0 B14R1.540 CC(C)CNC(C#N)c1ccccc1 Amb17043549 [0,0,0,0,0,0|2,0,2]=4 1 B14R1.540 CC(C)CNC(CO)c1ccccc1 Amb19051239 [0,0,0,0,0,0|1,0,3]=4 2 B14R1.540 CC(C)COC(CBr)c1ccccc1 Amb33348520 [0,0,0,0,0,0|2,0,2]=4 3 B14R1.540 CC(C)COC(CI)c1ccccc1 Amb33349137 [0,0,0,0,0,0|2,0,2]=4 4 B14R1.540 CC(C)C\C=C(\C=O)c1ccccc1 Amb9826779 [0,0,0,0,0,0|0,0,0]=0 5 B14R1.540 CC(C)N\C=C(\C#N)c1ccccc1 Amb27985019 [0,0,0,0,0,0|2,0,1]=3 6 B14R1.540 CCC(NCC(C)C)c1ccccc1 Amb19373691 [0,0,0,0,0,0|2,0,2]=4 7 B14R1.540 CCC(NCC(C)C)c1ccccc1 Amb6686005 [0,0,0,0,0,0|2,0,2]=4 8 B14R1.540 CN(C)CC\C(=N/O)c1ccccc1 Amb20619436 [0,0,0,0,0,0|2,0,2]=4 9 B14R1.540 CN(C)CC\C(=N\O)c1ccccc1 Amb6891044 [0,0,0,0,0,0|2,0,2]=4 10 B14R1.540 CNC(CCC(C)C)c1ccccc1 Amb2586538 [0,0,0,0,0,0|2,0,2]=4 11 B13R1.26 C#C\C(=C\CCCl)c1ccccc1 Amb27859219 [1,0,0,0,0,0|2,0,1]=4 12 B13R1.26 CCCNC(=S=O)c1ccncc1 Amb27608659 [1,0,0,0,0,0|3,0,0]=4 13 B13R1.26 CCC\N=C(\NC)c1ccccc1 Amb27253556 [1,0,0,0,0,0|3,0,0]=4 14 B13R1.26 CCN\C=C(/C#N)c1ccccc1 Amb27415557 [1,0,0,0,0,0|2,0,1]=4 15 B13R1.26 CCO\C=C(\C#N)c1ccccc1 Amb27603692 [1,0,0,0,0,0|2,0,1]=4 16 B13R1.26 C\C=C(\C=C\CO)c1ccccc1 Amb28206001 [1,0,0,0,0,0|2,0,1]=4 17 B13R1.26 N#CS\C=C(/C=O)c1ccccc1 Amb27403100 [1,0,0,0,0,0|2,0,1]=4 18 B13R1.45 CC(=O)CCC(=O)c1ccccc1 Amb6357807 [1,0,0,0,0,0|1,0,2]=4 19 B13R1.45 CC(=O)CNC(=O)c1ccccc1 Amb9836069 [1,0,0,0,0,0|2,0,1]=4 20 B13R1.45 CC(=O)COC(=O)c1ccccc1 Amb22497327 [1,0,0,0,0,0|2,0,1]=4 21 B13R1.45 CC(=O)C\C=C(/C)c1ccccc1 Amb27169026 [1,0,0,0,0,0|1,0,2]=4 22 B13R1.45 CC(C)=C=CC(=O)c1ccccc1 Amb28197507 [1,0,0,0,0,0|0,0,2]=3 23 B13R1.45 CC(C)=NNC(=O)c1ccccc1 Amb1652225 [1,0,0,0,0,0|2,0,1]=4 24 B13R1.45 CC(C)=NOC(=O)c1ccccc1 Amb22733229 [1,0,0,0,0,0|2,0,1]=4 25 B13R1.45 CC(C)CCC(=O)c1ccccc1 Amb3940666 [1,0,0,0,0,0|0,0,1]=2 26 B13R1.45 CC(C)CCC(=O)c1ccccn1 Amb6301499 [1,0,0,0,0,0|1,0,1]=3 27 B13R1.45 CC(C)CCC(=O)c1cccnc1 Amb17233267 [1,0,0,0,0,0|1,0,1]=3 28 B13R1.45 CC(C)CCC(N)c1ccccc1 Amb35745830 [1,0,0,0,0,0|1,0,2]=4 29 B13R1.45 CC(C)CCC(N)c1ccccc1 Amb6744642 [1,0,0,0,0,0|1,0,2]=4 30 B13R1.45 CC(C)CNC(=N)c1ccccc1 Amb23447122 [1,0,0,0,0,0|2,0,0]=3 31 B13R1.45 CC(C)CNC(=N)c1ccccc1 Amb32663656 [1,0,0,0,0,0|2,0,0]=3 32 B13R1.45 CC(C)CNC(=O)c1ccccc1 Amb2703716 [1,0,0,0,0,0|1,0,0]=2 33 B13R1.45 CC(C)CNC(=O)c1ccccn1 Amb8344418 [1,0,0,0,0,0|2,0,0]=3 34 B13R1.45 CC(C)CNC(=O)c1cccnc1 Amb6347269 [1,0,0,0,0,0|2,0,0]=3 35 B13R1.45 CC(C)CNC(=O)c1ccncn1 Amb27753659 [1,0,0,0,0,0|3,0,0]=4 36 B13R1.45 CC(C)CNC(=O)c1cnccn1 Amb8339065 [1,0,0,0,0,0|3,0,0]=4 37 B13R1.45 CC(C)CNC(=O)c1cncnc1 Amb27602100 [1,0,0,0,0,0|3,0,0]=4 38 B13R1.45 CC(C)CNC(=S)c1ccccc1 Amb10553418 [1,0,0,0,0,0|1,1,0]=3 39 B13R1.45 CC(C)CNC(=S)c1cccnc1 Amb27199709 [1,0,0,0,0,0|2,1,0]=4 40 B13R1.45 CC(C)CNC(C)c1ccccc1 Amb6684804 [1,0,0,0,0,0|1,0,2]=4 41 B13R1.45 CC(C)COC(=O)c1ccccc1 Amb6357326 [1,0,0,0,0,0|1,0,0]=2 42 B13R1.45 CC(C)COC(=O)c1ccncc1 Amb17509537 [1,0,0,0,0,0|2,0,0]=3 43 B13R1.45 CC(C)C\N=C(/N)c1cccnc1 Amb21970340 [1,0,0,0,0,0|3,0,0]=4 44 B13R1.45 CC(C)C\N=C(\Cl)c1ccccc1 Amb28048149 [1,0,0,0,0,0|2,0,0]=3 45 B13R1.45 CC(C)NCC(=O)c1ccccc1 Amb6357665 [1,0,0,0,0,0|1,0,1]=3 46 B13R1.45 CC(C)NNC(=O)c1ccccc1 Amb8484604 [1,0,0,0,0,0|2,0,0]=3 47 B13R1.45 CC(C)NNC(=O)c1ccccn1 Amb27760379 [1,0,0,0,0,0|3,0,0]=4 48 B13R1.45 CC(C)NNC(=O)c1ccncc1 Amb22728324 [1,0,0,0,0,0|3,0,0]=4 49 B13R1.45 CC(C)NNC(=O)c1ccncc1 Amb2612372 [1,0,0,0,0,0|3,0,0]=4 50 B13R1.45 CC(C)O\N=C(/N)c1ccccc1 Amb18862929 [1,0,0,0,0,0|3,0,0]=4 51 B13R1.45 CC(C)SCC(=O)c1ccccc1 Amb19051955 [1,0,0,0,0,0|1,0,1]=3 52 B13R1.45 CC(Cl)CNC(=O)c1ccccc1 Amb27983667 [1,0,0,0,0,0|2,0,0]=3 53 B13R1.45 CC(Cl)CNC(=O)c1ccncc1 Amb27590984 [1,0,0,0,0,0|3,0,0]=4 54 B13R1.45 CC(F)\C=C\C(=O)c1ccccc1 Amb26556366 [1,0,0,0,0,0|1,0,1]=3 55 B13R1.45 CC(O)C#CC(=O)c1ccccc1 Amb28351381 [1,0,0,0,0,0|1,0,2]=4 56 B13R1.45 CC(O)CNC(=O)c1ccccc1 Amb9244613 [1,0,0,0,0,0|2,0,0]=3 57 B13R1.45 CC(O)CNC(=O)c1cccnc1 Amb20624855 [1,0,0,0,0,0|3,0,0]=4 58 B13R1.45 CC(O)CNC(=O)c1cccnc1 Amb9246552 [1,0,0,0,0,0|3,0,0]=4 59 B13R1.45 CC(O)CNC(=S)c1ccccc1 Amb27795710 [1,0,0,0,0,0|2,1,0]=4 60 B13R1.45 CN(C)CCC(=O)c1ccccc1 Amb1106335 [1,0,0,0,0,0|1,0,1]=3 61 B13R1.45 CN(C)CCC(=O)c1ccccc1 Amb1197569 [1,0,0,0,0,0|1,0,1]=3 62 B13R1.45 CN(C)CCC(=O)c1ccccc1 Amb4421073 [1,0,0,0,0,0|1,0,1]=3 63 B13R1.45 CN(C)CCC(=O)c1ccccn1 Amb24119362 [1,0,0,0,0,0|2,0,1]=4 64 B13R1.45 CN(C)CCC(=O)c1cccnc1 Amb32680342 [1,0,0,0,0,0|2,0,1]=4 65 B13R1.45 CN(C)CCC(=O)c1ccncc1 Amb24119350 [1,0,0,0,0,0|2,0,1]=4 66 B13R1.45 CN(C)CNC(=O)c1ccccc1 Amb10565604 [1,0,0,0,0,0|2,0,0]=3 67 B13R1.45 CN(C)C\C=C(/N)c1ccccc1 Amb27180265 [1,0,0,0,0,0|2,0,0]=3 68 B13R1.45 CN(C)C\C=C(\N)c1ccccc1 Amb28051772 [1,0,0,0,0,0|2,0,0]=3 69 B13R1.45 CN(C)\C=C/C(=O)c1ccccc1 Amb9769748 [1,0,0,0,0,0|1,0,1]=3 70 B13R1.45 CN(C)\C=C/C(=O)c1cccnc1 Amb26518240 [1,0,0,0,0,0|2,0,1]=4 71 B13R1.45 CN(C)\C=C\C(=O)c1ccccc1 Amb2384234 [1,0,0,0,0,0|1,0,1]=3 72 B13R1.45 CN(C)\C=C\C(=O)c1ccccn1 Amb33995553 [1,0,0,0,0,0|2,0,1]=4 73 B13R1.45 CN(C)\C=C\C(=O)c1cccnc1 Amb2424323 [1,0,0,0,0,0|2,0,1]=4 74 B13R1.45 CN(C)\C=C\C(=O)c1ccncc1 Amb31282714 [1,0,0,0,0,0|2,0,1]=4 75 B13R1.45 CN(C)\C=N\C(=O)c1ccccc1 Amb16231122 [1,0,0,0,0,0|2,0,1]=4 76 B13R1.45 C[C@@H](F)C#CC(=O)c1ccccc1 Amb27948609 [1,0,0,0,0,0|1,0,2]=4 77 B13R1.45 C[C@@H](O)CNC(=O)c1ccccc1 Amb27427140 [1,0,0,0,0,0|2,0,0]=3 78 B13R1.45 C[C@@H](O)CNC(=O)c1ccccn1 Amb28289979 [1,0,0,0,0,0|3,0,0]=4 79 B13R1.45 C[C@@H](O)CNC(=O)c1cccnc1 Amb27586972 [1,0,0,0,0,0|3,0,0]=4 80 B13R1.45 C[C@H](O)C#CC(=O)c1ccccc1 Amb27772530 [1,0,0,0,0,0|1,0,2]=4 81 B13R1.45 C[C@H](O)CNC(=O)c1ccccc1 Amb27446628 [1,0,0,0,0,0|2,0,0]=3 82 B13R1.45 C[C@H](O)CNC(=O)c1ccncc1 Amb27812527 [1,0,0,0,0,0|3,0,0]=4 83 B13R1.45 C[C@H](O)\C=C\C(=O)c1ccccc1 Amb27409583 [1,0,0,0,0,0|1,0,1]=3 84 B13R1.45 C[N+](C)=C\C=C(/Cl)c1ccccc1 Amb27967091 [1,0,0,0,0,0|2,0,1]=4 85 B13R1.45 C\C(=C\NC(C)C)c1ccccc1 Amb28247065 [1,0,0,0,0,0|1,0,1]=3 86 B15R1.1350 CC(C)CC(=O)C(C#N)c1ccccc1 Amb8846804 [0,1,0,0,0,0|1,0,2]=4 87 B15R1.12293 CC(C)COC(C(=O)O)c1ccccc1 Amb6261519 [0,1,0,0,0,0|1,0,1]=3 88 B15R2.6 CC(Br)CCc1coc2ccccc12 Amb35704104 [0,0,0,1,0,0|1,0,2]=4 89 B15R2.6 CC(C)CCn1cnc2ccccc21 Amb355762 [0,0,0,1,0,0|2,0,1]=4 90 B15R2.6 CC(C)CNc1noc2ccccc12 Amb28410138 [0,0,0,1,0,0|2,0,1]=4 91 B15R2.6 CC(C)CNc1nsc2ccccc12 Amb24347307 [0,0,0,1,0,0|2,1,0]=4 92 B15R2.6 CC(C)CNc1snc2ccccc12 Amb27595719 [0,0,0,1,0,0|3,0,0]=4 93 B15R2.6 CC(C)NCc1coc2ccccc12 Amb19649833 [0,0,0,1,0,0|1,0,2]=4 94 B15R2.6 CC(C)NCc1csc2ccccc12 Amb19649474 [0,0,0,1,0,0|1,1,1]=4 95 B15R2.6 CC(Cl)\C=C\c1csc2ccccc12 Amb27397189 [0,0,0,1,0,0|1,1,1]=4 96 B15R2.6 CC(N)CCc1csc2ccccc12 Amb26597936 [0,0,0,1,0,0|1,1,1]=4 97 B15R2.6 CC(N)\C=C\c1coc2ccccc12 Amb27629946 [0,0,0,1,0,0|1,0,2]=4 98 B15R2.6 CC(N)\C=C\c1csc2ccccc12 Amb33475313 [0,0,0,1,0,0|1,1,1]=4 99 B15R2.6 CC(O)CCc1csc2ccccc12 Amb24401820 [0,0,0,1,0,0|1,1,1]=4 100 B15R2.6 CN(C)CCc1csc2ccccc12 Amb27841437 [0,0,0,1,0,0|1,1,1]=4 101 B15R2.6 C[C@@H](N)CCc1csc2ccccc12 Amb33312709 [0,0,0,1,0,0|1,1,1]=4 102 B15R2.6 C[C@@H](O)CCc1csc2ccccc12 Amb33312710 [0,0,0,1,0,0|1,1,1]=4 103 B15R2.6 C[C@H](N)CCc1csc2ccccc12 Amb33312708 [0,0,0,1,0,0|1,1,1]=4 104 B15R2.6 C[C@H](O)CCc1csc2ccccc12 Amb33225760 [0,0,0,1,0,0|1,1,1]=4 105 B15R2.59 CC(C)C1CNC(c2ccccc2)=N1 Amb27659425 [0,0,0,1,0,0|3,0,0]=4 106 B15R2.59 CC(C)C1NC(c2ccccc2)=NO1 Amb10587229 [0,0,0,1,0,0|2,0,1]=4 107 B15R2.59 CC(C)c1ccc(-c2ccccc2)o1 Amb22749609 [0,0,0,1,0,0|2,0,1]=4 108 B15R2.59 CC(C)c1nc(-c2ccccc2)cs1 Amb28409406 [0,0,0,1,0,0|1,1,1]=4 109 B15R2.59 CC(C)n1cc(-c2ccccn2)cn1 Amb4559053 [0,0,0,1,0,0|3,0,0]=4 110 B15R2.59 CC(C)n1cc(-c2ccncc2)cn1 Amb4559052 [0,0,0,1,0,0|3,0,0]=4 111 B15R2.59 C[C@@H](N)c1cc(-c2ccccc2)cs1 Amb27957448 [0,0,0,1,0,0|1,1,1]=4 112 B15R2.389 CC1=CC(=O)C(c2ccccc2)=CN1 Amb25983773 [0,0,0,1,0,0|1,0,2]=4 113 B15R2.389 CC1CC=C(c2ccccc2)C(=S)N1 Amb749441 [0,0,0,1,0,0|1,1,0]=3 114 B15R2.389 CC1CN=C(c2ccccc2)C(=O)N1 Amb27794898 [0,0,0,1,0,0|2,0,0]=3 115 B15R2.389 CN1CC=C(c2ccccc2)C(Cl)C1 Amb27625687 [0,0,0,1,0,0|2,0,1]=4 116 B15R2.389 NC1CCN(c2ccccc2)C(=O)C1 Amb27147611 [0,0,0,1,0,0|2,0,1]=4 117 B15R2.467 BrC1(I)C=CC(c2ccccc2)=CC1 Amb27234874 [0,0,0,1,0,0|3,0,0]=4 118 B15R2.467 CC1(C)CN=C(c2ccccc2)NC1 Amb4007672 [0,0,0,1,0,0|3,0,0]=4 119 B15R2.467 CC1(C)CNC(c2ccccc2)=NO1 Amb28186523 [0,0,0,1,0,0|2,0,1]=4 120 B15R2.7373 CC(C)NC1=C(c2ccccc2)C1=O Amb27851418 [0,0,0,1,0,0|1,0,0]=2 121 B15R2.7383 CC1(C)NCN(c2ccccc2)C1=O Amb25048404 [0,0,0,1,0,0|2,0,1]=4 122 B15R2.7383 CC1(O)NC=C(c2ccccc2)C1=O Amb27606356 [0,0,0,1,0,0|2,0,0]=3 123 B15R2.39201 CC(=O)n1cc(C=O)c2ccccc21 Amb1981177 [0,0,0,1,0,0|2,0,1]=4 124 B15R2.39201 CC(C)c1nc(C=O)c2ccccn12 Amb17052774 [0,0,0,1,0,0|2,0,1]=4 125 B15R2.39201 CC(C)n1cc(C#N)c2ccccc21 Amb23441451 [0,0,0,1,0,0|2,0,1]=4 126 B15R2.39201 CC(C)n1cc(C=O)c2ccccc21 Amb6336180 [0,0,0,1,0,0|1,0,0]=2 127 B15R2.39201 CC(C)n1cc(CO)c2ccccc21 Amb837437 [0,0,0,1,0,0|1,0,2]=4 128 B15R2.39201 CC(C)n1nc(C=O)c2ccccc21 Amb33512399 [0,0,0,1,0,0|2,0,0]=3 129 B15R2.39201 O=Cc1cn(C(F)F)c2ccccc12 Amb25319383 [0,0,0,1,0,0|3,0,0]=4 130 B15R2.89224 CC1(C)CC=C(C#N)c2ccccc21 Amb17234020 [0,0,0,1,0,0|1,0,1]=3 131 B15R2.89224 CC1(C)NC=C(C#N)c2ccccc21 Amb27749307 [0,0,0,1,0,0|2,0,1]=4 132 B13R1.713 CC(C)CC(C#N)c1ccccc1 Amb4017632 [0,0,0,0,1,0|1,0,2]=4 133 B13R1.713 CC(C)CC(C=O)c1ccccc1 Amb33362241 [0,0,0,0,1,0|0,0,1]=2 134 B13R1.713 CC(C)CC(CBr)c1ccccc1 Amb17255495 [0,0,0,0,1,0|1,0,2]=4 135 B13R1.713 CC(C)CC(CCl)c1ccccc1 Amb17236522 [0,0,0,0,1,0|1,0,2]=4 136 B13R1.713 CC(C)CC(CN)c1ccccc1 Amb8950167 [0,0,0,0,1,0|1,0,2]=4 137 B13R1.713 CC(C)CC(CO)c1ccccc1 Amb17233456 [0,0,0,0,1,0|0,0,3]=4 138 B13R1.713 CC(C)N\C(=N\O)c1ccccc1 Amb27790804 [0,0,0,0,1,0|2,0,1]=4 139 B13R1.713 CC(C)OC(C=O)c1ccccc1 Amb32661039 [0,0,0,0,1,0|1,0,1]=3 140 B13R1.713 CC(C)\C=C(/C#N)c1ccccc1 Amb17232821 [0,0,0,0,1,0|1,0,1]=3 141 B13R1.713 CC(C)\C=C(/C=O)c1ccccc1 Amb21618696 [0,0,0,0,1,0|0,0,0]=1 142 B13R1.713 CC(C)\C=C(\C#N)c1ccccc1 Amb27776902 [0,0,0,0,1,0|1,0,1]=3 143 B13R1.713 CC(O)C\C(=N\O)c1ccccc1 Amb27753088 [0,0,0,0,1,0|2,0,1]=4 144 B13R1.713 CCN(CC(C)C)c1ccccc1 Amb17233317 [0,0,0,0,1,0|2,0,1]=4 145 B13R1.713 CC\C(=C\C(C)O)c1ccccc1 Amb27443422 [0,0,0,0,1,0|2,0,1]=4 146 B13R1.713 CC\C(=C\[C@@H](C)O)c1ccccc1 Amb27757403 [0,0,0,0,1,0|2,0,1]=4 147 B13R1.713 CN(C)\C=C(/C#N)c1ccccc1 Amb18540688 [0,0,0,0,1,0|2,0,1]=4 148 B13R1.713 CN(C)\C=C(/C=O)c1ccccc1 Amb17335056 [0,0,0,0,1,0|1,0,0]=2 149 B13R1.713 CN(C)\C=C(/C=O)c1ccccn1 Amb27849856 [0,0,0,0,1,0|2,0,0]=3 150 B13R1.713 CN(C)\C=C(\C#N)c1ccccc1 Amb2414238 [0,0,0,0,1,0|2,0,1]=4 151 B13R1.713 CN(C)\C=C(\C=O)c1ccccc1 Amb24712659 [0,0,0,0,1,0|1,0,0]=2 152 B13R1.713 CN(C)\C=C(\C=O)c1cccnc1 Amb24550072 [0,0,0,0,1,0|2,0,0]=3 153 B13R1.713 CN(C)\N=C(\C=O)c1ccccc1 Amb28457462 [0,0,0,0,1,0|2,0,0]=3 154 B13R1.713 CN\C(=C\N(C)C)c1ccccc1 Amb27597621 [0,0,0,0,1,0|3,0,0]=4 155 B13R1.713 C\C=C(\CC(C)N)c1ccccc1 Amb27607649 [0,0,0,0,1,0|2,0,0]=3 156 B13R1.713 O=C\C(=C/C(=O)O)c1ccccc1 Amb27179165 [0,0,0,0,1,0|2,0,1]=4 157 B12R1.3 C=C\C(=C/CCl)c1ccccc1 Amb27865659 [2,0,0,0,0,0|2,0,0]=4 158 B12R1.3 CCCC(C=O)c1ccccc1 Amb17594046 [2,0,0,0,0,0|0,0,1]=3 159 B12R1.3 CCC\C(=N\N)c1ccccc1 Amb27649935 [2,0,0,0,0,0|2,0,0]=4 160 B12R1.3 CCC\C(=N\O)c1ccccc1 Amb27979178 [2,0,0,0,0,0|1,0,1]=4 161 B12R1.3 CCO\C(=C/Cl)c1ccccc1 Amb28365649 [2,0,0,0,0,0|2,0,0]=4 162 B12R1.3 CCO\C(=C\Cl)c1ccccc1 Amb28052050 [2,0,0,0,0,0|2,0,0]=4 163 B12R1.3 CC\C=C(/C#N)c1ccccc1 Amb17232217 [2,0,0,0,0,0|1,0,1]=4 164 B12R1.3 CC\C=C(\C=O)c1ccccc1 Amb10807890 [2,0,0,0,0,0|0,0,0]=2 165 B12R1.3 CO\C=C(/C=O)c1ccccc1 Amb18126326 [2,0,0,0,0,0|1,0,0]=3 166 B12R1.3 CO\N=C(/C=O)c1ccccc1 Amb10572536 [2,0,0,0,0,0|2,0,0]=4 167 B12R1.3 CO\N=C(\C=O)c1ccccc1 Amb27440030 [2,0,0,0,0,0|2,0,0]=4 168 B12R1.3 O=C\C(=C/NO)c1ccccc1 Amb17777667 [2,0,0,0,0,0|2,0,0]=4 169 B12R1.30 CC=C=CC(=O)c1ccccc1 Amb28144211 [2,0,0,0,0,0|0,0,2]=4 170 B12R1.30 CCCCC(=O)c1ccccc1 Amb4605998 [2,0,0,0,0,0|0,0,1]=3 171 B12R1.30 CCCCC(=O)c1ccccn1 Amb6301472 [2,0,0,0,0,0|1,0,1]=4 172 B12R1.30 CCCCC(=O)c1cccnc1 Amb10607964 [2,0,0,0,0,0|1,0,1]=4 173 B12R1.30 CCCCC(=O)c1ccncc1 Amb10573758 [2,0,0,0,0,0|1,0,1]=4 174 B12R1.30 CCCNC(=N)c1ccccc1 Amb23447119 [2,0,0,0,0,0|2,0,0]=4 175 B12R1.30 CCCNC(=O)c1ccccn1 Amb8330947 [2,0,0,0,0,0|2,0,0]=4 176 B12R1.30 CCCNC(=O)c1cccnc1 Amb3357738 [2,0,0,0,0,0|2,0,0]=4 177 B12R1.30 CCCOC(=O)c1ccccc1 Amb6357116 [2,0,0,0,0,0|1,0,0]=3 178 B12R1.30 CCCOC(=O)c1cccnc1 Amb1958081 [2,0,0,0,0,0|2,0,0]=4 179 B12R1.30 CCC\C=C(\N)c1ccccc1 Amb27965051 [2,0,0,0,0,0|1,0,0]=3 180 B12R1.30 CCC\C=C(\N)c1ccncc1 Amb28385666 [2,0,0,0,0,0|2,0,0]=4 181 B12R1.30 CCC\N=C(/C)c1ccccc1 Amb17779516 [2,0,0,0,0,0|1,0,1]=4 182 B12R1.30 CCN\C=C(/N)c1ccccc1 Amb27668811 [2,0,0,0,0,0|2,0,0]=4 183 B12R1.30 CCOCC(=O)c1ccccc1 Amb9666077 [2,0,0,0,0,0|1,0,1]=4 184 B12R1.30 CCONC(=O)c1ccccc1 Amb10572541 [2,0,0,0,0,0|2,0,0]=4 185 B12R1.30 CCSCC(=O)c1ccccc1 Amb2778943 [2,0,0,0,0,0|1,0,1]=4 186 B12R1.30 CNCCC(=O)c1ccccc1 Amb11032366 [2,0,0,0,0,0|1,0,1]=4 187 B12R1.30 CNCCC(=O)c1ccccc1 Amb8390832 [2,0,0,0,0,0|1,0,1]=4 188 B12R1.30 CNCNC(=O)c1ccccc1 Amb27402677 [2,0,0,0,0,0|2,0,0]=4 189 B12R1.30 CNC\C=C(/C)c1ccccc1 Amb23555664 [2,0,0,0,0,0|1,0,1]=4 190 B12R1.30 CNC\C=C(\C)c1ccccc1 Amb27963918 [2,0,0,0,0,0|1,0,1]=4 191 B12R1.30 CN\C=C/C(=O)c1ccccc1 Amb2386631 [2,0,0,0,0,0|1,0,1]=4 192 B12R1.30 COCCC(=O)c1ccccc1 Amb33538573 [2,0,0,0,0,0|1,0,1]=4 193 B12R1.30 CSCCC(=O)c1ccccc1 Amb32683163 [2,0,0,0,0,0|1,0,1]=4 194 B12R1.30 CSCNC(=O)c1ccccc1 Amb28208358 [2,0,0,0,0,0|2,0,0]=4 195 B12R1.30 CS\C=C\C(=O)c1ccccc1 Amb27973048 [2,0,0,0,0,0|1,0,1]=4 196 B12R1.30 C\C(=C/CCBr)c1ccccc1 Amb17246875 [2,0,0,0,0,0|1,0,1]=4 197 B12R1.30 C\C(=C/CCCl)c1ccccc1 Amb17233775 [2,0,0,0,0,0|1,0,1]=4 198 B12R1.30 C\C(=C/CCN)c1ccccc1 Amb17232384 [2,0,0,0,0,0|1,0,1]=4 199 B12R1.30 C\C(=C/CCO)c1ccccc1 Amb28421884 [2,0,0,0,0,0|1,0,1]=4 200 B12R1.30 C\C(=C\CCN)c1ccccc1 Amb27453270 [2,0,0,0,0,0|1,0,1]=4 201 B12R1.30 C\C(=C\CCO)c1ccccc1 Amb27840638 [2,0,0,0,0,0|1,0,1]=4 202 B12R1.30 NCCCC(=O)c1ccccc1 Amb18623671 [2,0,0,0,0,0|1,0,1]=4 203 B12R1.30 NCCNC(=O)c1ccccc1 Amb302802 [2,0,0,0,0,0|2,0,0]=4 204 B12R1.30 NCCNC(=O)c1ccccc1 Amb6662646 [2,0,0,0,0,0|2,0,0]=4 205 B12R1.30 NCCOC(=O)c1ccccc1 Amb10807731 [2,0,0,0,0,0|2,0,0]=4 206 B12R1.30 NCCSC(=O)c1ccccc1 Amb3987898 [2,0,0,0,0,0|2,0,0]=4 207 B12R1.30 O=C(CCCBr)c1ccccc1 Amb17247624 [2,0,0,0,0,0|1,0,1]=4 208 B12R1.30 O=C(CCCCl)c1ccccc1 Amb1229841 [2,0,0,0,0,0|1,0,1]=4 209 B12R1.30 O=C(CCCO)c1ccccc1 Amb17334609 [2,0,0,0,0,0|1,0,1]=4 210 B12R1.30 O=C(NCCCl)c1ccccc1 Amb2414312 [2,0,0,0,0,0|2,0,0]=4 211 B12R1.30 O=C(NCCI)c1ccccc1 Amb22753771 [2,0,0,0,0,0|2,0,0]=4 212 B12R1.30 O=C(NCCO)c1ccccc1 Amb4318140 [2,0,0,0,0,0|2,0,0]=4 213 B12R1.30 O=C(NCCS)c1ccccc1 Amb26616512 [2,0,0,0,0,0|2,0,0]=4 214 B12R1.30 O=C(OCCCl)c1ccccc1 Amb385414 [2,0,0,0,0,0|2,0,0]=4 215 B12R1.30 O=C(OCCO)c1ccccc1 Amb1110468 [2,0,0,0,0,0|2,0,0]=4 216 B12R1.30 O=C(\C=C\CCl)c1ccccc1 Amb27983598 [2,0,0,0,0,0|1,0,1]=4 217 B12R1.252 CC(=O)C\C=C\c1ccccc1 Amb24740083 [2,0,0,0,0,0|1,0,1]=4 218 B12R1.252 CC(Br)C\C=C\c1ccccc1 Amb33080969 [2,0,0,0,0,0|1,0,0]=3 219 B12R1.252 CC(C)=C\C=C\c1ccccc1 Amb28143072 [2,0,0,0,0,0|0,0,2]=4 220 B12R1.252 CC(C)CC#Cc1ccccc1 Amb27494575 [2,0,0,0,0,0|0,0,2]=4 221 B12R1.252 CC(C)CCNc1ccccc1 Amb4016589 [2,0,0,0,0,0|1,0,1]=4 222 B12R1.252 CC(C)CCOc1ccccc1 Amb23450363 [2,0,0,0,0,0|1,0,1]=4 223 B12R1.252 CC(C)CNCc1ccccc1 Amb22586944 [2,0,0,0,0,0|1,0,1]=4 224 B12R1.252 CC(C)CNCc1ccccc1 Amb6687359 [2,0,0,0,0,0|1,0,1]=4 225 B12R1.252 CC(C)C\C=C\c1ccccn1 Amb27661989 [2,0,0,0,0,0|1,0,0]=3 226 B12R1.252 CC(C)N\C=N\c1ccccc1 Amb27596734 [2,0,0,0,0,0|2,0,0]=4 227 B12R1.252 CC(N)C\C=C\c1ccccc1 Amb25970039 [2,0,0,0,0,0|1,0,0]=3 228 B12R1.252 CC(N)C\C=C\c1ccncc1 Amb24540248 [2,0,0,0,0,0|2,0,0]=4 229 B12R1.252 CC(O)C\C=C\c1ccccc1 Amb32954303 [2,0,0,0,0,0|1,0,0]=3 230 B12R1.252 CC(O)C\C=N\c1ccccc1 Amb27948769 [2,0,0,0,0,0|2,0,0]=4 231 B12R1.252 CN(O)C\C=C\c1ccccc1 Amb33081135 [2,0,0,0,0,0|2,0,0]=4 232 B12R1.252 C[C@@H](N)C\C=C\c1ccccc1 Amb33080763 [2,0,0,0,0,0|1,0,0]=3 233 B12R1.252 C[C@@H](O)C\C=C\c1ccccc1 Amb32954522 [2,0,0,0,0,0|1,0,0]=3 234 B12R1.252 C[C@H](N)C\C=C\c1ccccc1 Amb33080767 [2,0,0,0,0,0|1,0,0]=3 235 B12R1.252 C[C@H](O)C\C=C\c1ccccc1 Amb32954836 [2,0,0,0,0,0|1,0,0]=3 236 B14R1.178 CCCCC(C(=O)O)c1ccccc1 Amb13882286 [1,1,0,0,0,0|0,0,2]=4 237 B14R1.178 CCCOC(C(=O)O)c1ccccc1 Amb8874516 [1,1,0,0,0,0|1,0,1]=4 238 B14R1.149 CC(C)CCC(=O)c1cccc(Br)c1 Amb17264247 [1,1,0,0,0,0|0,0,1]=3 239 B14R1.149 CC(C)CCC(=O)c1cccc(Cl)c1 Amb17240762 [1,1,0,0,0,0|0,0,1]=3 240 B14R1.149 CC(C)CNC(=O)c1cc(Cl)ccn1 Amb8256774 [1,1,0,0,0,0|2,0,0]=4 241 B14R1.149 CC(C)CNC(=O)c1cccc(Br)c1 Amb2716540 [1,1,0,0,0,0|1,0,0]=3 242 B14R1.149 CC(C)CNC(=O)c1cccc(Cl)c1 Amb6347591 [1,1,0,0,0,0|1,0,0]=3 243 B14R1.149 CC(C)CNC(=O)c1cccc(F)n1 Amb27398524 [1,1,0,0,0,0|2,0,0]=4 244 B14R1.149 CC(C)CNC(=O)c1cccc(I)c1 Amb3889462 [1,1,0,0,0,0|1,0,0]=3 245 B14R1.149 CC(C)CNC(=O)c1cccc(N)c1 Amb1118281 [1,1,0,0,0,0|1,0,0]=3 246 B14R1.149 CC(C)CNC(=O)c1cccc(N)n1 Amb18296083 [1,1,0,0,0,0|2,0,0]=4 247 B14R1.149 CC(C)CNC(=O)c1cccc(O)c1 Amb6671604 [1,1,0,0,0,0|1,0,0]=3 248 B14R1.149 CC(C)CNC(=O)c1cccc(S)c1 Amb27652621 [1,1,0,0,0,0|1,0,0]=3 249 B14R1.149 CC(C)CNC(=O)c1ccnc(F)c1 Amb19043628 [1,1,0,0,0,0|2,0,0]=4 250 B14R1.149 CC(C)CNC(=O)c1ccnc(N)c1 Amb18986870 [1,1,0,0,0,0|2,0,0]=4 251 B14R1.149 CC(C)CNC(=O)c1cncc(Br)c1 Amb8240891 [1,1,0,0,0,0|2,0,0]=4 252 B14R1.149 CC(C)CNC(=O)c1cncc(F)c1 Amb27808216 [1,1,0,0,0,0|2,0,0]=4 253 B14R1.149 CC(C)CNC(=O)c1cncc(N)c1 Amb27649279 [1,1,0,0,0,0|2,0,0]=4 254 B14R1.149 CC(C)CNC(=O)c1cncc(O)c1 Amb27222191 [1,1,0,0,0,0|2,0,0]=4 255 B14R1.149 CC(C)COC(=O)c1cccc(N)c1 Amb17307668 [1,1,0,0,0,0|1,0,0]=3 256 B14R1.149 CC(C)COC(=O)c1cccc(O)c1 Amb17307714 [1,1,0,0,0,0|1,0,0]=3 257 B14R1.149 CC(C)NCC(=O)c1cccc(Cl)c1 Amb18866292 [1,1,0,0,0,0|1,0,1]=4 258 B14R1.149 CC(C)NCC(=O)c1cccc(F)c1 Amb18864001 [1,1,0,0,0,0|1,0,1]=4 259 B14R1.149 CC(C)NCC(=O)c1cccc(N)c1 Amb18550937 [1,1,0,0,0,0|1,0,1]=4 260 B14R1.149 CC(C)ONC(=O)c1cccc(Br)c1 Amb27226691 [1,1,0,0,0,0|2,0,0]=4 261 B14R1.149 CC(C)ONC(=O)c1cccc(I)c1 Amb27750159 [1,1,0,0,0,0|2,0,0]=4 262 B14R1.149 CC(C)SCC(=O)c1cccc(Br)c1 Amb32682838 [1,1,0,0,0,0|1,0,1]=4 263 B14R1.149 CC(C)SCC(=O)c1cccc(Cl)c1 Amb32682758 [1,1,0,0,0,0|1,0,1]=4 264 B14R1.149 CC(C)SCC(=O)c1cccc(F)c1 Amb32682880 [1,1,0,0,0,0|1,0,1]=4 265 B14R1.149 CC(Cl)CNC(=O)c1cccc(Br)c1 Amb27485094 [1,1,0,0,0,0|2,0,0]=4 266 B14R1.149 CC(Cl)CNC(=O)c1cccc(Cl)c1 Amb27589111 [1,1,0,0,0,0|2,0,0]=4 267 B14R1.149 CC(Cl)CNC(=O)c1cccc(O)c1 Amb27399193 [1,1,0,0,0,0|2,0,0]=4 268 B14R1.149 CC(N)CNC(=O)c1cccc(I)c1 Amb28244586 [1,1,0,0,0,0|2,0,0]=4 269 B14R1.149 CC(N)CNC(=O)c1cccc(N)c1 Amb28205831 [1,1,0,0,0,0|2,0,0]=4 270 B14R1.149 CC(O)CNC(=O)c1cccc(Br)c1 Amb8304014 [1,1,0,0,0,0|2,0,0]=4 271 B14R1.149 CC(O)CNC(=O)c1cccc(Cl)c1 Amb8248403 [1,1,0,0,0,0|2,0,0]=4 272 B14R1.149 CC(O)CNC(=O)c1cccc(F)c1 Amb1933083 [1,1,0,0,0,0|2,0,0]=4 273 B14R1.149 CC(O)CNC(=O)c1cccc(I)c1 Amb9244616 [1,1,0,0,0,0|2,0,0]=4 274 B14R1.149 CC(O)CNC(=O)c1cccc(O)c1 Amb9244596 [1,1,0,0,0,0|2,0,0]=4 275 B14R1.149 CN(C)CCC(=O)c1cccc(Br)c1 Amb8592823 [1,1,0,0,0,0|1,0,1]=4 276 B14R1.149 CN(C)CCC(=O)c1cccc(N)c1 Amb17226886 [1,1,0,0,0,0|1,0,1]=4 277 B14R1.149 CN(C)\C=C/C(=O)c1cccc(Cl)c1 Amb6889438 [1,1,0,0,0,0|1,0,1]=4 278 B14R1.149 CN(C)\C=C\C(=O)c1cccc(Br)c1 Amb33291218 [1,1,0,0,0,0|1,0,1]=4 279 B14R1.149 CN(C)\C=C\C(=O)c1cccc(Cl)c1 Amb2424321 [1,1,0,0,0,0|1,0,1]=4 280 B14R1.149 CN(C)\C=C\C(=O)c1cccc(F)c1 Amb2736231 [1,1,0,0,0,0|1,0,1]=4 281 B14R1.149 CN(C)\C=C\C(=O)c1cccc(N)c1 Amb27259365 [1,1,0,0,0,0|1,0,1]=4 282 B14R1.149 C[C@@H](O)CNC(=O)c1cccc(Br)c1 Amb27437268 [1,1,0,0,0,0|2,0,0]=4 283 B14R1.149 C[C@@H](O)CNC(=O)c1cccc(F)c1 Amb27208842 [1,1,0,0,0,0|2,0,0]=4 284 B14R1.149 C[C@@H](O)CNC(=O)c1cccc(N)c1 Amb28280389 [1,1,0,0,0,0|2,0,0]=4 285 B14R1.149 C[C@@H](O)CNC(=O)c1cccc(O)c1 Amb27388164 [1,1,0,0,0,0|2,0,0]=4 286 B14R1.149 Cc1cccc(C(=O)CCC(C)C)c1 Amb17234948 [1,1,0,0,0,0|0,0,1]=3 287 B14R1.149 Cc1cccc(C(=O)CNC(C)C)c1 Amb18863635 [1,1,0,0,0,0|1,0,1]=4 288 B14R1.149 Cc1cccc(C(=O)CSC(C)C)c1 Amb32682844 [1,1,0,0,0,0|1,0,1]=4 289 B14R1.149 Cc1cccc(C(=O)NCC(C)Br)c1 Amb28206561 [1,1,0,0,0,0|2,0,0]=4 290 B14R1.149 Cc1cccc(C(=O)NCC(C)C)c1 Amb2660563 [1,1,0,0,0,0|1,0,0]=3 291 B14R1.149 Cc1cccc(C(=O)NCC(C)C)n1 Amb10707932 [1,1,0,0,0,0|2,0,0]=4 292 B14R1.149 Cc1cccc(C(=O)NCC(C)O)c1 Amb9244680 [1,1,0,0,0,0|2,0,0]=4 293 B14R1.149 Cc1cccc(C(=O)OCC(C)C)c1 Amb17509521 [1,1,0,0,0,0|1,0,0]=3 294 B14R1.149 Cc1cccc(C(=O)\C=C\N(C)C)c1 Amb20619054 [1,1,0,0,0,0|1,0,1]=4 295 B14R1.160 CC(Br)CNC(=O)c1ccccc1Br Amb27587908 [1,1,0,0,0,0|2,0,0]=4 296 B14R1.160 CC(Br)CNC(=O)c1ccccc1O Amb27656843 [1,1,0,0,0,0|2,0,0]=4 297 B14R1.160 CC(C)CCC(=O)c1ccccc1Cl Amb10562656 [1,1,0,0,0,0|0,0,1]=3 298 B14R1.160 CC(C)CCC(=O)c1ccccc1F Amb17235949 [1,1,0,0,0,0|0,0,1]=3 299 B14R1.160 CC(C)CNC(=O)C1=CNC=CC1=O Amb28046953 [1,1,0,0,0,0|2,0,0]=4 300 B14R1.160 CC(C)CNC(=O)c1ccccc1Br Amb6339543 [1,1,0,0,0,0|1,0,0]=3 301 B14R1.160 CC(C)CNC(=O)c1ccccc1F Amb6347610 [1,1,0,0,0,0|1,0,0]=3 302 B14R1.160 CC(C)CNC(=O)c1ccccc1I Amb6397344 [1,1,0,0,0,0|1,0,0]=3 303 B14R1.160 CC(C)CNC(=O)c1ccccc1N Amb1105963 [1,1,0,0,0,0|1,0,0]=3 304 B14R1.160 CC(C)CNC(=O)c1cccnc1Cl Amb6530723 [1,1,0,0,0,0|2,0,0]=4 305 B14R1.160 CC(C)CNC(=O)c1cccnc1N Amb18295537 [1,1,0,0,0,0|2,0,0]=4 306 B14R1.160 CC(C)CNC(=O)c1ccncc1Cl Amb28125330 [1,1,0,0,0,0|2,0,0]=4 307 B14R1.160 CC(C)CNC(=O)c1cnccc1Cl Amb27203825 [1,1,0,0,0,0|2,0,0]=4 308 B14R1.160 CC(C)CNC(=O)c1ncccc1N Amb27611845 [1,1,0,0,0,0|2,0,0]=4 309 B14R1.160 CC(C)CNC(=O)c1ncccc1O Amb19051538 [1,1,0,0,0,0|2,0,0]=4 310 B14R1.160 CC(C)COC(=O)c1ccccc1N Amb2688908 [1,1,0,0,0,0|1,0,0]=3 311 B14R1.160 CC(C)COC(=O)c1ccccc1O Amb4016371 [1,1,0,0,0,0|1,0,0]=3 312 B14R1.160 CC(C)NCC(=O)c1ccccc1Cl Amb18866291 [1,1,0,0,0,0|1,0,1]=4 313 B14R1.160 CC(C)NCC(=O)c1ccccc1F Amb18864000 [1,1,0,0,0,0|1,0,1]=4 314 B14R1.160 CC(C)ONC(=O)c1ccccc1N Amb27434116 [1,1,0,0,0,0|2,0,0]=4 315 B14R1.160 CC(C)SCC(=O)c1ccccc1Br Amb32682902 [1,1,0,0,0,0|1,0,1]=4 316 B14R1.160 CC(C)SCC(=O)c1ccccc1Cl Amb32682872 [1,1,0,0,0,0|1,0,1]=4 317 B14R1.160 CC(C)SCC(=O)c1ccccc1F Amb32682905 [1,1,0,0,0,0|1,0,1]=4 318 B14R1.160 CC(N)CNC(=O)c1ccccc1Cl Amb18112224 [1,1,0,0,0,0|2,0,0]=4 319 B14R1.160 CC(N)CNC(=O)c1ccccc1I Amb27417228 [1,1,0,0,0,0|2,0,0]=4 320 B14R1.160 CC(O)CNC(=O)c1ccccc1Br Amb8253227 [1,1,0,0,0,0|2,0,0]=4 321 B14R1.160 CC(O)CNC(=O)c1ccccc1Cl Amb8253230 [1,1,0,0,0,0|2,0,0]=4 322 B14R1.160 CC(O)CNC(=O)c1ccccc1F Amb9244829 [1,1,0,0,0,0|2,0,0]=4 323 B14R1.160 CC(O)CNC(=O)c1ccccc1I Amb9244832 [1,1,0,0,0,0|2,0,0]=4 324 B14R1.160 CC(O)CNC(=O)c1ccccc1O Amb9244597 [1,1,0,0,0,0|2,0,0]=4 325 B14R1.160 CN(C)CCC(=O)c1ccccc1Cl Amb24119356 [1,1,0,0,0,0|1,0,1]=4 326 B14R1.160 CN(C)CCC(=O)c1ccccc1N Amb17226887 [1,1,0,0,0,0|1,0,1]=4 327 B14R1.160 CN(C)CCC(=O)c1ccccc1O Amb17595060 [1,1,0,0,0,0|1,0,1]=4 328 B14R1.160 CN(C)\C=C\C(=O)c1ccccc1Br Amb33291124 [1,1,0,0,0,0|1,0,1]=4 329 B14R1.160 CN(C)\C=C\C(=O)c1ccccc1Cl Amb19651245 [1,1,0,0,0,0|1,0,1]=4 330 B14R1.160 CN(C)\C=C\C(=O)c1ccccc1F Amb2427777 [1,1,0,0,0,0|1,0,1]=4 331 B14R1.160 CN(C)\C=C\C(=O)c1ccccc1O Amb31282730 [1,1,0,0,0,0|1,0,1]=4 332 B14R1.160 C[C@@H](O)CNC(=O)c1ccccc1Br Amb28125006 [1,1,0,0,0,0|2,0,0]=4 333 B14R1.160 C[C@H](N)CNC(=O)c1ccccc1O Amb27858876 [1,1,0,0,0,0|2,0,0]=4 334 B14R1.160 C[C@H](O)CNC(=O)c1ccccc1Br Amb27394953 [1,1,0,0,0,0|2,0,0]=4 335 B14R1.160 Cc1ccccc1C(=O)CCC(C)C Amb17234944 [1,1,0,0,0,0|0,0,1]=3 336 B14R1.160 Cc1ccccc1C(=O)CNC(C)C Amb18224858 [1,1,0,0,0,0|1,0,1]=4 337 B14R1.160 Cc1ccccc1C(=O)CSC(C)C Amb32682822 [1,1,0,0,0,0|1,0,1]=4 338 B14R1.160 Cc1ccccc1C(=O)NCC(C)Br Amb27587909 [1,1,0,0,0,0|2,0,0]=4 339 B14R1.160 Cc1ccccc1C(=O)NCC(C)C Amb6410939 [1,1,0,0,0,0|1,0,0]=3 340 B14R1.160 Cc1ccccc1C(=O)NCC(C)O Amb9244643 [1,1,0,0,0,0|2,0,0]=4 341 B14R1.160 Cc1ccccc1C(=O)NC[C@@H](C)O Amb27482191 [1,1,0,0,0,0|2,0,0]=4 342 B14R1.160 Cc1ccccc1C(=O)NNC(C)C Amb28343917 [1,1,0,0,0,0|2,0,0]=4 343 B14R1.160 Cc1ccccc1C(=O)\C=C\N(C)C Amb33291107 [1,1,0,0,0,0|1,0,1]=4 344 B14R1.160 Cc1ccncc1C(=O)CCC(C)C Amb32674682 [1,1,0,0,0,0|1,0,1]=4 345 B14R1.160 Cc1ccncc1C(=O)NCC(C)C Amb35706279 [1,1,0,0,0,0|2,0,0]=4 346 B14R1.160 Cc1ncccc1C(=O)NCC(C)C Amb27878930 [1,1,0,0,0,0|2,0,0]=4 347 B14R1.163 C=CC(C)CNC(=O)c1ccccc1 Amb24072038 [1,1,0,0,0,0|1,0,1]=4 348 B14R1.163 CC(C#N)CNC(=O)c1ccccc1 Amb18327633 [1,1,0,0,0,0|1,0,1]=4 349 B14R1.163 CC(CNC(=O)c1ccccc1)ON Amb17139465 [1,1,0,0,0,0|2,0,0]=4 350 B14R1.163 CC(CO)SCC(=O)c1ccccc1 Amb32682804 [1,1,0,0,0,0|1,0,1]=4 351 B14R1.163 CCC(Br)CCC(=O)c1ccccc1 Amb24079098 [1,1,0,0,0,0|1,0,1]=4 352 B14R1.163 CCC(C)COC(=O)c1ccccc1 Amb9787606 [1,1,0,0,0,0|1,0,0]=3 353 B14R1.163 CCC(C)SCC(=O)c1ccccc1 Amb9269103 [1,1,0,0,0,0|1,0,1]=4 354 B14R1.163 O=C(NCC(O)CCl)c1ccccc1 Amb17595793 [1,1,0,0,0,0|2,0,0]=4 355 B14R1.163 O=C(OCC(O)CO)c1ccccc1 Amb538218 [1,1,0,0,0,0|2,0,0]=4 356 B14R1.415 CC(Br)C(C)NC(=O)c1ccccc1 Amb28069119 [1,1,0,0,0,0|2,0,0]=4 357 B14R1.415 CC(C)C(=O)CC(=O)c1ccccc1 Amb5399070 [1,1,0,0,0,0|0,0,2]=4 358 B14R1.415 CC(C)C(=S)NC(=O)c1ccccc1 Amb28077014 [1,1,0,0,0,0|1,0,1]=4 359 B14R1.415 CC(C)C(C)NC(=N)c1ccccc1 Amb28122582 [1,1,0,0,0,0|2,0,0]=4 360 B14R1.415 CC(C)[C@@H](C)NC(=O)c1ccccc1 Amb27793492 [1,1,0,0,0,0|1,0,0]=3 361 B14R1.415 CC(C)[C@H](C)NC(=O)c1ccccc1 Amb28185825 [1,1,0,0,0,0|1,0,0]=3 362 B14R1.415 CC(N)C(C)NC(=O)c1ccccc1 Amb28054243 [1,1,0,0,0,0|2,0,0]=4 363 B14R1.415 C\C(=C/C(=O)c1ccccc1)N(C)C Amb6384170 [1,1,0,0,0,0|1,0,1]=4 364 B14R1.415 C\C(=C\C(O)C(C)C)c1ccccc1 Amb28455107 [1,1,0,0,0,0|0,0,1]=3 365 B14R1.417 C=C(C(=O)NC(C)C)c1ccccc1 Amb27798349 [1,1,0,0,0,0|1,0,0]=3 366 B14R1.417 CC(C)CC(=O)N(N)c1ccccc1 Amb33191337 [1,1,0,0,0,0|2,0,0]=4 367 B14R1.417 CC(C)CC(N)C(=O)c1ccccc1 Amb17139320 [1,1,0,0,0,0|0,0,1]=3 368 B14R1.417 CC(C)CC(N)C(=O)c1ccccn1 Amb18565134 [1,1,0,0,0,0|1,0,1]=4 369 B14R1.417 CC(C)CC(N)C(=O)c1cccnc1 Amb18565140 [1,1,0,0,0,0|1,0,1]=4 370 B14R1.417 CC(C)CC(N)C(=O)c1ccncc1 Amb18565146 [1,1,0,0,0,0|1,0,1]=4 371 B14R1.417 CC(C)NC(=O)C(=O)c1ccccc1 Amb17336309 [1,1,0,0,0,0|1,0,0]=3 372 B14R1.417 CC(C)SC(C)C(=O)c1ccccc1 Amb32683184 [1,1,0,0,0,0|1,0,1]=4 373 B14R1.417 CC(C)\C=C(/Cl)C(=O)c1ccccc1 Amb28135396 [1,1,0,0,0,0|0,0,1]=3 374 B14R1.417 CC(C)\C=C(\Cl)C(=O)c1ccccc1 Amb27444800 [1,1,0,0,0,0|0,0,1]=3 375 B14R1.417 CC(CN(C)C)C(=O)c1ccccc1 Amb2228745 [1,1,0,0,0,0|1,0,1]=4 376 B14R1.417 CC(CN(C)C)C(=O)c1ccccc1 Amb3940648 [1,1,0,0,0,0|1,0,1]=4 377 B14R1.417 CC(Cl)CC(Cl)C(=O)c1ccccc1 Amb16231695 [1,1,0,0,0,0|1,0,1]=4 378 B14R1.678 CC(C)CCC(=O)c1ccc(Br)cc1 Amb8850491 [1,1,0,0,0,0|0,0,1]=3 379 B14R1.678 CC(C)CCC(=O)c1ccc(Cl)cc1 Amb9214259 [1,1,0,0,0,0|0,0,1]=3 380 B14R1.678 CC(C)CCC(=O)c1ccc(F)cc1 Amb8849983 [1,1,0,0,0,0|0,0,1]=3 381 B14R1.678 CC(C)CCC(=O)c1ccc(N)cc1 Amb17139328 [1,1,0,0,0,0|0,0,1]=3 382 B14R1.678 CC(C)CNC(=O)C1=CNC(=O)C=C1 Amb19079976 [1,1,0,0,0,0|2,0,0]=4 383 B14R1.678 CC(C)CNC(=O)c1ccc(Br)cc1 Amb6342182 [1,1,0,0,0,0|1,0,0]=3 384 B14R1.678 CC(C)CNC(=O)c1ccc(Cl)cc1 Amb2660624 [1,1,0,0,0,0|1,0,0]=3 385 B14R1.678 CC(C)CNC(=O)c1ccc(Cl)nc1 Amb6248948 [1,1,0,0,0,0|2,0,0]=4 386 B14R1.678 CC(C)CNC(=O)c1ccc(F)cc1 Amb6347634 [1,1,0,0,0,0|1,0,0]=3 387 B14R1.678 CC(C)CNC(=O)c1ccc(I)cc1 Amb1883594 [1,1,0,0,0,0|1,0,0]=3 388 B14R1.678 CC(C)CNC(=O)c1ccc(N)cc1 Amb1112934 [1,1,0,0,0,0|1,0,0]=3 389 B14R1.678 CC(C)CNC(=O)c1ccc(N)cn1 Amb26594001 [1,1,0,0,0,0|2,0,0]=4 390 B14R1.678 CC(C)CNC(=O)c1ccc(S)cc1 Amb28349902 [1,1,0,0,0,0|1,0,0]=3 391 B14R1.678 CC(C)CNC(=S)c1ccc(Cl)cc1 Amb28367472 [1,1,0,0,0,0|1,1,0]=4 392 B14R1.678 CC(C)CNS(=O)c1ccc(N)cc1 Amb18866354 [1,1,0,0,0,0|2,0,0]=4 393 B14R1.678 CC(C)COC(=O)c1ccc(N)cc1 Amb6358484 [1,1,0,0,0,0|1,0,0]=3 394 B14R1.678 CC(C)COC(=O)c1ccc(O)cc1 Amb2111930 [1,1,0,0,0,0|1,0,0]=3 395 B14R1.678 CC(C)NCC(=O)c1ccc(N)cc1 Amb18550892 [1,1,0,0,0,0|1,0,1]=4 396 B14R1.678 CC(C)SCC(=O)c1ccc(Br)cc1 Amb17198922 [1,1,0,0,0,0|1,0,1]=4 397 B14R1.678 CC(C)SCC(=O)c1ccc(Cl)cc1 Amb17198812 [1,1,0,0,0,0|1,0,1]=4 398 B14R1.678 CC(C)SCC(=O)c1ccc(F)cc1 Amb17198967 [1,1,0,0,0,0|1,0,1]=4 399 B14R1.678 CC(C)SCC(=O)c1ccc(I)cc1 Amb32682786 [1,1,0,0,0,0|1,0,1]=4 400 B14R1.678 CC(C)SCC(=O)c1ccc(N)cc1 Amb17202005 [1,1,0,0,0,0|1,0,1]=4 401 B14R1.678 CC(C)SCC(=O)c1ccc(O)cc1 Amb32683127 [1,1,0,0,0,0|1,0,1]=4 402 B14R1.678 CC(Cl)CNC(=O)c1ccc(Br)cc1 Amb28454291 [1,1,0,0,0,0|2,0,0]=4 403 B14R1.678 CC(Cl)CNC(=O)c1ccc(O)cc1 Amb28190602 [1,1,0,0,0,0|2,0,0]=4 404 B14R1.678 CC(N)CNC(=O)c1ccc(Br)cc1 Amb18112182 [1,1,0,0,0,0|2,0,0]=4 405 B14R1.678 CC(N)CNC(=O)c1ccc(Cl)cc1 Amb18112307 [1,1,0,0,0,0|2,0,0]=4 406 B14R1.678 CC(N)CNC(=O)c1ccc(I)cc1 Amb28122737 [1,1,0,0,0,0|2,0,0]=4 407 B14R1.678 CC(O)CNC(=O)c1ccc(Br)cc1 Amb8271051 [1,1,0,0,0,0|2,0,0]=4 408 B14R1.678 CC(O)CNC(=O)c1ccc(Cl)cc1 Amb8263835 [1,1,0,0,0,0|2,0,0]=4 409 B14R1.678 CC(O)CNC(=O)c1ccc(F)cc1 Amb9244595 [1,1,0,0,0,0|2,0,0]=4 410 B14R1.678 CC(O)CNC(=O)c1ccc(N)cc1 Amb9358629 [1,1,0,0,0,0|2,0,0]=4 411 B14R1.678 CC(O)CNC(=O)c1ccc(O)cc1 Amb9244590 [1,1,0,0,0,0|2,0,0]=4 412 B14R1.678 CN(C)CCC(=O)c1ccc(Br)cc1 Amb4314672 [1,1,0,0,0,0|1,0,1]=4 413 B14R1.678 CN(C)CCC(=O)c1ccc(Cl)cc1 Amb3429032 [1,1,0,0,0,0|1,0,1]=4 414 B14R1.678 CN(C)CCC(=O)c1ccc(Cl)cc1 Amb4314688 [1,1,0,0,0,0|1,0,1]=4 415 B14R1.678 CN(C)CCC(=O)c1ccc(F)cc1 Amb594296 [1,1,0,0,0,0|1,0,1]=4 416 B14R1.678 CN(C)CCC(=O)c1ccc(F)cc1 Amb9814667 [1,1,0,0,0,0|1,0,1]=4 417 B14R1.678 CN(C)CCC(=O)c1ccc(N)cc1 Amb17099131 [1,1,0,0,0,0|1,0,1]=4 418 B14R1.678 CN(C)CCC(=O)c1ccc(O)cc1 Amb2701586 [1,1,0,0,0,0|1,0,1]=4 419 B14R1.678 CN(C)\C=C/C(=O)c1ccc(Br)cc1 Amb1945734 [1,1,0,0,0,0|1,0,1]=4 420 B14R1.678 CN(C)\C=C/C(=O)c1ccc(Cl)cc1 Amb1945547 [1,1,0,0,0,0|1,0,1]=4 421 B14R1.678 CN(C)\C=C/C(=O)c1ccc(F)cc1 Amb6888586 [1,1,0,0,0,0|1,0,1]=4 422 B14R1.678 CN(C)\C=C\C(=O)c1ccc(Br)cc1 Amb34002070 [1,1,0,0,0,0|1,0,1]=4 423 B14R1.678 CN(C)\C=C\C(=O)c1ccc(Cl)cc1 Amb2414150 [1,1,0,0,0,0|1,0,1]=4 424 B14R1.678 CN(C)\C=C\C(=O)c1ccc(F)cc1 Amb33025402 [1,1,0,0,0,0|1,0,1]=4 425 B14R1.678 CN(C)\C=C\C(=O)c1ccc(I)cc1 Amb26494751 [1,1,0,0,0,0|1,0,1]=4 426 B14R1.678 C[C@@H](O)CNC(=O)c1ccc(Br)cc1 Amb27594966 [1,1,0,0,0,0|2,0,0]=4 427 B14R1.678 C[C@@H](O)CNC(=O)c1ccc(Cl)cc1 Amb27755622 [1,1,0,0,0,0|2,0,0]=4 428 B14R1.678 C[C@@H](O)CNC(=O)c1ccc(F)cc1 Amb27805837 [1,1,0,0,0,0|2,0,0]=4 429 B14R1.678 C[C@@H](O)CNC(=O)c1ccc(O)cc1 Amb27776010 [1,1,0,0,0,0|2,0,0]=4 430 B14R1.678 C[C@H](O)CNC(=O)c1ccc(O)cc1 Amb27241976 [1,1,0,0,0,0|2,0,0]=4 431 B14R1.678 Cc1ccc(C(=O)CCC(C)C)cc1 Amb8850971 [1,1,0,0,0,0|0,0,1]=3 432 B14R1.678 Cc1ccc(C(=O)CCN(C)C)cc1 Amb1007083 [1,1,0,0,0,0|1,0,1]=4 433 B14R1.678 Cc1ccc(C(=O)CSC(C)C)cc1 Amb32682765 [1,1,0,0,0,0|1,0,1]=4 434 B14R1.678 Cc1ccc(C(=O)NCC(C)C)cc1 Amb6361017 [1,1,0,0,0,0|1,0,0]=3 435 B14R1.678 Cc1ccc(C(=O)NCC(C)C)cn1 Amb8332929 [1,1,0,0,0,0|2,0,0]=4 436 B14R1.678 Cc1ccc(C(=O)NCC(C)Cl)cc1 Amb28206562 [1,1,0,0,0,0|2,0,0]=4 437 B14R1.678 Cc1ccc(C(=O)NCC(C)O)cc1 Amb9244621 [1,1,0,0,0,0|2,0,0]=4 438 B14R1.678 Cc1ccc(C(=O)NC[C@H](C)O)cc1 Amb27812597 [1,1,0,0,0,0|2,0,0]=4 439 B14R1.678 Cc1ccc(C(=O)NOC(C)C)cc1 Amb28132214 [1,1,0,0,0,0|2,0,0]=4 440 B14R1.678 Cc1ccc(C(=O)\C=C/N(C)C)cc1 Amb1946247 [1,1,0,0,0,0|1,0,1]=4 441 B14R1.678 Cc1ccc(C(=O)\C=C\N(C)C)cc1 Amb2408463 [1,1,0,0,0,0|1,0,1]=4 442 B14R1.678 Cc1ccc(C(=S)NCC(C)C)cc1 Amb27394308 [1,1,0,0,0,0|1,1,0]=4 443 B14R1.678 Cc1ccc(\C(Br)=C/CN(C)C)cc1 Amb27209147 [1,1,0,0,0,0|2,0,0]=4 444 B14R1.678 Cc1ccc(\C(Br)=C\CN(C)C)cc1 Amb27238997 [1,1,0,0,0,0|2,0,0]=4 445 B14R1.3098 CC(C)(C)C#CC(=O)c1ccccc1 Amb8394381 [1,1,0,0,0,0|0,0,2]=4 446 B14R1.3098 CC(C)(C)CNC(=O)c1ccccn1 Amb27241231 [1,1,0,0,0,0|2,0,0]=4 447 B14R1.3098 CC(C)(C)OOC(=O)c1ccccc1 Amb8513684 [1,1,0,0,0,0|2,0,0]=4 448 B14R1.3098 CC(C)(C)SCC(=O)c1ccccc1 Amb4165989 [1,1,0,0,0,0|1,0,1]=4 449 B14R1.3098 CC(C)(O)CNC(=O)c1ccccc1 Amb4115968 [1,1,0,0,0,0|1,0,0]=3 450 B14R1.3098 CC(C)(O)CNC(=O)c1ccccn1 Amb18565522 [1,1,0,0,0,0|2,0,0]=4 451 B14R1.3098 CC(C)(O)CNC(=O)c1cccnc1 Amb25873491 [1,1,0,0,0,0|2,0,0]=4 452 B14R1.3098 CC(C)(O)CNC(=O)c1ccncc1 Amb24365153 [1,1,0,0,0,0|2,0,0]=4 453 B14R1.3098 CC(C)(S)CNC(=O)c1cccnc1 Amb25861890 [1,1,0,0,0,0|2,0,0]=4 454 B14R1.3098 CC(F)(F)CNC(=O)c1ccccc1 Amb29855919 [1,1,0,0,0,0|2,0,0]=4 455 B14R1.3098 C[N+](C)(C)CCC(=O)c1ccccc1 Amb24079921 [1,1,0,0,0,0|1,0,1]=4 456 B14R1.3098 C\C(=C/C[Si](C)(C)C)c1ccccc1 Amb8392368 [1,1,0,0,0,0|0,1,1]=4 457 B14R1.544 CC(C)(C)\C=C(\CN)c1ccccc1 Amb27467820 [0,1,0,0,1,0|1,0,1]=4 458 B14R1.544 CC(C)(C)\C=C(\CO)c1ccccc1 Amb27472774 [0,1,0,0,1,0|0,0,2]=4 459 B14R1.1019 CC(C)\C=C(/C#N)c1ccc(Br)cc1 Amb17261230 [0,1,0,0,1,0|1,0,1]=4 460 B14R1.1019 CC(C)\C=C(/C#N)c1ccc(Cl)cc1 Amb17238734 [0,1,0,0,1,0|1,0,1]=4 461 B14R1.1019 CC(C)\C=C(/C#N)c1ccc(F)cc1 Amb17234658 [0,1,0,0,1,0|1,0,1]=4 462 B14R1.1019 CC(C)\C=C(\C#N)c1ccc(Br)cc1 Amb27458895 [0,1,0,0,1,0|1,0,1]=4 463 B14R1.1019 CC(C)\C=C(\C#N)c1ccc(F)cc1 Amb27191510 [0,1,0,0,1,0|1,0,1]=4 464 B14R1.1019 CN(C)\C=C(/C=O)c1ccc(Br)cc1 Amb17354636 [0,1,0,0,1,0|1,0,0]=3 465 B14R1.1019 CN(C)\C=C(/C=O)c1ccc(Cl)cc1 Amb3918891 [0,1,0,0,1,0|1,0,0]=3 466 B14R1.1019 CN(C)\C=C(/C=O)c1ccc(F)cc1 Amb17336583 [0,1,0,0,1,0|1,0,0]=3 467 B14R1.1019 CN(C)\C=C(\C=O)c1ccc(Cl)cc1 Amb22491241 [0,1,0,0,1,0|1,0,0]=3 468 B14R1.1019 CN(C)\C=C(\C=O)c1ccc(F)cc1 Amb24741190 [0,1,0,0,1,0|1,0,0]=3 469 B14R1.1019 Cc1ccc(\C(=C/O)CC(C)N)cc1 Amb28384600 [0,1,0,0,1,0|1,0,1]=4 470 B14R1.1019 Cc1ccc(\C(=C\O)CC(C)N)cc1 Amb28289943 [0,1,0,0,1,0|1,0,1]=4 471 B14R1.1019 Cc1ccc(\C(C#N)=C\C(C)C)cc1 Amb17234211 [0,1,0,0,1,0|1,0,1]=4 472 B14R1.1019 Cc1ccc(\C(C=O)=C/N(C)C)cc1 Amb10071957 [0,1,0,0,1,0|1,0,0]=3 473 B14R1.1019 Cc1ccc(\C(C=O)=C\N(C)C)cc1 Amb5380886 [0,1,0,0,1,0|1,0,0]=3 474 B14R1.1020 CN(C)\C=C(/C=O)c1cccc(Br)c1 Amb17354634 [0,1,0,0,1,0|1,0,0]=3 475 B14R1.1020 CN(C)\C=C(/C=O)c1cccc(Cl)c1 Amb2428019 [0,1,0,0,1,0|1,0,0]=3 476 B14R1.1020 CN(C)\C=C(/C=O)c1cccc(F)c1 Amb27585593 [0,1,0,0,1,0|1,0,0]=3 477 B14R1.1020 CN(C)\C=C(\C=O)c1cccc(F)c1 Amb25731881 [0,1,0,0,1,0|1,0,0]=3 478 B14R1.1020 Cc1cccc(\C(C=O)=C\N(C)C)c1 Amb17336120 [0,1,0,0,1,0|1,0,0]=3 479 B14R1.1027 CN(C)C(=O)C(C=O)c1ccccc1 Amb32415029 [0,1,0,0,1,0|1,0,1]=4 480 B14R1.3642 CN(C)CC(C)(C=O)c1ccccc1 Amb19078640 [0,1,0,0,1,0|1,0,1]=4 481 B14R1.3642 CN(C)CC(C)(C=O)c1ccccc1 Amb32662589 [0,1,0,0,1,0|1,0,1]=4 482 B14R1.6455 CC(=O)C(CN(C)C)c1ccccc1 Amb17595000 [0,1,0,0,1,0|1,0,1]=4 483 B14R1.6455 CC(=O)\C(=C/N(C)C)c1ccccc1 Amb2440196 [0,1,0,0,1,0|1,0,0]=3 484 B14R1.6455 CC(=O)\C(=C\N(C)C)c1ccccc1 Amb27619331 [0,1,0,0,1,0|1,0,0]=3 485 B14R1.6455 CC(=O)\C(=C\N(C)C)c1ccncc1 Amb27437176 [0,1,0,0,1,0|2,0,0]=4 486 B14R1.6455 CC(C)CC(C(=O)O)c1ccccc1 Amb4019881 [0,1,0,0,1,0|0,0,1]=3 487 B14R1.6455 CC(C)CC(C(=O)O)c1ccncc1 Amb32667645 [0,1,0,0,1,0|1,0,1]=4 488 B14R1.6455 CC(C)CC(C(=O)[O-])c1ccncc1 Amb32667602 [0,1,0,0,1,0|1,0,1]=4 489 B14R1.6455 CC(C)NC(C(=O)O)c1ccccc1 Amb9620372 [0,1,0,0,1,0|1,0,1]=4 490 B14R1.6455 CC(C)NC(C(N)=O)c1ccccc1 Amb17336465 [0,1,0,0,1,0|1,0,1]=4 491 B14R1.6455 CC(C)OC(C(=O)O)c1ccccc1 Amb33529697 [0,1,0,0,1,0|1,0,1]=4 492 B14R1.6455 CC(C)\C=C(\C(=O)O)c1ccccc1 Amb28054501 [0,1,0,0,1,0|0,0,0]=2 493 B14R1.6455 CC(C)\C=C(\C(N)=O)c1ccccc1 Amb27781459 [0,1,0,0,1,0|0,0,0]=2 494 B14R1.6455 CC(O)CC(=C(F)F)c1ccccc1 Amb27757395 [0,1,0,0,1,0|2,0,0]=4 495 B14R1.6455 CN(C)CC(C(=O)O)c1ccccc1 Amb17235621 [0,1,0,0,1,0|1,0,1]=4 496 B14R1.6455 CN(C)CC(C(=O)O)c1ccccc1 Amb28653167 [0,1,0,0,1,0|1,0,1]=4 497 B14R1.6455 CN(C)\C=C(\C(N)=S)c1ccccc1 Amb27980655 [0,1,0,0,1,0|1,1,0]=4 498 B14R1.6474 CN(C)\C=C(/C=O)c1ccccc1Cl Amb17339417 [0,1,0,0,1,0|1,0,0]=3 499 B14R1.6474 CN(C)\C=C(/C=O)c1ccccc1F Amb17336581 [0,1,0,0,1,0|1,0,0]=3 500 B14R1.6474 CN(C)\C=C(\C=O)c1ccccc1F Amb26390925 [0,1,0,0,1,0|1,0,0]=3 501 B14R1.6474 Cc1ccccc1\C(C=O)=C\N(C)C Amb17336118 [0,1,0,0,1,0|1,0,0]=3 502 B16R1.12528 CC(C)CCOC(C(=O)O)c1ccccc1 Amb6273569 [0,1,0,0,0,1|0,0,2]=4 503 B16R1.3942 CC(C)(N)COC(C(=O)O)c1ccccc1 Amb18630826 [0,2,0,0,0,0|1,0,1]=4 504 B14R1.6723 C\C=C\c1ccc(C(C)C)cc1C=O Amb27439082 [0,0,1,1,0,0|0,0,2]=4 505 B14R2.3 CCCNc1csc2ccccc12 Amb27186106 [1,0,0,1,0,0|1,1,0]=4 506 B14R2.24 O=C1CCCC=C1c2ccccc2 Amb8439756 [1,0,0,1,0,0|0,0,0]=2 507 B14R2.24 O=C1CCCC=C1c2ccncc2 Amb27188923 [1,0,0,1,0,0|1,0,0]=3 508 B14R2.24 O=C1CCCCC1c2ccccc2 Amb1229912 [1,0,0,1,0,0|0,0,2]=4 509 B14R2.24 O=C1CCCCN1c2ccccc2 Amb17233112 [1,0,0,1,0,0|1,0,1]=4 510 B14R2.24 O=C1CCCC[C@@H]1c2ccccc2 Amb27878571 [1,0,0,1,0,0|0,0,2]=4 511 B14R2.24 O=C1CCCC[C@H]1c2ccccc2 Amb8384672 [1,0,0,1,0,0|0,0,2]=4 512 B14R2.24 O=C1CCCNN1c2ccccc2 Amb24435552 [1,0,0,1,0,0|2,0,0]=4 513 B14R2.24 O=C1CCCSC1c2ccccc2 Amb27209043 [1,0,0,1,0,0|1,0,1]=4 514 B14R2.24 O=C1NCCN=C1c2ccccc2 Amb28241323 [1,0,0,1,0,0|2,0,0]=4 515 B14R2.39 CCCC1=C(c2ccccc2)C1=O Amb27261933 [1,0,0,1,0,0|0,0,0]=2 516 B14R2.1131 C=CC1=CCC(O)c2ccccc21 Amb27981769 [1,0,0,1,0,0|2,0,0]=4 517 B14R2.1131 Cc1ccc(C=O)c2ccccc12 Amb2689532 [1,0,0,1,0,0|0,0,2]=4 518 B14R2.1253 C1=C(c2ccccc2)CCCCC1 Amb4001532 [1,0,0,1,0,0|1,0,1]=4 519 B14R2.2014 O=CC1CCCCc2ccccc21 Amb20668008 [1,0,0,1,0,0|0,0,2]=4 520 B14R2.2850 O=CC(c1ccccc1)C2CCC2 Amb25839748 [1,0,0,1,0,0|0,0,2]=4 521 B14R2.2974 O=CC1(c2ccccc2)CCCC1 Amb17400442 [1,0,0,1,0,0|0,0,2]=4 522 B14R2.4514 CC1CNN(c2ccccc2)C1=O Amb8487921 [1,0,0,1,0,0|2,0,0]=4 523 B14R2.4514 CC1OC=C(c2ccccc2)C1=O Amb28253991 [1,0,0,1,0,0|1,0,0]=3 524 B14R2.19587 C=Cc1cn(CC)c2ccccc12 Amb28436362 [1,0,0,1,0,0|2,0,0]=4 525 B14R2.19587 CCn1cc(C=O)c2ccccc21 Amb6336168 [1,0,0,1,0,0|1,0,0]=3 526 B14R2.19587 CCn1cc(C=O)c2cccnc21 Amb9901141 [1,0,0,1,0,0|2,0,0]=4 527 B14R2.19587 CCn1nc(C=O)c2ccccc21 Amb23455184 [1,0,0,1,0,0|2,0,0]=4 528 B14R2.287 CC1CCC(=O)c2ccccc2N1 Amb27403568 [1,0,0,1,0,0|1,0,1]=4 529 B14R2.287 CC1CNC(=O)c2ccccc2C1 Amb27653306 [1,0,0,1,0,0|1,0,0]=3 530 B14R2.287 CN1CCC(=O)c2ccccc2C1 Amb25876640 [1,0,0,1,0,0|1,0,1]=4 531 B14R2.287 O=C1NCC(O)Cc2ccccc21 Amb24534423 [1,0,0,1,0,0|2,0,0]=4 532 B14R2.352 CC1CC1NC(=O)c2cccnc2 Amb27804921 [1,0,0,1,0,0|2,0,0]=4 533 B14R2.352 CC1CC1NC(=O)c2ccncc2 Amb27834828 [1,0,0,1,0,0|2,0,0]=4 534 B14R2.403 CC1(C)C=C(c2ccccc2)C=N1 Amb25191559 [1,0,0,1,0,0|1,0,0]=3 535 B14R2.403 CC1(C)C=CC(c2ccccc2)=N1 Amb25826066 [1,0,0,1,0,0|1,0,1]=4 536 B14R2.403 CC1(C)COC(c2ccccc2)=N1 Amb6355786 [1,0,0,1,0,0|2,0,0]=4 537 B14R2.422 CC1CC(C(=O)c2ccccc2)C1 Amb23590238 [1,0,0,1,0,0|0,0,1]=3 538 B14R2.422 CC1CC(C(=O)c2cccnc2)C1 Amb35658761 [1,0,0,1,0,0|1,0,1]=4 539 B14R2.422 CC1CN(C(=N)c2ccccc2)C1 Amb30023412 [1,0,0,1,0,0|2,0,0]=4 540 B14R2.422 CC1CN(C(=O)c2ccccc2)C1 Amb27456121 [1,0,0,1,0,0|1,0,0]=3 541 B14R2.422 CC1CN(C(=O)c2ccccn2)C1 Amb28293742 [1,0,0,1,0,0|2,0,0]=4 542 B14R2.422 CC1CN(C(=O)c2cccnc2)C1 Amb27968951 [1,0,0,1,0,0|2,0,0]=4 543 B14R2.422 NC1CC(C(=O)c2ccccc2)C1 Amb30032429 [1,0,0,1,0,0|1,0,1]=4 544 B14R2.422 NC1CN(C(=O)c2ccccc2)C1 Amb34913216 [1,0,0,1,0,0|2,0,0]=4 545 B14R2.422 O=C(c1ccccc1)C2CC(O)C2 Amb28351467 [1,0,0,1,0,0|1,0,1]=4 546 B14R2.422 O=C(c1ccccc1)N2CC(O)C2 Amb26632126 [1,0,0,1,0,0|2,0,0]=4 547 B14R2.422 O=C(c1ccccc1)N2CC(S)C2 Amb27951593 [1,0,0,1,0,0|2,0,0]=4 548 B14R2.792 O=C(C#CC1CC1)c2ccccc2 Amb27861379 [1,0,0,1,0,0|0,0,2]=4 549 B14R2.792 O=C(CNC1CC1)c2ccccc2 Amb17313805 [1,0,0,1,0,0|1,0,1]=4 550 B14R2.792 O=C(NCC1CC1)c2ccccn2 Amb9169323 [1,0,0,1,0,0|2,0,0]=4 551 B14R2.792 O=C(NCC1CC1)c2cccnc2 Amb8331059 [1,0,0,1,0,0|2,0,0]=4 552 B14R2.792 O=C(OCC1CO1)c2ccccc2 Amb10789142 [1,0,0,1,0,0|2,0,0]=4 553 B14R2.15693 CC1(C)CC1C(=O)c2ccccc2 Amb27750300 [1,0,0,1,0,0|0,0,1]=3 554 B14R2.25733 CC(C)C1CC(=O)c2ccccc21 Amb17233022 [1,0,0,1,0,0|0,0,1]=3 555 B14R2.25733 CC(C)C1NC(=O)c2ccccc21 Amb27152886 [1,0,0,1,0,0|1,0,0]=3 556 B14R2.25733 CC(C)[C@@H]1NC(=O)c2ccccc21 Amb25066912 [1,0,0,1,0,0|1,0,0]=3 557 B14R2.25733 CC(C)[C@H]1NC(=O)c2ccccc21 Amb26464028 [1,0,0,1,0,0|1,0,0]=3 558 B14R2.25733 CC(C)n1cc(O)c2ccccc21 Amb25736316 [1,0,0,1,0,0|1,0,1]=4 559 B14R2.25733 CC(N)C1OC(=O)c2ccccc21 Amb27445455 [1,0,0,1,0,0|2,0,0]=4 560 B14R2.25733 CC(O)C1OC(=O)c2ccccc21 Amb27952288 [1,0,0,1,0,0|2,0,0]=4 561 B14R2.25733 Cc1cn(C(C)C)c2ccccc12 Amb27409377 [1,0,0,1,0,0|1,0,1]=4 562 B14R2.29285 CC1(C)C=CC(=O)c2ccccc21 Amb17594321 [1,0,0,1,0,0|0,0,1]=3 563 B14R2.29285 CC1(C)CCC(=O)c2ccccc21 Amb4012595 [1,0,0,1,0,0|0,0,1]=3 564 B14R2.29285 CC1(C)CCC(=O)c2ncccc21 Amb28321866 [1,0,0,1,0,0|1,0,1]=4 565 B14R2.29285 CC1(C)CNC(=O)c2ccccc21 Amb17400492 [1,0,0,1,0,0|1,0,0]=3 566 B14R2.29285 CC1(C)OCC(=O)c2ccccc21 Amb28243276 [1,0,0,1,0,0|1,0,1]=4 567 B14R2.29285 C[Si]1(C)CNC(=O)c2ccccc21 Amb25670257 [1,0,0,1,0,0|1,1,0]=4 568 B14R2.2 CC(Br)Cc1csc2ccccc12 Amb27670238 [0,0,0,1,1,0|1,1,0]=4 569 B14R2.2 CC(C)Cn1cnc2ccccc21 Amb1104115 [0,0,0,1,1,0|2,0,0]=4 570 B14R2.2 CC(C)Nc1coc2ccccc12 Amb25158272 [0,0,0,1,1,0|1,0,1]=4 571 B14R2.2 CC(C)Nc1csc2ccccc12 Amb27448120 [0,0,0,1,1,0|1,1,0]=4 572 B14R2.2 CC(N)Cc1csc2ccccc12 Amb2237287 [0,0,0,1,1,0|1,1,0]=4 573 B14R2.2 CC(O)CC1=CCc2ccccc21 Amb27970563 [0,0,0,1,1,0|2,0,0]=4 574 B14R2.2 CC(O)Cc1coc2ccccc12 Amb28061306 [0,0,0,1,1,0|1,0,1]=4 575 B14R2.2 CC(O)Cc1csc2ccccc12 Amb26944427 [0,0,0,1,1,0|1,1,0]=4 576 B14R2.2 CN(C)Cc1coc2ccccc12 Amb27631487 [0,0,0,1,1,0|1,0,1]=4 577 B14R2.2 CN(C)Cc1csc2ccccc12 Amb4056962 [0,0,0,1,1,0|1,1,0]=4 578 B14R2.2 C[C@@H](N)Cc1csc2ccccc12 Amb33312707 [0,0,0,1,1,0|1,1,0]=4 579 B14R2.2 C[C@@H](O)Cc1csc2ccccc12 Amb33312704 [0,0,0,1,1,0|1,1,0]=4 580 B14R2.2 C[C@H](N)Cc1csc2ccccc12 Amb33312706 [0,0,0,1,1,0|1,1,0]=4 581 B14R2.2 C[C@H](O)Cc1csc2ccccc12 Amb33312705 [0,0,0,1,1,0|1,1,0]=4 582 B14R2.598 CC1CC(=O)N(c2ccccc2)N1 Amb8385473 [0,0,0,1,1,0|2,0,0]=4 583 B14R2.598 CC1CC(c2ccccc2)C(=O)N1 Amb28342413 [0,0,0,1,1,0|1,0,1]=4 584 B14R2.598 CC1CN(c2ccccc2)C(=O)N1 Amb27851502 [0,0,0,1,1,0|2,0,0]=4 585 B14R2.598 C[C@H]1CC(=O)C(c2ccccc2)C1 Amb27973094 [0,0,0,1,1,0|0,0,1]=3 586 B14R2.598 NC1CC(=O)N(c2ccccc2)C1 Amb17845256 [0,0,0,1,1,0|2,0,0]=4 587 B14R2.598 NC1CC(=O)N(c2ccccc2)C1 Amb7173110 [0,0,0,1,1,0|2,0,0]=4 588 B14R2.598 O=C1C[C@@H](O)C=C1c2ccccc2 Amb27226987 [0,0,0,1,1,0|1,0,0]=3 589 B14R2.598 O=C1OC(O)C=C1c2ccccc2 Amb26638407 [0,0,0,1,1,0|2,0,0]=4 590 B14R2.1146 CC1C=C(C#N)c2ccccc2C1 Amb18126621 [0,0,0,1,1,0|1,0,1]=4 591 B14R2.1146 Cc1cc(C=O)c2ccccc2c1 Amb18647392 [0,0,0,1,1,0|0,0,2]=4 592 B14R2.1146 Cc1cc(C=O)c2ccccc2n1 Amb2797653 [0,0,0,1,1,0|1,0,1]=4 593 B14R2.1146 O=CN1CC(O)Cc2ccccc21 Amb27180423 [0,0,0,1,1,0|2,0,0]=4 594 B14R2.3449 O=CC1(c2ccccc2)CC(F)C1 Amb32988601 [0,0,0,1,1,0|1,0,1]=4 595 B14R2.3449 O=C[C@]1(c2ccccc2)C[C@@H](F)C1 Amb32648091 [0,0,0,1,1,0|1,0,1]=4 596 B14R2.45179 CC1(C)C=C(C#N)c2ccccc21 Amb17232715 [0,0,0,1,1,0|1,0,1]=4 597 B14R2.45179 CC1(C)C\C(=N\N)c2ccccc21 Amb27206366 [0,0,0,1,1,0|2,0,0]=4 598 B14R2.45179 CC1(C)C\C(=N\O)c2ccccc21 Amb27400175 [0,0,0,1,1,0|1,0,1]=4 599 B16R2.477 CC(C)CNc1cnc2ccccc2c1 Amb9556785 [0,0,0,1,0,1|2,0,0]=4 600 B16R2.1618 CC(C)c1nc(C=O)cc2ccccc12 Amb31096516 [0,0,0,1,0,1|1,0,1]=4 601 B16R2.1625 CC(C)Cn1c(C=O)cc2ccccc21 Amb32417758 [0,0,0,1,0,1|1,0,0]=3 602 B16R2.1625 CC(C)Cn1c(C=O)nc2ccccc21 Amb1101725 [0,0,0,1,0,1|1,0,0]=3 603 B16R2.1625 CN(C)Cc1c(C=O)sc2ccccc12 Amb19649478 [0,0,0,1,0,1|1,0,0]=3 604 B16R2.3356 CC(C)CCC1Cc2ccccc2C1=O Amb27212119 [0,0,0,1,0,1|0,0,2]=4 605 B16R2.36 CC(C)CNCc1csc2ccccc12 Amb28963525 [0,0,0,1,0,1|0,1,1]=4 606 B16R2.85 CC(C)c1ccc(-c2ccccc2)cc1 Amb8384527 [0,0,0,1,0,1|1,0,1]=4 607 B16R2.157 CC(C)Nc1nc(-c2ccccc2)cs1 Amb244389 [0,0,0,1,0,1|1,1,0]=4 608 B16R2.157 CC(N)Cc1nc(-c2ccccc2)cs1 Amb5740885 [0,0,0,1,0,1|1,1,0]=4 609 B16R2.157 CC(O)Cc1ccc(-c2ccccc2)s1 Amb33081056 [0,0,0,1,0,1|2,0,0]=4 610 B16R2.157 C[C@@H](N)Cc1ccc(-c2ccccc2)s1 Amb33082403 [0,0,0,1,0,1|2,0,0]=4 611 B16R2.157 C[C@@H](O)Cc1ccc(-c2ccccc2)s1 Amb33081201 [0,0,0,1,0,1|2,0,0]=4 612 B16R2.157 C[C@H](N)Cc1ccc(-c2ccccc2)s1 Amb33081196 [0,0,0,1,0,1|2,0,0]=4 613 B16R2.157 C[C@H](O)Cc1ccc(-c2ccccc2)s1 Amb33081198 [0,0,0,1,0,1|2,0,0]=4 614 B16R2.14515 CC1CC(=O)N(c2ccccc2)CCN1 Amb31116724 [0,0,0,1,0,1|1,0,1]=4 615 B16R2.14594 CC1(C)CNCC(c2ccccc2)C1=O Amb18785387 [0,0,0,1,0,1|0,0,2]=4 616 B16R2.14594 CC1(C)NCCN(c2ccccc2)C1=O Amb31128634 [0,0,0,1,0,1|1,0,1]=4 617 B16R2.39178 CN(C)c1ccc(C=O)c2ccccc12 Amb2719820 [0,0,0,1,0,1|1,0,1]=4 618 B16R2.75436 C=C(C)Cn1cc(C=O)c2ccccc21 Amb17116904 [0,0,0,1,0,1|0,0,2]=4 619 B16R2.75436 CC(=O)Cn1cc(C=O)c2ccccc21 Amb17116890 [0,0,0,1,0,1|1,0,1]=4 620 B16R2.75436 CC(C)Cc1nc(C=O)c2ccccn12 Amb17052776 [0,0,0,1,0,1|1,0,0]=3 621 B16R2.75436 CC(C)Cn1cc(C=O)c2ccccc21 Amb838422 [0,0,0,1,0,1|0,0,0]=2 622 B16R2.75436 CC(O)Cn1cc(C=O)c2cccnc21 Amb27847395 [0,0,0,1,0,1|2,0,0]=4 623 B16R2.75436 CN(C)Cn1cc(C=O)c2ccccc21 Amb17480888 [0,0,0,1,0,1|1,0,0]=3 624 B16R2.40082 CC(C)c1cc(C=O)c2ccccc2n1 Amb18850582 [0,1,0,1,0,0|0,0,1]=3 625 B16R2.2865 CC(C)n1cc(-c2ccc(Br)cc2)cn1 Amb23443726 [0,1,0,1,0,0|2,0,0]=4 626 B16R2.2865 CC(C)n1cc(-c2ccc(I)cc2)cn1 Amb23537907 [0,1,0,1,0,0|2,0,0]=4 627 B16R2.2865 CC(C)n1cc(-c2ccc(N)cc2)cn1 Amb30666440 [0,1,0,1,0,0|2,0,0]=4 628 B16R2.48623 CC(C)n1cc(C=O)c2ccc(Cl)cc21 Amb32672014 [0,1,0,1,0,0|1,0,0]=3 629 B16R2.2918 CC(C)n1cc(-c2cccc(I)c2)cn1 Amb27764457 [0,1,0,1,0,0|2,0,0]=4 630 B16R2.2918 CC(C)n1cc(-c2cccc(N)c2)cn1 Amb24116444 [0,1,0,1,0,0|2,0,0]=4 631 B16R2.2506 CNC1CCN(c2ccccc2)C(=O)C1 Amb31116723 [0,1,0,1,0,0|1,0,1]=4 632 B16R2.2506 NCC1CCN(c2ccccc2)C(=O)C1 Amb31112729 [0,1,0,1,0,0|1,0,1]=4 633 B16R2.4093 CC1CCN(c2ccccc2)C(=O)CN1 Amb31128720 [0,1,0,1,0,0|1,0,1]=4 634 B16R2.75437 CCC(C)n1cc(C=O)c2ccccc21 Amb845357 [0,1,0,1,0,0|1,0,0]=3 635 B16R2.75437 O=Cc1cn(C(O)CO)c2ccccc12 Amb9901857 [0,1,0,1,0,0|2,0,0]=4 636 B16R2.2888 CC(C)C1N=C(c2ccccc2)OC1=O Amb3093796 [0,1,0,1,0,0|1,0,0]=3 637 B16R2.2888 CC(C)N1N=C(c2ccccc2)CC1=O Amb32675732 [0,1,0,1,0,0|2,0,0]=4 638 B16R2.18974 CC(C)n1cc(N=C=O)c2ccccc21 Amb17085277 [0,1,0,1,0,0|1,0,1]=4 639 B16R2.179941 CC(C)CNc1nccc2ccccc12 Amb18456059 [0,1,0,1,0,0|2,0,0]=4 640 B16R2.520 CC(C)CC(=O)c1cnn2ccccc12 Amb27421189 [0,1,0,1,0,0|2,0,0]=4 641 B16R2.520 CC(C)CC(=O)c1coc2ccccc12 Amb26877298 [0,1,0,1,0,0|0,0,1]=3 642 B16R2.520 CC(C)CC(Cl)c1coc2ccccc12 Amb35704194 [0,1,0,1,0,0|0,0,2]=4 643 B16R2.520 CC(C)CC(Cl)c1csc2ccccc12 Amb27753357 [0,1,0,1,0,0|0,1,1]=4 644 B16R2.520 CC(C)CC(N)c1coc2ccccc12 Amb31112567 [0,1,0,1,0,0|0,0,2]=4 645 B16R2.520 CC(C)CC(N)c1csc2ccccc12 Amb9212771 [0,1,0,1,0,0|0,1,1]=4 646 B16R2.520 CC(C)OC(=O)c1coc2ccccc12 Amb28185407 [0,1,0,1,0,0|1,0,1]=4 647 B16R2.520 CC(N)CC(=O)c1coc2ccccc12 Amb35704140 [0,1,0,1,0,0|1,0,1]=4 648 B16R2.2247 CC1CC(=O)N(c2ccccc2)C(=O)N1 Amb9420812 [0,1,0,1,0,0|2,0,0]=4 649 B16R2.6150 CC(C)Cc1nc2ccccn2c1C=O Amb33070465 [0,1,0,1,0,0|1,0,0]=3 650 B16R2.2947 CC(C)(N)CCc1csc2ccccc12 Amb33313107 [0,1,0,1,0,0|0,1,1]=4 651 B16R2.75438 CC(C)(C)n1nc(C=O)c2ccccc21 Amb32669037 [0,1,0,1,0,0|2,0,0]=4 652 B16R2.3270 CC(C)n1cc(-c2ccccc2Br)cn1 Amb35744563 [0,1,0,1,0,0|2,0,0]=4 653 B16R2.3270 CC(C)n1cc(-c2ccccc2N)cn1 Amb32701340 [0,1,0,1,0,0|2,0,0]=4 654 B16R2.4003 CC(C)CCN1C(=O)Nc2ccccc21 Amb18034261 [0,1,0,1,0,0|1,0,1]=4 655 B16R2.4003 CC(C)CCN1C(=O)Oc2ccccc21 Amb19806278 [0,1,0,1,0,0|1,0,1]=4 656 B16R2.241288 CC(C)n1cc(C=O)c2c(F)cccc21 Amb32672015 [0,1,0,1,0,0|1,0,0]=3 657 B16R2.400351 CC(=O)c1cn(C(C)C)c2ccccc12 Amb32672013 [0,1,0,1,0,0|1,0,0]=3 658 B16R2.400351 CC(C)c1cc(C(=O)O)n2ccccc12 Amb18149679 [0,1,0,1,0,0|1,0,1]=4 659 B16R2.400351 CC(C)n1cc(C(=O)O)c2ccccc21 Amb21912559 [0,1,0,1,0,0|1,0,0]=3 660 B16R2.400351 CC(C)n1nc(C(=O)O)c2ccccc21 Amb10603439 [0,1,0,1,0,0|2,0,0]=4 661 B16R2.403705 CC1(C)CC=C(C(=O)O)c2ccccc21 Amb17237450 [0,1,0,1,0,0|0,0,0]=2 662 B16R2.403705 CC1(C)CCC(C(=O)O)c2ccccc21 Amb18538590 [0,1,0,1,0,0|0,0,2]=4 663 B16R2.403705 CC1(C)CCC(C(N)=O)c2ccccc21 Amb33457532 [0,1,0,1,0,0|0,0,2]=4 664 B16R2.403705 CC1(C)CNC(C(=O)O)c2ccccc21 Amb19107350 [0,1,0,1,0,0|1,0,1]=4 665 B16R2.403705 CC1(C)CNC(C(N)=O)c2ccccc21 Amb23515136 [0,1,0,1,0,0|1,0,1]=4 666 B16R3.88384 O=Cc1nn(C2CC2)c3ccccc13 Amb23455187 [0,0,0,2,0,0|2,0,0]=4 667 B12R1.54 CC(C)CCC(=O)c1ccco1 Amb8496552 [1,0,0,0,1,0|1,0,1]=4 668 B12R1.54 CC(C)CCC(=O)c1cccs1 Amb8850824 [1,0,0,0,1,0|1,0,1]=4 669 B12R1.54 CC(C)CCC(=O)c1ccoc1 Amb33542148 [1,0,0,0,1,0|1,0,1]=4 670 B12R1.54 CC(C)CNC(=O)c1cccs1 Amb2660666 [1,0,0,0,1,0|2,0,0]=4 671 B12R1.54 CC(C)CNC(=O)c1ccoc1 Amb8334878 [1,0,0,0,1,0|2,0,0]=4 672 B12R1.54 CC(C)\C=C\C(=O)c1ccoc1 Amb26612004 [1,0,0,0,1,0|1,0,1]=4 673 B12R1.107 C=C(C)CC(=O)c1ccccc1 Amb18563490 [1,0,0,0,1,0|0,0,2]=4 674 B12R1.107 C=C(CC(C)=O)c1ccccc1 Amb27802448 [1,0,0,0,1,0|1,0,1]=4 675 B12R1.107 C=C(CC(C)O)c1ccccc1 Amb27486292 [1,0,0,0,1,0|1,0,0]=3 676 B12R1.107 C=C(CN(C)C)c1ccccn1 Amb27779301 [1,0,0,0,1,0|2,0,0]=4 677 B12R1.107 CC(=N)CC(=O)c1ccccc1 Amb4354188 [1,0,0,0,1,0|1,0,1]=4 678 B12R1.107 CC(=O)CC(=O)c1ccccc1 Amb534154 [1,0,0,0,1,0|1,0,1]=4 679 B12R1.107 CC(C)=CC(=O)c1ccccc1 Amb10874044 [1,0,0,0,1,0|0,0,1]=3 680 B12R1.107 CC(C)CC(=O)c1ccccc1 Amb4017884 [1,0,0,0,1,0|0,0,0]=2 681 B12R1.107 CC(C)CC(=O)c1ccccn1 Amb6301495 [1,0,0,0,1,0|1,0,0]=3 682 B12R1.107 CC(C)CC(=O)c1cccnc1 Amb10607962 [1,0,0,0,1,0|1,0,0]=3 683 B12R1.107 CC(C)CC(=O)c1ccncc1 Amb17334579 [1,0,0,0,1,0|1,0,0]=3 684 B12R1.107 CC(C)CC(=O)c1ccnnc1 Amb28453539 [1,0,0,0,1,0|2,0,0]=4 685 B12R1.107 CC(C)CC(=O)c1ncccn1 Amb18792555 [1,0,0,0,1,0|2,0,0]=4 686 B12R1.107 CC(C)CC(N)c1ccccc1 Amb6892355 [1,0,0,0,1,0|1,0,1]=4 687 B12R1.107 CC(C)CC(N)c1ccccc1 Amb9703509 [1,0,0,0,1,0|1,0,1]=4 688 B12R1.107 CC(C)CC(O)c1ccccc1 Amb1110402 [1,0,0,0,1,0|0,0,2]=4 689 B12R1.107 CC(C)CC(S)c1ccccc1 Amb7784758 [1,0,0,0,1,0|0,1,1]=4 690 B12R1.107 CC(C)CN(C)c1ccccc1 Amb17232437 [1,0,0,0,1,0|1,0,1]=4 691 B12R1.107 CC(C)C[C@@H](N)c1ccccc1 Amb22288660 [1,0,0,0,1,0|1,0,1]=4 692 B12R1.107 CC(C)C[C@@H](N)c1ccccc1 Amb27175567 [1,0,0,0,1,0|1,0,1]=4 693 B12R1.107 CC(C)C[C@H](N)c1ccccc1 Amb22288705 [1,0,0,0,1,0|1,0,1]=4 694 B12R1.107 CC(C)C[C@H](N)c1ccccc1 Amb27249677 [1,0,0,0,1,0|1,0,1]=4 695 B12R1.107 CC(C)NC(=N)c1ccccc1 Amb27985757 [1,0,0,0,1,0|2,0,0]=4 696 B12R1.107 CC(C)NC(=S)c1ccccc1 Amb28119091 [1,0,0,0,1,0|1,1,0]=4 697 B12R1.107 CC(C)OC(=O)c1ccccc1 Amb15740252 [1,0,0,0,1,0|1,0,0]=3 698 B12R1.107 CC(C)OC(=O)c1ccccn1 Amb17509339 [1,0,0,0,1,0|2,0,0]=4 699 B12R1.107 CC(C)OC(=O)c1cccnc1 Amb1959307 [1,0,0,0,1,0|2,0,0]=4 700 B12R1.107 CC(C)\N=C(/Cl)c1ccccc1 Amb33595358 [1,0,0,0,1,0|2,0,0]=4 701 B12R1.107 CC(C)\N=C(\Cl)c1ccccc1 Amb2371275 [1,0,0,0,1,0|2,0,0]=4 702 B12R1.107 CC(Cl)CC(=O)c1ccccc1 Amb28042789 [1,0,0,0,1,0|1,0,0]=3 703 B12R1.107 CC(Cl)OC(=O)c1ccccc1 Amb10603969 [1,0,0,0,1,0|2,0,0]=4 704 B12R1.107 CC(N)CC(=O)c1ccccc1 Amb20668879 [1,0,0,0,1,0|1,0,0]=3 705 B12R1.107 CC(N)CC(=O)c1ccccc1 Amb22059727 [1,0,0,0,1,0|1,0,0]=3 706 B12R1.107 CC(N)CC(=O)c1ccccn1 Amb27623071 [1,0,0,0,1,0|2,0,0]=4 707 B12R1.107 CC(N)CS(=O)c1ccccc1 Amb27165944 [1,0,0,0,1,0|2,0,0]=4 708 B12R1.107 CC(N)NC(=O)c1ccccc1 Amb27792210 [1,0,0,0,1,0|2,0,0]=4 709 B12R1.107 CC(O)CC(=O)c1ccccc1 Amb27177964 [1,0,0,0,1,0|1,0,0]=3 710 B12R1.107 CC(O)\C=C(\Cl)c1ccccc1 Amb27451951 [1,0,0,0,1,0|2,0,0]=4 711 B12R1.107 CN(C)CC(=O)c1ccccc1 Amb22264767 [1,0,0,0,1,0|1,0,0]=3 712 B12R1.107 CN(C)CC(=O)c1ccccc1 Amb9217331 [1,0,0,0,1,0|1,0,0]=3 713 B12R1.107 CN(C)NC(=O)c1ccccc1 Amb10574824 [1,0,0,0,1,0|2,0,0]=4 714 B12R1.107 CN(C)\C=C(/O)c1ccccc1 Amb24068870 [1,0,0,0,1,0|1,0,1]=4 715 B12R1.107 C[C@@H](Cl)OC(=O)c1ccccc1 Amb27858875 [1,0,0,0,1,0|2,0,0]=4 716 B12R1.107 C[C@H](O)CC(=O)c1ccccc1 Amb27178049 [1,0,0,0,1,0|1,0,0]=3 717 B12R1.107 C[S+](C)CC(=O)c1ccccc1 Amb10838263 [1,0,0,0,1,0|1,0,0]=3 718 B12R1.107 C[S+](C)CC(=O)c1ccccc1 Amb4036338 [1,0,0,0,1,0|1,0,0]=3 719 B12R1.107 C\C(=C\C(C)C)c1ccccc1 Amb4018527 [1,0,0,0,1,0|0,0,1]=3 720 B12R1.107 C\C(=C\[C@H](C)O)c1ccccc1 Amb27650888 [1,0,0,0,1,0|1,0,1]=4 721 B12R1.107 C\C(=N/C(C)C)c1ccccc1 Amb24053029 [1,0,0,0,1,0|1,0,1]=4 722 B12R1.107 C\C(N)=C/C(=O)c1ccccc1 Amb27666841 [1,0,0,0,1,0|1,0,1]=4 723 B12R1.107 C\C(N)=C\C(=O)c1ccccc1 Amb2386640 [1,0,0,0,1,0|1,0,1]=4 724 B12R1.107 O=C(CC(F)Cl)c1ccccc1 Amb27637711 [1,0,0,0,1,0|2,0,0]=4 725 B12R1.476 CN(C)\C=C(\C=O)c1cccs1 Amb24518498 [0,0,0,0,2,0|2,0,0]=4 726 B12R1.478 C=CC(c1ccccc1)C(C)C Amb33175609 [0,0,0,0,2,0|1,0,1]=4 727 B12R1.478 CC(C)C(C=O)c1ccccc1 Amb17138541 [0,0,0,0,2,0|0,0,1]=3 728 B12R1.478 CC(C)C(C=O)c1cccnc1 Amb27669974 [0,0,0,0,2,0|1,0,1]=4 729 B12R1.478 CC(C)N(C=O)c1ccccc1 Amb28384348 [0,0,0,0,2,0|1,0,0]=3 730 B12R1.478 CC(C)N(C=O)c1cccnc1 Amb10553726 [0,0,0,0,2,0|2,0,0]=4 731 B12R1.478 CC(N)\C(=C\Cl)c1ccccc1 Amb24670393 [0,0,0,0,2,0|2,0,0]=4 732 B12R1.478 C\C(Cl)=C(/C=O)c1ccccc1 Amb28185829 [0,0,0,0,2,0|1,0,1]=4 733 B12R1.478 C\C(O)=C(\C=O)c1ccccc1 Amb17777663 [0,0,0,0,2,0|1,0,1]=4 734 B12R1.478 C\C=C(/c1ccccc1)C(C)O Amb27605428 [0,0,0,0,2,0|2,0,0]=4 735 B14R1.420 CC(C)=CCNC(=O)c1ccccc1 Amb28053871 [1,0,0,0,0,1|1,0,1]=4 736 B14R1.420 CC(C)CCCC(=O)c1ccccc1 Amb9031532 [1,0,0,0,0,1|0,0,1]=3 737 B14R1.420 CC(C)CCOC(=O)c1ccccc1 Amb4017910 [1,0,0,0,0,1|0,0,1]=3 738 B14R1.420 CC(C)CSCC(=O)c1ccccc1 Amb9269403 [1,0,0,0,0,1|0,0,1]=3 739 B14R1.420 CC(C)N\C=C\C(=S)c1ccccc1 Amb28292720 [1,0,0,0,0,1|0,1,1]=4 740 B14R1.420 CC(C)SCCC(=O)c1ccccc1 Amb32683160 [1,0,0,0,0,1|0,0,1]=3 741 B14R1.420 CC(C)\C=N\NC(=O)c1ccccc1 Amb2465869 [1,0,0,0,0,1|1,0,1]=4 742 B14R1.420 CN(C)CCCC(=O)c1ccccc1 Amb1951190 [1,0,0,0,0,1|1,0,1]=4 743 B14R1.420 CN(C)CCCC(=O)c1ccccc1 Amb24117967 [1,0,0,0,0,1|1,0,1]=4 744 B14R1.420 CN(C)CCOC(=O)c1ccccc1 Amb17778565 [1,0,0,0,0,1|1,0,1]=4 745 B14R1.420 CN(C)CCOC(=O)c1ccccc1 Amb4124273 [1,0,0,0,0,1|1,0,1]=4 746 B14R1.423 CC(C)CNC(=S)Nc1ccccc1 Amb1841661 [1,0,0,0,0,1|1,1,0]=4 747 B14R1.423 CC(C)COC(=O)Cc1ccccc1 Amb6357515 [1,0,0,0,0,1|1,0,0]=3 748 B14R1.423 CC(C)COC(=O)Nc1cccnc1 Amb444418 [1,0,0,0,0,1|2,0,0]=4 749 B14R1.423 CC(C)COC(=S)Nc1ccccc1 Amb1039629 [1,0,0,0,0,1|1,1,0]=4 750 B14R1.423 CC(C)SCC(=O)Cc1ccccc1 Amb32683179 [1,0,0,0,0,1|1,0,1]=4 751 B14R1.423 CC(C)SCC(=O)Nc1ccccc1 Amb2556743 [1,0,0,0,0,1|1,0,1]=4 752 B14R1.423 CC(N)COC(=O)Nc1ccccc1 Amb35723823 [1,0,0,0,0,1|2,0,0]=4 753 B14R1.423 CC(O)CCC(=O)Nc1ccccc1 Amb17336624 [1,0,0,0,0,1|1,0,1]=4 754 B14R1.423 CC(O)CNC(=O)Cc1ccccc1 Amb9244614 [1,0,0,0,0,1|2,0,0]=4 755 B14R1.423 CC(O)CNC(=O)Nc1ccccc1 Amb9246709 [1,0,0,0,0,1|2,0,0]=4 756 B14R1.423 CC(O)COC(=O)Nc1ccccc1 Amb27230575 [1,0,0,0,0,1|2,0,0]=4 757 B14R1.423 CN(C)CCC(=O)Cc1ccccc1 Amb32662659 [1,0,0,0,0,1|1,0,1]=4 758 B14R1.423 CN(C)CCC(=O)Cc1ccccc1 Amb32662660 [1,0,0,0,0,1|1,0,1]=4 759 B14R1.423 CN(C)\C=C\C(=O)Nc1ccccc1 Amb2408498 [1,0,0,0,0,1|1,0,1]=4 760 B14R1.423 CN(C)\N=C\C(=O)Nc1ccccc1 Amb27248282 [1,0,0,0,0,1|2,0,0]=4 761 B14R1.423 C[C@@H](O)CNC(=O)Nc1ccccc1 Amb27461579 [1,0,0,0,0,1|2,0,0]=4 762 B14R1.423 C[C@@H](O)CNC(=O)Oc1ccccc1 Amb33483091 [1,0,0,0,0,1|2,0,0]=4 763 B14R1.549 C=C(C)C\C(C=O)=C/c1ccccc1 Amb17594833 [0,0,0,0,1,1|0,0,2]=4 764 B14R1.549 C=C(C)C\C(C=O)=C\c1ccccc1 Amb534618 [0,0,0,0,1,1|0,0,2]=4 765 B14R1.549 C=C\C(=N/C(C)C)Nc1ccccc1 Amb28388669 [0,0,0,0,1,1|2,0,0]=4