826 B14R2.19306 CCc1c(Cl)[n](C)c2ccccc21 Amb24573075 [0,1,0,0,1,0|2,0,0]=4 1827 B14R2.19306 CN1C(=O)C(CO)c2ccccc12 Amb24495886 [0,1,0,0,1,0|0,0,1]=3 1828 B14R2.19306 CN1c2ccccc2C(C=O)C1=O Amb18127394 [0,1,0,0,1,0|0,0,2]=4 1829 B14R2.19306 CN1c2ccccc2N(CC)C1=O Amb25755418 [0,1,0,0,1,0|2,0,0]=4 1830 B14R2.19306 COC1C(=O)N(C)c2ccccc21 Amb25072825 [0,1,0,0,1,0|0,0,1]=3 1831 B14R2.19306 CON1C(=O)C(C)c2ccccc12 Amb25786968 [0,1,0,0,1,0|1,0,1]=4 1832 B14R2.19306 CON1c2ccccc2C(=O)C1=O Amb25735238 [0,1,0,0,1,0|0,0,1]=3 1833 B14R2.19306 CO[n]1c2ccccc2c(C)c1C Amb25097046 [0,1,0,0,1,0|2,0,0]=4 1834 B14R2.19306 C[n]1c(Br)c(C=O)c2ccccc12 Amb22484290 [0,1,0,0,1,0|1,0,1]=4 1835 B14R2.19306 C[n]1c(Br)c(CN)c2ccccc12 Amb24615822 [0,1,0,0,1,0|2,0,0]=4 1836 B14R2.19306 C[n]1c(Cl)c(CO)c2ccccc12 Amb18556556 [0,1,0,0,1,0|1,0,0]=3 1837 B14R2.19306 C[n]1c(I)c(C#N)c2ccccc12 Amb21963326 [0,1,0,0,1,0|2,0,0]=4 1838 B14R2.19306 C[n]1c(N)c(C#N)c2ccccc12 Amb25349215 [0,1,0,0,1,0|2,0,0]=4 1839 B14R2.19306 C[n]1c(N)c(C=O)c2ccccc12 Amb18197774 [0,1,0,0,1,0|1,0,1]=4 1840 B14R2.19306 Cc1c(CCl)c2ccccc2[n]1C Amb18863877 [0,1,0,0,1,0|2,0,0]=4 1841 B14R2.19306 Cc1c(CO)c2ccccc2[n]1C Amb18224487 [0,1,0,0,1,0|1,0,0]=3 1842 B14R2.19306 Cc1c(NC)c2ccccc2[n]1C Amb18564021 [0,1,0,0,1,0|2,0,0]=4 1843 B14R2.19306 Cc1c2ccccc2[n](CC)c1Cl Amb23569032 [0,1,0,0,1,0|2,0,0]=4 1844 B14R2.19306 ClCN1C(=O)C(=O)c2c1cccc2 Amb17595162 [0,1,0,0,1,0|0,0,1]=3 1845 B14R2.19306 N#Cc1c(C)n(c2c1cccc2)C Amb1001991 [0,1,0,0,1,0|2,0,0]=4 1846 B14R2.19306 N#Cc1c(Cl)n(c2c1cccc2)C Amb2419097 [0,1,0,0,1,0|2,0,0]=4 1847 B14R2.19306 NCN1c2ccccc2C(=O)C1=O Amb24552944 [0,1,0,0,1,0|0,0,1]=3 1848 B14R2.19306 O=CN1c2ccccc2C(=O)C1=O Amb24492687 [0,1,0,0,1,0|0,0,2]=4 1849 B14R2.19306 O=Cc1c(C)n(c2c1cccc2)C Amb1008884 [0,1,0,0,1,0|1,0,1]=4 1850 B14R2.19306 O=Cc1c(Cl)n(c2c1cccc2)C Amb1157532 [0,1,0,0,1,0|1,0,1]=4 1851 B14R2.19306 O\C=C/1\c2ccccc2N(C1=O)C Amb10809902 [0,1,0,0,1,0|0,0,0]=2 1852 B14R2.19306 O\N=C\1/c2ccccc2N(C1=O)C Amb1007113 [0,1,0,0,1,0|0,0,0]=2 1853 B14R2.28485 CN1C(=O)C(N)c2cccc(F)c12 Amb18893644 [0,1,0,0,1,0|1,0,1]=4 1854 B14R2.28485 CN1c2c(Br)cccc2C(=O)C1=O Amb22886726 [0,1,0,0,1,0|0,0,1]=3 1855 B14R2.28485 CN1c2c(F)cccc2C(=O)C1=O Amb18243747 [0,1,0,0,1,0|0,0,1]=3 1856 B14R2.28485 CN1c2c(I)cccc2C(=O)C1=O Amb24554744 [0,1,0,0,1,0|0,0,1]=3 1857 B14R2.28485 CN1c2c(O)cccc2C(=O)C1=O Amb25075296 [0,1,0,0,1,0|0,0,1]=3 1858 B14R2.28485 CN1c2cccc(Cl)c2C(=O)C1=O Amb19043527 [0,1,0,0,1,0|0,0,1]=3 1859 B14R2.28485 CN1c2cccc(O)c2C(=O)C1=O Amb24492683 [0,1,0,0,1,0|0,0,1]=3 1860 B14R2.28485 Cc1c(Br)c2cccc(Cl)c2[n]1C Amb18563304 [0,1,0,0,1,0|2,0,0]=4 1861 B14R2.28485 Cc1c(Br)c2cccc(F)c2[n]1C Amb18563303 [0,1,0,0,1,0|2,0,0]=4 1862 B14R2.28485 Cc1c(C)c2c(O)cccc2[n]1C Amb18127479 [0,1,0,0,1,0|2,0,0]=4 1863 B14R2.28485 Cc1c(C)c2cccc(O)c2[n]1C Amb25831648 [0,1,0,0,1,0|2,0,0]=4 1864 B14R2.28485 Cc1cccc2C(N)C(=O)N(C)c12 Amb21959837 [0,1,0,0,1,0|1,0,1]=4 1865 B14R2.28485 Cc1cccc2c(Br)c(C)[n](C)c12 Amb18563300 [0,1,0,0,1,0|2,0,0]=4 1866 B14R2.28485 Cc1n(C)c2c(c1C)cccc2C Amb1907117 [0,1,0,0,1,0|2,0,0]=4 1867 B14R2.28485 O=C1C(N)c2c(N1C)c(C)ccc2 Amb16187113 [0,1,0,0,1,0|1,0,1]=4 1868 B14R2.28485 O=C1N(C)c2c(C1=O)cccc2C Amb1085871 [0,1,0,0,1,0|0,0,1]=3 1869 B14R2.28485 O=C1N(C)c2c(C1=O)cccc2Cl Amb1102739 [0,1,0,0,1,0|0,0,1]=3 1870 B14R2.57380 CC1(N)C(=O)N(O)c2ccccc12 Amb25123281 [0,1,0,0,1,0|2,0,0]=4 1871 B14R2.57380 CN1C(=O)C(C)(C)c2ccccc12 Amb18669470 [0,1,0,0,1,0|1,0,1]=4 1872 B14R2.57380 CN1C(=O)C(C)(N)c2ccccc12 Amb25050702 [0,1,0,0,1,0|1,0,1]=4 1873 B14R2.57380 CN1c2ccccc2C(C1=O)(Cl)Cl Amb10976624 [0,1,0,0,1,0|1,0,1]=4 1874 B14R2.2296 Cc1c(C=O)cc(O)c2cc[s]c21 Amb25326863 [0,1,0,0,1,0|2,0,0]=4 1875 B14R2.11806 CN1C(=O)C=C(CN)c2[s]ccc12 Amb18189877 [0,1,0,0,1,0|2,0,0]=4 1876 B14R2.11806 CN1C(=O)C=C(CN)c2occc12 Amb18195556 [0,1,0,0,1,0|2,0,0]=4 1877 B16R2.133588 CC1=NCC(=O)N(C)c2ccc(Br)cc12 Amb22406299 [0,1,0,0,0,1|1,0,1]=4 1878 B16R2.133588 CN1c2ccc(Cl)cc2C(=O)NCC1=O Amb22450550 [0,1,0,0,0,1|0,0,2]=4 1879 B16R2.64030 CC=1CC(=O)N(CC)c2ccccc2N1 Amb19671795 [0,1,0,0,0,1|1,0,1]=4 1880 B16R2.128840 CC=1CC(=O)N(C)c2cc(Cl)ccc2N1 Amb24110642 [0,1,0,0,0,1|1,0,1]=4 1881 B16R2.128840 Cc1ccc2N=C(C)CC(=O)N(C)c2c1 Amb24110657 [0,1,0,0,0,1|1,0,1]=4 1882 B16R2.9566 CC=1C(=O)N(CC)c2ccccc2C1O Amb19667374 [0,2,0,0,0,0|0,0,0]=2 1883 B16R2.9566 CC=1C(=O)N(OC)c2ccccc2[N+]1[O-] Amb19521094 [0,2,0,0,0,0|1,0,1]=4 1884 B16R2.9566 CCN1C(=O)C(Br)=C(O)c2ccccc12 Amb19550818 [0,2,0,0,0,0|0,0,0]=2 1885 B16R2.9566 CCN1C(=O)C(S)=C(O)c2ccccc12 Amb23533829 [0,2,0,0,0,0|0,0,0]=2 1886 B16R2.9566 CON1c2ccccc2N(O)C(=O)C1=O Amb19817122 [0,2,0,0,0,0|1,0,0]=3 1887 B16R2.9913 CC1=CC(=O)N(CC)c2ccc(N)cc12 Amb23569094 [0,2,0,0,0,0|1,0,0]=3 1888 B16R2.9913 CC1=CC(=O)c2cc(Br)ccc2N1CC Amb19816079 [0,2,0,0,0,0|1,0,1]=4 1889 B16R2.9913 CC1=CC(=O)c2cc(N)ccc2N1CC Amb22410676 [0,2,0,0,0,0|1,0,1]=4 1890 B16R2.9913 CCN1c2ccc(Br)cc2C(=O)OC1=O Amb18533335 [0,2,0,0,0,0|1,0,1]=4 1891 B16R2.9913 CCN1c2ccc(N)cc2C(=O)NC1=O Amb18669587 [0,2,0,0,0,0|1,0,1]=4 1892 B16R2.9913 CCN1c2ccc(N)cc2C(=O)OC1=O Amb18538597 [0,2,0,0,0,0|1,0,1]=4 1893 B16R2.9913 CCn1c(C)cc(=O)c2c1ccc(c2)C Amb10976743 [0,2,0,0,0,0|1,0,1]=4 1894 B16R2.9913 CCn1c(C)cc(=O)c2c1ccc(c2)Cl Amb10976747 [0,2,0,0,0,0|1,0,1]=4 1895 B16R2.9913 CCn1c(C)cc(=O)c2c1ccc(c2)F Amb10976749 [0,2,0,0,0,0|1,0,1]=4 1896 B16R2.9913 Cc1cc2C(O)=CC(=O)N(CC)c2cc1 Amb19650707 [0,2,0,0,0,0|0,0,0]=2 1897 B16R2.23332 CC(C)N1c2ccccc2C(=O)OC1=O Amb21936298 [0,2,0,0,0,0|1,0,1]=4 1898 B16R2.23332 CC1=CC(=O)N(C(C)C)c2ccccc12 Amb21927207 [0,2,0,0,0,0|1,0,0]=3 1899 B16R2.44545 C=CCN1c2ccccc2C(=O)OC1=O Amb19665066 [0,2,0,0,0,0|1,0,1]=4 1900 B16R2.44545 CC1=CC(=O)N(CC#C)c2ccccc21 Amb21927208 [0,2,0,0,0,0|1,0,0]=3 1901 B16R2.44545 CC1=CC(=O)N(CC#N)c2ccccc21 Amb21998080 [0,2,0,0,0,0|1,0,0]=3 1902 B16R2.44545 CC1=CC(=O)N(CC=C)c2ccccc21 Amb21927206 [0,2,0,0,0,0|1,0,0]=3 1903 B16R2.44545 CC1=CC(=O)c2ccccc2N1CC#N Amb22009654 [0,2,0,0,0,0|1,0,1]=4 1904 B16R2.44545 CCON1C(=O)C=[N+]([O-])c2ccccc12 Amb19525539 [0,2,0,0,0,0|1,0,1]=4 1905 B16R2.44545 Cc1cc(=S)[n](CCC)c2ccccc12 Amb24070481 [0,2,0,0,0,0|1,1,0]=4 1906 B16R2.44545 N#CCN1c2ccccc2C(=O)NC1=O Amb20413777 [0,2,0,0,0,0|1,0,1]=4 1907 B16R2.44545 N#CCN1c2ccccc2C(=O)OC1=O Amb20413779 [0,2,0,0,0,0|1,0,1]=4 1908 B16R2.44545 O=C1NC(=O)N(CCBr)c2ccccc12 Amb25769831 [0,2,0,0,0,0|1,0,1]=4 1909 B16R2.44545 O=CCN1c2ccccc2C(=O)NC1=O Amb24616690 [0,2,0,0,0,0|1,0,1]=4 1910 B16R2.70217 CCn1c(C)cc(=O)c2c1c(C)ccc2 Amb10976742 [0,2,0,0,0,0|1,0,1]=4 1911 B16R2.70217 CCn1c(C)cc(=O)c2c1c(Cl)ccc2 Amb10976746 [0,2,0,0,0,0|1,0,1]=4 1912 B16R2.70217 CCn1c(C)cc(=O)c2c1c(F)ccc2 Amb10976748 [0,2,0,0,0,0|1,0,1]=4 1913 B16R2.70221 CC1=CC(=O)c2ccc(N)cc2N1CC Amb23569479 [0,2,0,0,0,0|1,0,1]=4 1914 B16R2.8682 CC=1C(=N)c2ccccc2N(C)C1CC Amb19754519 [0,2,0,0,0,0|2,0,0]=4 1915 B16R2.8682 CC=1C(=N)c2ccccc2N(C)C1CC Amb21870065 [0,2,0,0,0,0|2,0,0]=4 1916 B16R2.8682 CC=1C(=[NH2+])c2ccccc2N(C)C1CC Amb19756006 [0,2,0,0,0,0|2,0,0]=4 1917 B16R2.8682 CC=1C(=[NH2+])c2ccccc2N(C)C1CC Amb22553054 [0,2,0,0,0,0|2,0,0]=4 1918 B16R2.8682 CCC1=C(O)c2ccccc2N(C)C1=O Amb19668004 [0,2,0,0,0,0|0,0,0]=2 1919 B16R2.8682 CCC=1C(=O)N(C)c2ccccc2C1Cl Amb22448329 [0,2,0,0,0,0|1,0,0]=3 1920 B16R2.8682 CN1C(=O)C(C#N)=C(Cl)c2ccccc12 Amb22469969 [0,2,0,0,0,0|1,0,0]=3 1921 B16R2.8682 CN1C(=O)C(C#N)=C(O)c2ccccc12 Amb19667458 [0,2,0,0,0,0|0,0,0]=2 1922 B16R2.8682 CN1c2ccccc2C(=O)N(CC)C1=O Amb19807416 [0,2,0,0,0,0|1,0,1]=4 1923 B16R2.8682 CN1c2ccccc2C(Cl)=C(C=O)C1=O Amb18658583 [0,2,0,0,0,0|1,0,0]=3 1924 B16R2.8682 CN1c2ccccc2C(O)=C(N=O)C1=O Amb20028250 [0,2,0,0,0,0|0,0,0]=2 1925 B16R2.8682 COC1=C(O)c2ccccc2N(C)C1=O Amb22751150 [0,2,0,0,0,0|0,0,0]=2 1926 B16R2.22899 CN1C(=O)c2c(I)cccc2N(C)C1=O Amb22234590 [0,2,0,0,0,0|1,0,1]=4 1927 B16R2.133343 Brc1ccc2c(c1)n(C)c(=O)c(=O)n2C Amb2196519 [0,2,0,0,0,0|2,0,0]=4 1928 B16R2.133343 CN1C(=O)c2cc(Br)ccc2N(C)C1=O Amb19546116 [0,2,0,0,0,0|1,0,1]=4 1929 B16R2.133343 CN1C(=O)c2ccc(N)cc2N(C)C1=O Amb18654945 [0,2,0,0,0,0|1,0,1]=4 1930 B16R2.133343 CN1c2ccc(Br)cc2N(C)C(=O)C1=O Amb19654265 [0,2,0,0,0,0|2,0,0]=4 1931 B16R2.133343 CN1c2ccc(N)cc2N(C)C(=O)C1=O Amb18654946 [0,2,0,0,0,0|2,0,0]=4 1932 B16R2.133343 Clc1ccc2c(c1)n(C)c(=O)c(=O)n2C Amb10553837 [0,2,0,0,0,0|2,0,0]=4 1933 B16R2.24454 CC1=CC(=O)N(C)c2c1c(O)ccc2O Amb22751153 [0,2,0,0,0,0|1,0,0]=3 1934 B16R2.24454 CC1=CC(=S)N(C)C2=C1C(=O)C=CC2=O Amb24093790 [0,2,0,0,0,0|1,1,0]=4 1935 B16R2.36854 COc1cccc2c1C(=O)OC(=O)N2C Amb21943639 [0,2,0,0,0,0|1,0,1]=4 1936 B16R2.133137 CN1c2ccc(Br)c(F)c2C(=O)OC1=O Amb24055970 [0,2,0,0,0,0|1,0,1]=4 1937 B16R2.36855 CC1=CC(=O)N(C)c2c1cccc2OC Amb22371372 [0,2,0,0,0,0|1,0,0]=3 1938 B16R2.36855 COc1cccc2c1N(C)C(=O)OC2=O Amb22754370 [0,2,0,0,0,0|1,0,1]=4 1939 B16R2.36855 COc1cccc2c1n(C)c(cc2=O)C Amb10976713 [0,2,0,0,0,0|1,0,1]=4 1940 B16R2.37419 CN1C(=O)C=C(OC)c2cccc(O)c12 Amb21917190 [0,2,0,0,0,0|0,0,0]=2 1941 B16R2.104316 Cc1cc(C)c2c(c1)c(=O)cc(n2C)C Amb10976719 [0,2,0,0,0,0|1,0,1]=4 1942 B16R2.104316 Fc1cc(F)c2c(c1)c(=O)cc(n2C)C Amb10976733 [0,2,0,0,0,0|1,0,1]=4 1943 B16R2.37411 CN1c2ccccc2C(CO)=CC1(C)C Amb24116281 [0,2,0,0,0,0|1,0,1]=4 1944 B16R2.21692 CCOC1=CC(=O)c2ccccc2N1C Amb24062729 [0,2,0,0,0,0|0,0,2]=4 1945 B16R2.23331 CC(=O)c1cc(O)c2ccccc2c1O Amb18653766 [0,2,0,0,0,0|2,0,0]=4 1946 B16R2.23331 CN1C(=CC(=O)c2ccccc12)C(O)=O Amb18547589 [0,2,0,0,0,0|0,0,1]=3 1947 B16R2.22312 CC(C)c1cc(=O)[n](C)c2ccccc21 Amb24070401 [0,2,0,0,0,0|1,0,0]=3 1948 B16R2.22312 CN1c2ccccc2C(=CC1=O)C(O)=O Amb18545028 [0,2,0,0,0,0|0,0,0]=2 1949 B16R2.22312 OC(=O)C1CC(=O)N(c2c1cccc2)C Amb149550 [0,2,0,0,0,0|0,0,2]=4 1950 B16R2.37414 Cc1ccc2c(c1)N(C)C(=O)C=C2C=O Amb24099693 [0,2,0,0,0,0|0,0,1]=3 1951 B16R2.50940 CN1C(=O)C=C(\C=N\O)c2ccccc12 Amb19671989 [0,2,0,0,0,0|0,0,0]=2 1952 B16R2.50940 CN1c2ccccc2C(CCO)=CC1=O Amb23448567 [0,2,0,0,0,0|0,0,0]=2 1953 B16R2.50940 COCc1cc(=O)[n](C)c2ccccc21 Amb24103004 [0,2,0,0,0,0|0,0,0]=2 1954 B16R2.196882 CN1C(=O)C=C(O)c2cc(ccc12)OC Amb22751152 [0,2,0,0,0,0|0,0,0]=2 1955 B16R2.196882 COc1ccc2c(c1)c(=O)cc(n2C)C Amb10976714 [0,2,0,0,0,0|1,0,1]=4 1956 B16R2.197132 CN1C(=O)C=C(O)c2ccc(cc12)OC Amb22751149 [0,2,0,0,0,0|0,0,0]=2 1957 B14R2.8 CCc1coc(c1)c2ccccc2 Amb10572838 [0,0,1,1,0,0|2,0,0]=4 1958 B14R2.8 CNc1[nH]nc(c1)c2ccccc2 Amb16249399 [0,0,1,1,0,0|2,0,0]=4 1959 B14R2.8 CNc1cc([nH]n1)c2ccccc2 Amb13952791 [0,0,1,1,0,0|2,0,0]=4 1960 B14R2.8 CNc1cc([n][s]1)-c2ccccc2 Amb22462234 [0,0,1,1,0,0|1,1,0]=4 1961 B14R2.8 CNc1cc([n]o1)-c2ccccc2 Amb24678779 [0,0,1,1,0,0|1,0,1]=4 1962 B14R2.21 O=C1C=C(C=NN1)c2ccccc2 Amb25859226 [0,0,1,1,0,0|2,0,0]=4 1963 B14R2.21 O=C1C=C(N=CN1)c2ccccc2 Amb18001789 [0,0,1,1,0,0|1,0,1]=4 1964 B14R2.21 O=C1C=C(OC=C1)c2ccccc2 Amb22750060 [0,0,1,1,0,0|1,0,1]=4 1965 B14R2.21 O=C1CCOC(=C1)c2ccccc2 Amb22750040 [0,0,1,1,0,0|1,0,0]=3 1966 B14R2.21 O=C1NCC=C(N1)c2ccccc2 Amb25798331 [0,0,1,1,0,0|2,0,0]=4 1967 B14R2.21 O=C1NCC=C(O1)c2ccccc2 Amb23596887 [0,0,1,1,0,0|2,0,0]=4 1968 B14R2.52 CC1=CC(=O)CCc2ccccc21 Amb24492363 [0,0,1,1,0,0|2,0,0]=4 1969 B14R2.52 O=C1NCc2ccccc2C(=O)N1 Amb25732496 [0,0,1,1,0,0|1,0,1]=4 1970 B14R2.260 CC1=NC(=CC1=O)c2ccccc2 Amb24432231 [0,0,1,1,0,0|2,0,0]=4 1971 B14R2.260 CC1OC(=CC1=O)c2ccccc2 Amb24620159 [0,0,1,1,0,0|1,0,0]=3 1972 B14R2.260 CN1C=C(NC1=O)c2ccccc2 Amb25790637 [0,0,1,1,0,0|2,0,0]=4 1973 B14R2.260 CN1N=C(CC1=O)c2ccccc2 Amb17712376 [0,0,1,1,0,0|1,0,1]=4 1974 B14R2.260 CN1NC(=CC1=O)c2ccccc2 Amb19769388 [0,0,1,1,0,0|1,0,0]=3 1975 B14R2.260 C[n+]1oc(cc1C)c2ccccc2 Amb10553455 [0,0,1,1,0,0|1,0,1]=4 1976 B14R2.260 C[n+]1oc(cc1C)c2ccccc2 Amb16757474 [0,0,1,1,0,0|1,0,1]=4 1977 B14R2.260 C[n+]1oc(cc1N)-c2ccccc2 Amb24452248 [0,0,1,1,0,0|1,0,1]=4 1978 B14R2.260 C[n]1[n]c(cc1Br)-c2ccccc2 Amb22301186 [0,0,1,1,0,0|2,0,0]=4 1979 B14R2.260 C[n]1[n]c(cc1Cl)-c2ccccc2 Amb22453272 [0,0,1,1,0,0|2,0,0]=4 1980 B14R2.260 C[n]1[n]c(cc1S)-c2ccccc2 Amb19073087 [0,0,1,1,0,0|1,1,0]=4 1981 B14R2.260 Cc1cc(cn1C)-c2ccccc2 Amb17666668 [0,0,1,1,0,0|2,0,0]=4 1982 B14R2.260 Cn1oc(cc1=O)c2ccccc2 Amb10553851 [0,0,1,1,0,0|0,0,0]=2 1983 B14R2.335 O[C@H]([C@H]1CNC1=O)c2ccccc2 Amb25302360 [0,0,1,1,0,0|0,0,2]=4 1984 B14R2.958 CNC(=O)[C@@H]1O[C@H]1c2ccccc2 Amb25317578 [0,0,1,1,0,0|0,0,2]=4 1985 B14R2.24 O=C1C=CC=CN1c2ccccc2 Amb19133652 [0,0,1,1,0,0|1,0,1]=4 1986 B14R2.24 O=C1C=CC=NN1c2ccccc2 Amb22491545 [0,0,1,1,0,0|2,0,0]=4 1987 B14R2.24 O=C1C=CCCC1c2ccccc2 Amb25373024 [0,0,1,1,0,0|2,0,0]=4 1988 B14R2.24 O=C1C=CCCN1c2ccccc2 Amb22500740 [0,0,1,1,0,0|1,0,0]=3 1989 B14R2.24 O=C1C=COC=C1c2ccccc2 Amb25190053 [0,0,1,1,0,0|1,0,1]=4 1990 B14R2.44 CN1\C(=C/C=O)\Sc2ccccc12 Amb24668929 [0,0,1,1,0,0|0,1,1]=4 1991 B14R2.44 CN1\C(=C\C=O)\Oc2ccccc12 Amb25179864 [0,0,1,1,0,0|0,0,2]=4 1992 B14R2.44 C[n]1c2ccccc2cc1\C=N/O Amb25793531 [0,0,1,1,0,0|2,0,0]=4 1993 B14R2.44 C[n]1c2ccccc2cc1\C=N\O Amb24623687 [0,0,1,1,0,0|2,0,0]=4 1994 B14R2.44 O\N=C/c1nc2c(n1C)cccc2 Amb16765644 [0,0,1,1,0,0|2,0,0]=4 1995 B14R2.279 O=C1CCOc2c(N1C)cccc2 Amb17570222 [0,0,1,1,0,0|0,0,2]=4 1996 B14R2.317 CC1(CC=CC1=O)c2ccccc2 Amb25320045 [0,0,1,1,0,0|2,0,0]=4 1997 B14R2.317 CC1(OC=CC1=O)c2ccccc2 Amb24621673 [0,0,1,1,0,0|1,0,0]=3 1998 B14R2.422 CN(C=1CC(=O)C1)c2ccccc2 Amb24416733 [0,0,1,1,0,0|1,0,1]=4 1999 B14R2.598 CC1=CC(=O)N(N1)c2ccccc2 Amb18790297 [0,0,1,1,0,0|2,0,0]=4 2000 B14R2.598 NC1=CC(=O)N(N1)c2ccccc2 Amb22394971 [0,0,1,1,0,0|2,0,0]=4 2001 B14R2.598 NC=1CN(C(=O)N1)c2ccccc2 Amb25227483 [0,0,1,1,0,0|2,0,0]=4 2002 B14R2.598 Nc1cc(O)[n][n]1-c2ccccc2 Amb18944742 [0,0,1,1,0,0|2,0,0]=4 2003 B14R2.598 O=C1C=C(Cl)NN1c2ccccc2 Amb25295385 [0,0,1,1,0,0|2,0,0]=4 2004 B14R2.598 O=C1CC(=O)N(C1)c2ccccc2 Amb20622677 [0,0,1,1,0,0|0,0,2]=4 2005 B14R2.598 O=C1OC(=O)CN1c2ccccc2 Amb25084575 [0,0,1,1,0,0|1,0,1]=4 2006 B14R2.598 OC1=CC(=O)N(N1)c2ccccc2 Amb22171490 [0,0,1,1,0,0|1,0,0]=3 2007 B14R2.11690 CN1c2c(CC1=O)cccc2C=O Amb18197489 [0,0,1,1,0,0|0,0,2]=4 2008 B14R2.11690 CN1c2c(cccc2OC1=O)C=O Amb18196470 [0,0,1,1,0,0|1,0,1]=4 2009 B14R2.11690 Cc1cc2cccc(C=O)c2[n]1C Amb18198020 [0,0,1,1,0,0|1,0,1]=4 2010 B14R2.11690 Cc1cc2cccc(CO)c2[n]1C Amb25071417 [0,0,1,1,0,0|1,0,1]=4 2011 B14R2.31359 NC(=O)N1CC=Cc2ccccc12 Amb24063999 [0,0,1,1,0,0|2,0,0]=4 2012 B14R2.98 CNc1ccccc1-c2[n]c[n]o2 Amb18951460 [0,0,1,1,0,0|2,0,0]=4 2013 B14R2.98 CNc1ccccc1-c2ccc[s]2 Amb19040744 [0,0,1,1,0,0|1,1,0]=4 2014 B14R2.98 COc1ccccc1-c2cc[n]o2 Amb22043707 [0,0,1,1,0,0|2,0,0]=4 2015 B14R2.98 COc1ccccc1-c2ccco2 Amb24184097 [0,0,1,1,0,0|2,0,0]=4 2016 B14R2.510 C=C1O\C(=C\C=O)\c2ccccc21 Amb24580388 [0,0,1,1,0,0|1,0,1]=4 2017 B14R2.510 C[n]1cc(CC=O)c2ccccc12 Amb18127082 [0,0,1,1,0,0|1,0,1]=4 2018 B14R2.7150 O=C\C=C\1/CCCc2ccccc21 Amb18647673 [0,0,1,1,0,0|2,0,0]=4 2019 B14R2.9718 OC1(CC=O)CNc2ccccc12 Amb24743967 [0,0,1,1,0,0|0,0,2]=4 2020 B14R2.11635 CNc1cccc2cccc(N)c21 Amb18126928 [0,0,1,1,0,0|2,0,0]=4 2021 B14R2.11635 COc1cccc2c1c(O)ccn2 Amb10602739 [0,0,1,1,0,0|2,0,0]=4 2022 B14R2.11635 COc1cccc2cccc(O)c21 Amb18127191 [0,0,1,1,0,0|2,0,0]=4 2023 B14R2.11691 CNc1cccc2C(=O)NC(=O)c21 Amb25075942 [0,0,1,1,0,0|1,0,1]=4 2024 B14R2.24350 C[n]1c[n]c2cccc(C(O)=O)c12 Amb24088933 [0,0,1,1,0,0|2,0,0]=4 2025 B16R3.13490 O=C1C=C2CCCN2c3ccccc31 Amb22371329 [0,1,0,1,0,0|1,0,1]=4 2026 B16R3.13490 Oc1cc2CCCc2c3ccccc31 Amb25087250 [0,1,0,1,0,0|2,0,0]=4 2027 B16R3.33838 CC1=CC(=O)N2CCc3cccc1c23 Amb19654057 [0,1,0,1,0,0|1,0,0]=3 2028 B16R3.33838 O=C1C=C(Cl)c2cccc3CCN1c32 Amb24119522 [0,1,0,1,0,0|1,0,0]=3 2029 B16R3.33838 OC1=CC(=O)N2CCc3cccc1c23 Amb24119521 [0,1,0,1,0,0|0,0,0]=2 2030 B16R3.33838 [O-][N+]1=CC(=O)N2CCc3cccc1c23 Amb25267848 [0,1,0,1,0,0|1,0,1]=4 2031 B12R2.18 CC1C(=O)Cc2ccccc21 Amb20622460 [1,0,0,0,1,0|1,0,1]=4 2032 B12R2.18 CC1C(=O)Oc2ccccc21 Amb25150504 [1,0,0,0,1,0|2,0,0]=4 2033 B12R2.18 CC1C(=O)Sc2ccccc21 Amb24519014 [1,0,0,0,1,0|2,0,0]=4 2034 B12R2.18 CN1C(=C)Oc2ccccc12 Amb24102381 [1,0,0,0,1,0|2,0,0]=4 2035 B12R2.18 CN1C(=C)Sc2ccccc12 Amb17842907 [1,0,0,0,1,0|2,0,0]=4 2036 B12R2.18 CN1C(=N)Sc2ccccc12 Amb19202293 [1,0,0,0,1,0|2,0,0]=4 2037 B12R2.18 CN1C(=O)Cc2cc[n]cc12 Amb22491400 [1,0,0,0,1,0|1,0,1]=4 2038 B12R2.18 CN1C(=O)Cc2ccc[n]c12 Amb24334650 [1,0,0,0,1,0|1,0,1]=4 2039 B12R2.18 CN1C(=O)Nc2[n]cccc12 Amb20661045 [1,0,0,0,1,0|2,0,0]=4 2040 B12R2.18 CN1C(=O)Nc2c[n]ccc12 Amb19148095 [1,0,0,0,1,0|2,0,0]=4 2041 B12R2.18 CN1C(=O)Nc2ccc[n]c12 Amb21963725 [1,0,0,0,1,0|2,0,0]=4 2042 B12R2.18 CN1C(=O)Nc2ccccc12 Amb18537193 [1,0,0,0,1,0|1,0,0]=3 2043 B12R2.18 CN1C(=O)Oc2ccc[n]c12 Amb18407346 [1,0,0,0,1,0|2,0,0]=4 2044 B12R2.18 CN1C(=O)Oc2ccccc12 Amb18043105 [1,0,0,0,1,0|1,0,0]=3 2045 B12R2.18 CN1C(=O)Sc2ccccc12 Amb19654015 [1,0,0,0,1,0|1,0,0]=3 2046 B12R2.18 CN1C(=S)Nc2ccccc12 Amb19815991 [1,0,0,0,1,0|1,1,0]=4 2047 B12R2.18 CN1C(=S)Oc2ccccc12 Amb19664828 [1,0,0,0,1,0|1,1,0]=4 2048 B12R2.18 CN1C(=S)Sc2ccccc12 Amb19664825 [1,0,0,0,1,0|1,1,0]=4 2049 B12R2.18 C[n]1c(Br)cc2[n]cccc12 Amb18175870 [1,0,0,0,1,0|2,0,0]=4 2050 B12R2.18 C[n]1c(Br)cc2c[n]ccc12 Amb18175875 [1,0,0,0,1,0|2,0,0]=4 2051 B12R2.18 C[n]1c(Br)cc2ccccc12 Amb22232574 [1,0,0,0,1,0|1,0,0]=3 2052 B12R2.18 C[n]1c(I)cc2ccc[n]c12 Amb25196637 [1,0,0,0,1,0|2,0,0]=4 2053 B12R2.18 C[n]1c(I)cc2ccccc12 Amb24067548 [1,0,0,0,1,0|1,0,0]=3 2054 B12R2.18 C[n]1c(N)cc2c[n]ccc12 Amb18202290 [1,0,0,0,1,0|2,0,0]=4 2055 B12R2.18 C[n]1c(N)cc2ccccc12 Amb18644284 [1,0,0,0,1,0|1,0,0]=3 2056 B12R2.18 C[n]1c(N)cc2ccccc12 Amb19944548 [1,0,0,0,1,0|1,0,0]=3 2057 B12R2.18 C[n]1c(O)cc2[n]cccc12 Amb24462412 [1,0,0,0,1,0|1,0,1]=4 2058 B12R2.18 C[n]1c([SeH])[n]c2ccccc12 Amb20246247 [1,0,0,0,1,0|1,1,0]=4 2059 B12R2.18 Cc1cc2c[n]ccc2[n]1C Amb21857394 [1,0,0,0,1,0|2,0,0]=4 2060 B12R2.18 Cc1cc2ccc[n]c2[n]1C Amb25798385 [1,0,0,0,1,0|2,0,0]=4 2061 B12R2.18 Cc1cc2ccccc2[n]1Cl Amb24628260 [1,0,0,0,1,0|2,0,0]=4 2062 B12R2.18 Cn1c(=O)[nH]c2c1cccc2 Amb1159144 [1,0,0,0,1,0|1,0,0]=3 2063 B12R2.18 Cn1c(=O)oc2c1cccc2 Amb1905664 [1,0,0,0,1,0|1,0,0]=3 2064 B12R2.18 Cn1c(C)cc2c1cccc2 Amb1934988 [1,0,0,0,1,0|1,0,0]=3 2065 B12R2.18 Cn1c(N)nc2c1cccc2 Amb10561226 [1,0,0,0,1,0|2,0,0]=4 2066 B12R2.18 Cn1c(S)nc2c1cccc2 Amb1104434 [1,0,0,0,1,0|1,1,0]=4 2067 B12R2.18 NN1C(=O)Nc2ccccc12 Amb18124952 [1,0,0,0,1,0|2,0,0]=4 2068 B12R2.18 NN1C(=O)Oc2ccccc12 Amb18644412 [1,0,0,0,1,0|2,0,0]=4 2069 B12R2.18 O=C1Cc2c(N1C)cccc2 Amb1398903 [1,0,0,0,1,0|0,0,1]=3 2070 B12R2.18 O=C1Cc2c(N1N)cccc2 Amb10560115 [1,0,0,0,1,0|1,0,1]=4 2071 B12R2.18 ON1C(=O)Cc2ccccc12 Amb17940424 [1,0,0,0,1,0|1,0,1]=4 2072 B12R2.82 CN1c2cc[n][n]2C=CC1=O Amb22753332 [1,0,0,0,1,0|2,0,0]=4 2073 B12R2.246 Cc1cc(=O)[nH]c2cc[nH]c21 Amb24083426 [1,0,0,0,1,0|2,0,0]=4 2074 B12R2.246 Nc1[nH]c2cccc2c(O)[n]1 Amb24427277 [1,0,0,0,1,0|2,0,0]=4 2075 B12R2.246 O=C1C=C(Cl)c2[s]ccc2N1 Amb23560707 [1,0,0,0,1,0|2,0,0]=4 2076 B12R2.246 O=C1C=C(Cl)c2cc[s]c2N1 Amb22500816 [1,0,0,0,1,0|2,0,0]=4 2077 B12R2.246 OC1=CC(=O)N[n]2cccc21 Amb22276928 [1,0,0,0,1,0|1,0,0]=3 2078 B12R2.246 OC1=CC(=O)Nc2[n]cc[n]21 Amb22496265 [1,0,0,0,1,0|2,0,0]=4 2079 B12R2.246 OC1=CC(=O)Nc2[s]ccc21 Amb21857124 [1,0,0,0,1,0|1,0,0]=3 2080 B12R2.246 OC1=CC(=O)Nc2cc[n][n]21 Amb22753418 [1,0,0,0,1,0|2,0,0]=4 2081 B12R2.2028 C=C1NC(=O)c2ccccc21 Amb20671447 [1,0,0,0,1,0|2,0,0]=4 2082 B12R2.2028 C=C1OC(=O)c2ccccc21 Amb22229358 [1,0,0,0,1,0|2,0,0]=4 2083 B12R2.2028 CC1=CC(O)c2ccccc12 Amb17778893 [1,0,0,0,1,0|1,0,1]=4 2084 B12R2.2028 C[n]1cc(O)c2ccccc12 Amb24069283 [1,0,0,0,1,0|2,0,0]=4 2085 B12R2.2028 N=C1NC(=O)c2ccccc21 Amb21811514 [1,0,0,0,1,0|2,0,0]=4 2086 B12R2.2028 O=C1CC(=O)c2c1cccc2 Amb1883008 [1,0,0,0,1,0|0,0,2]=4 2087 B12R2.2028 O=C1NC(=O)c2c1cccc2 Amb10604058 [1,0,0,0,1,0|1,0,1]=4 2088 B12R2.2028 O=C1NC(=O)c2c1cccc2 Amb1934252 [1,0,0,0,1,0|1,0,1]=4 2089 B12R2.2028 O=C1NC(=O)c2ccccc12 Amb19944694 [1,0,0,0,1,0|1,0,1]=4 2090 B12R2.2028 O=C1NC(=S)c2ccccc21 Amb25277268 [1,0,0,0,1,0|1,1,0]=4 2091 B12R2.2028 O=C1NC(c2c1cccc2)O Amb17593710 [1,0,0,0,1,0|1,0,1]=4 2092 B12R2.2028 O=C1OC(=O)[13c]2[13cH][13cH][13cH][13cH][13c]21 Amb22339015 [1,0,0,0,1,0|1,0,1]=4 2093 B12R2.2028 O=C1OC(=O)c2ccccc12 Amb17748796 [1,0,0,0,1,0|1,0,1]=4 2094 B12R2.2028 O=C1OC(c2c1cccc2)O Amb10552913 [1,0,0,0,1,0|1,0,1]=4 2095 B12R2.2028 O=C1OC(c2c1cccc2)O Amb16226896 [1,0,0,0,1,0|1,0,1]=4 2096 B12R2.2028 O=C1[15N-]C(=O)c2ccccc12 Amb22732113 [1,0,0,0,1,0|1,0,1]=4 2097 B12R2.2028 O=C1[15NH]C(=O)c2ccccc12 Amb22338958 [1,0,0,0,1,0|1,0,1]=4 2098 B12R2.2028 O=C1[N-]C(=O)c2ccccc12 Amb22411655 [1,0,0,0,1,0|1,0,1]=4 2099 B12R2.2028 O=C1[N-]C(=O)c2ccccc12 Amb22524346 [1,0,0,0,1,0|1,0,1]=4 2100 B12R2.2028 O=[13C]1O[13C](=O)c2ccccc12 Amb22056066 [1,0,0,0,1,0|1,0,1]=4 2101 B12R2.2028 OI1OC(=O)c2ccccc12 Amb19958248 [1,0,0,0,1,0|2,0,0]=4 2102 B12R2.2028 ON1CC(=O)c2ccccc12 Amb24078911 [1,0,0,0,1,0|1,0,1]=4 2103 B12R2.2028 O[C@@H]1CC(=O)c2ccccc21 Amb24724027 [1,0,0,0,1,0|0,0,2]=4 2104 B12R2.2028 O[C@H]1CC(=O)c2ccccc21 Amb25188743 [1,0,0,0,1,0|0,0,2]=4 2105 B12R2.2028 [O-][N+]1=CC(=O)c2ccccc12 Amb17843025 [1,0,0,0,1,0|1,0,1]=4 2106 B12R2.221 CN1C=CC(=O)c2[s]ccc12 Amb24723951 [1,0,0,0,1,0|1,0,1]=4 2107 B12R2.221 Cc1ccc(O)c2C=CCc21 Amb25707042 [1,0,0,0,1,0|1,0,1]=4 2108 B12R2.221 Cc1ccc(O)c2[nH]ccc21 Amb24067495 [1,0,0,0,1,0|2,0,0]=4 2109 B12R2.221 Cc1ccc(O)c2[s]ccc21 Amb25144591 [1,0,0,0,1,0|2,0,0]=4 2110 B12R2.221 Cc1ccc(O)c2cc[nH]c21 Amb22736748 [1,0,0,0,1,0|2,0,0]=4 2111 B14R1.163 CNC(=O)CCC(=O)c1ccccc1 Amb17336307 [0,0,1,0,0,1|0,0,2]=4 2112 B14R1.163 CNC(=O)CCC(c1ccccc1)O Amb17336618 [0,0,1,0,0,1|0,0,2]=4 2113 B14R1.163 CNC(=O)CNC(=N)c1ccccc1 Amb24677147 [0,0,1,0,0,1|1,0,1]=4 2114 B14R1.163 CNC(=O)CNC(=O)c1ccccc1 Amb1666156 [0,0,1,0,0,1|0,0,2]=4 2115 B14R1.163 CNC(=O)NCC(=O)c1ccccc1 Amb24639111 [0,0,1,0,0,1|0,0,2]=4 2116 B14R1.163 CNC(=O)NCC(O)c1ccccc1 Amb24181770 [0,0,1,0,0,1|0,0,2]=4 2117 B14R1.163 CNC(=O)NNC(=N)c1ccccc1 Amb25119281 [0,0,1,0,0,1|2,0,0]=4 2118 B14R1.163 CNC(=O)NNC(=S)c1ccccc1 Amb25035857 [0,0,1,0,0,1|1,1,0]=4 2119 B14R1.163 CNC(=O)S\N=C(\O)/c1ccccc1 Amb24653673 [0,0,1,0,0,1|1,0,0]=3 2120 B14R1.163 COC(=O)\C=C\C(=O)c1ccccc1 Amb2435415 [0,0,1,0,0,1|1,0,1]=4 2121 B14R1.743 CNC(=O)CC(=O)Nc1ccccc1 Amb24506382 [0,0,1,0,0,1|0,0,2]=4 2122 B14R1.743 CNC(=O)\N=C(\N)/Nc1ccccc1 Amb25336354 [0,0,1,0,0,1|2,0,0]=4 2123 B14R1.743 CN\C(=C/C(=O)Oc1ccccc1)\C Amb2386641 [0,0,1,0,0,1|1,0,1]=4 2124 B14R1.743 COC(=O)\C=C(/Nc1ccccc1)\C Amb2386652 [0,0,1,0,0,1|2,0,0]=4 2125 B14R1.743 COC(=O)\C=C(\N)/Nc1ccccc1 Amb25843964 [0,0,1,0,0,1|2,0,0]=4 2126 B14R1.743 C\C(=C/C(=O)Oc1ccccc1)\NC Amb25233525 [0,0,1,0,0,1|1,0,1]=4 2127 B14R1.743 C\C(=C/C(=S)Nc1ccccc1)\NC Amb24682808 [0,0,1,0,0,1|1,1,0]=4 2128 B14R1.743 C\C(=C\C(=O)CC)\Nc1ccccc1 Amb24447082 [0,0,1,0,0,1|2,0,0]=4 2129 B14R1.743 C\C(=C\C(=S)NC)\Nc1ccccc1 Amb24640385 [0,0,1,0,0,1|1,1,0]=4 2130 B14R1.743 C\C(=C\C(=S)Nc1ccccc1)\NC Amb24506567 [0,0,1,0,0,1|1,1,0]=4 2131 B14R1.60 CC(=Cc1ccccc1)C(=O)C=C[O-] Amb24090361 [0,0,1,0,0,1|1,0,1]=4 2132 B14R1.60 C\C(=C/c1ccccc1)\C(=O)\C=C/[O-] Amb22728792 [0,0,1,0,0,1|1,0,1]=4 2133 B14R1.60 C\C=C\C(=O)N(C)Cc1ccccc1 Amb25256786 [0,0,1,0,0,1|1,0,0]=3 2134 B14R1.60 OCCC(=O)N(Cc1ccccc1)C Amb17336607 [0,0,1,0,0,1|0,0,2]=4 2135 B14R1.744 CC(=O)Nc1ccccc1N(C)C=O Amb24743203 [0,0,1,0,0,1|0,0,2]=4 2136 B14R2.741 CC1=Cc2ccccc2C=CC1=O Amb21948167 [1,0,0,0,0,1|1,0,0]=3 2137 B14R2.741 CN1Cc2ccccc2C=CC1=O Amb25320489 [1,0,0,0,0,1|0,0,0]=2 2138 B14R2.741 CN1Cc2ccccc2CCC1=O Amb25315973 [1,0,0,0,0,1|0,0,2]=4 2139 B14R2.741 CN1Cc2ccccc2NCC1=O Amb25374060 [1,0,0,0,0,1|1,0,1]=4 2140 B14R2.741 NC1=Cc2ccccc2C=CC1=O Amb25760803 [1,0,0,0,0,1|2,0,0]=4 2141 B14R2.741 O=C1C=Cc2ccccc2NC1=O Amb25190176 [1,0,0,0,0,1|2,0,0]=4 2142 B14R2.741 O=C1C=Cc2ccccc2OC1=O Amb24721695 [1,0,0,0,0,1|2,0,0]=4 2143 B14R2.287 CC1=NCC(=O)Nc2ccccc21 Amb22236112 [1,0,0,0,0,1|1,0,1]=4 2144 B14R2.287 O=C1C=CC(=O)Nc2ccccc12 Amb25338058 [1,0,0,0,0,1|0,0,1]=3 2145 B14R2.287 O=C1C=CC(=O)Oc2ccccc12 Amb25073385 [1,0,0,0,0,1|1,0,1]=4 2146 B14R2.287 O=C1C=NC(=O)c2ccccc2N1 Amb24597661 [1,0,0,0,0,1|0,0,1]=3 2147 B14R2.287 O=C1CCC(=O)c2c(N1)cccc2 Amb17608787 [1,0,0,0,0,1|0,0,2]=4 2148 B14R2.287 OC1=CCC(=O)Nc2ccccc21 Amb25827555 [1,0,0,0,0,1|0,0,0]=2 2149 B14R2.287 OC1C=CC(=O)Nc2ccccc21 Amb25034148 [1,0,0,0,0,1|0,0,1]=3 2150 B14R2.287 OC=1C=CC(=O)N=C2N=CC=CC21 Amb25214670 [1,0,0,0,0,1|1,0,1]=4 2151 B14R2.738 C=C1Nc2ccccc2N=C(O)N1 Amb25815750 [1,0,0,0,0,1|2,0,0]=4 2152 B14R2.738 CC1=CC(=Nc2c(N1)cccc2)C Amb1399492 [1,0,0,0,0,1|2,0,0]=4 2153 B14R2.738 CC1=CC(=O)Cc2ccccc2O1 Amb24646596 [1,0,0,0,0,1|2,0,0]=4 2154 B14R2.738 CC1=CC(=O)Nc2[n]cccc2N1 Amb24682708 [1,0,0,0,0,1|2,0,0]=4 2155 B14R2.738 CC1=CC(=O)Nc2c[n]ccc2N1 Amb24566138 [1,0,0,0,0,1|2,0,0]=4 2156 B14R2.738 CC1=CC(=O)Nc2ccccc2N1 Amb17912774 [1,0,0,0,0,1|1,0,0]=3 2157 B14R2.738 CC1=CC(=[NH+]c2c(N1)cccc2)C Amb10638 [1,0,0,0,0,1|2,0,0]=4 2158 B14R2.738 CC=1C=C(C)Nc2ccccc2N1 Amb21872593 [1,0,0,0,0,1|2,0,0]=4 2159 B14R2.738 O=C1C=C(Cl)Sc2ccccc2N1 Amb25119160 [1,0,0,0,0,1|1,0,0]=3 2160 B14R2.738 O=C1CC(=Nc2c(N1)cccc2)C Amb1396300 [1,0,0,0,0,1|1,0,1]=4 2161 B14R2.738 O=C1CC(=O)Nc2c(N1)cccc2 Amb1678046 [1,0,0,0,0,1|0,0,2]=4 2162 B14R2.738 OC1=CC(=O)Nc2[n]cccc2N1 Amb25816909 [1,0,0,0,0,1|1,0,0]=3 2163 B14R2.738 OC1=CC(=O)Nc2[n]cccc2O1 Amb24470717 [1,0,0,0,0,1|1,0,0]=3 2164 B14R2.738 OC1=CC(=O)Nc2ccccc2O1 Amb25685946 [1,0,0,0,0,1|0,0,0]=2