0 B11R1.40 BrC(Cc1ccccc1)C#N Amb1154191 [0,0,0,0,0,0|3,0,1]=4 1 B11R1.40 BrCC(=O)Cc1ccccc1 Amb17569850 [0,0,0,0,0,0|2,0,0]=2 2 B11R1.40 BrCC(=O)Nc1ccccc1 Amb2222053 [0,0,0,0,0,0|3,0,0]=3 3 B11R1.40 BrCC(Cc1ccccc1)O Amb17595843 [0,0,0,0,0,0|2,0,2]=4 4 B11R1.40 C#CC(=O)Cc1cc[n]cc1 Amb25758182 [0,0,0,0,0,0|2,0,1]=3 5 B11R1.40 C#CC(=O)Cc1ccc[n]c1 Amb25070158 [0,0,0,0,0,0|2,0,1]=3 6 B11R1.40 C#CC(=O)Cc1ccccc1 Amb22059749 [0,0,0,0,0,0|1,0,1]=2 7 B11R1.40 C#CC(=O)Nc1ccccc1 Amb2444736 [0,0,0,0,0,0|2,0,1]=3 8 B11R1.40 C#CC(Cl)Cc1ccccc1 Amb24398624 [0,0,0,0,0,0|2,0,2]=4 9 B11R1.40 C#CC(N)Cc1ccccc1 Amb24699229 [0,0,0,0,0,0|2,0,2]=4 10 B11R1.40 C#C[C@@H](O)Cc1ccccc1 Amb25056589 [0,0,0,0,0,0|1,0,3]=4 11 B11R1.40 C=C(C=C)Nc1ccccc1 Amb25131122 [0,0,0,0,0,0|3,0,1]=4 12 B11R1.40 C=C(C=O)Oc1ccccc1 Amb18124880 [0,0,0,0,0,0|4,0,0]=4 13 B11R1.40 C=C(C=O)Sc1ccccc1 Amb25347672 [0,0,0,0,0,0|4,0,0]=4 14 B11R1.40 C=C(Cc1ccccc1)CCl Amb25185403 [0,0,0,0,0,0|3,0,0]=3 15 B11R1.40 C=CC(=O)Cc1cccc[n]1 Amb24425169 [0,0,0,0,0,0|2,0,1]=3 16 B11R1.40 C=CC(=O)Cc1ccccc1 Amb25353450 [0,0,0,0,0,0|1,0,1]=2 17 B11R1.40 C=CC(=O)Oc1ccccc1 Amb17934129 [0,0,0,0,0,0|2,0,1]=3 18 B11R1.40 C=CC(N)Cc1ccccc1 Amb25064298 [0,0,0,0,0,0|2,0,2]=4 19 B11R1.40 C=CC(O)Cc1ccccc1 Amb24664362 [0,0,0,0,0,0|1,0,3]=4 20 B11R1.40 C=C[C@H](Cc1ccccc1)N Amb10982592 [0,0,0,0,0,0|2,0,2]=4 21 B11R1.40 C=C[C@H](N)Cc1ccccc1 Amb19929662 [0,0,0,0,0,0|2,0,2]=4 22 B11R1.40 CC(=NC)Oc1ccccc1 Amb24066830 [0,0,0,0,0,0|3,0,0]=3 23 B11R1.40 CC(CBr)Cc1ccccc1 Amb25151397 [0,0,0,0,0,0|3,0,1]=4 24 B11R1.40 CC(CN)Cc1ccccc1 Amb18010535 [0,0,0,0,0,0|3,0,1]=4 25 B11R1.40 CC(Cc1ccccc1)=[N+]=[N-] Amb25173943 [0,0,0,0,0,0|3,0,0]=3 26 B11R1.40 CC(Cc1ccccc1)C#N Amb24402121 [0,0,0,0,0,0|3,0,1]=4 27 B11R1.40 CC(Cc1ccccc1)C=C Amb25850978 [0,0,0,0,0,0|2,0,2]=4 28 B11R1.40 CC(Cc1ccccc1)NN Amb22487303 [0,0,0,0,0,0|3,0,1]=4 29 B11R1.40 CC(Cc1ccccc1)[Mg]Br Amb22897350 [0,0,0,0,0,0|3,0,1]=4 30 B11R1.40 CC(Cc1ccccc1)[Zn]Br Amb22897866 [0,0,0,0,0,0|3,0,1]=4 31 B11R1.40 CCC(=N)Nc1ccc[n]c1 Amb24627657 [0,0,0,0,0,0|4,0,0]=4 32 B11R1.40 CCC(=O)Cc1cccnc1 Amb17477730 [0,0,0,0,0,0|2,0,0]=2 33 B11R1.40 CCC(=O)Cc1ccncc1 Amb17477729 [0,0,0,0,0,0|2,0,0]=2 34 B11R1.40 CCC(=O)Nc1c[n]c[n]c1 Amb25267928 [0,0,0,0,0,0|4,0,0]=4 35 B11R1.40 CCC(=O)Nc1ncccn1 Amb17775259 [0,0,0,0,0,0|4,0,0]=4 36 B11R1.40 CCC(=O)Oc1ccc[n]c1 Amb24674574 [0,0,0,0,0,0|3,0,0]=3 37 B11R1.40 CCC(=O)Oc1cccc[n]1 Amb25264358 [0,0,0,0,0,0|3,0,0]=3 38 B11R1.40 CCC(=O)Sc1[n]ccc[n]1 Amb24638147 [0,0,0,0,0,0|4,0,0]=4 39 B11R1.40 CCC(=S)Nc1ccccc1 Amb24757738 [0,0,0,0,0,0|2,1,0]=3 40 B11R1.40 CCC(Br)Cc1cc[n]cc1 Amb24353281 [0,0,0,0,0,0|3,0,1]=4 41 B11R1.40 CCC(Br)Cc1ccccc1 Amb25189250 [0,0,0,0,0,0|2,0,1]=3 42 B11R1.40 CCC(C)Cc1c[n]ccc1 Amb24085206 [0,0,0,0,0,0|3,0,1]=4 43 B11R1.40 CCC(C)Cc1cccc[n]1 Amb24089681 [0,0,0,0,0,0|3,0,1]=4 44 B11R1.40 CCC(C)Oc1ccccc1 Amb24350256 [0,0,0,0,0,0|3,0,1]=4 45 B11R1.40 CCC(C)Sc1ccccc1 Amb25698974 [0,0,0,0,0,0|3,0,1]=4 46 B11R1.40 CCC(Cc1ccccn1)Cl Amb17477711 [0,0,0,0,0,0|3,0,1]=4 47 B11R1.40 CCC(Cc1ccccn1)O Amb17477703 [0,0,0,0,0,0|2,0,2]=4 48 B11R1.40 CCC(Cc1cccnc1)Cl Amb17477713 [0,0,0,0,0,0|3,0,1]=4 49 B11R1.40 CCC(Cc1cccnc1)O Amb17477705 [0,0,0,0,0,0|2,0,2]=4 50 B11R1.40 CCC(Cc1ccncc1)Cl Amb17477712 [0,0,0,0,0,0|3,0,1]=4 51 B11R1.40 CCC(Cc1ccncc1)O Amb17477704 [0,0,0,0,0,0|2,0,2]=4 52 B11R1.40 CCC(Cl)Cc1ccccc1 Amb18177890 [0,0,0,0,0,0|2,0,1]=3 53 B11R1.40 CCN(C)Cc1c[n]ccc1 Amb25133981 [0,0,0,0,0,0|4,0,0]=4 54 B11R1.40 CCN(Cc1ccccc1)C Amb10807414 [0,0,0,0,0,0|3,0,0]=3 55 B11R1.40 CCN(Cc1ccccc1)N Amb17232076 [0,0,0,0,0,0|3,0,0]=3 56 B11R1.40 CCP(=O)Oc1ccccc1 Amb21963209 [0,0,0,0,0,0|3,0,0]=3 57 B11R1.40 CCS(=O)Cc1[n]ccc[n]1 Amb25853346 [0,0,0,0,0,0|4,0,0]=4 58 B11R1.40 CCS(=O)Cc1cc[n]cc1 Amb24690059 [0,0,0,0,0,0|3,0,0]=3 59 B11R1.40 CCS(=O)Cc1ccccc1 Amb24485048 [0,0,0,0,0,0|2,0,0]=2 60 B11R1.40 CCS(=O)Nc1ccccc1 Amb24752666 [0,0,0,0,0,0|3,0,0]=3 61 B11R1.40 CC[C@@H](Br)Cc1ccccc1 Amb25770013 [0,0,0,0,0,0|2,0,1]=3 62 B11R1.40 CC[C@@H](Cl)Cc1ccccc1 Amb24710145 [0,0,0,0,0,0|2,0,1]=3 63 B11R1.40 CC[C@@H](N)Cc1ccccc1 Amb22748727 [0,0,0,0,0,0|2,0,1]=3 64 B11R1.40 CC[C@@H](N)Cc1ccccc1 Amb25141525 [0,0,0,0,0,0|2,0,1]=3 65 B11R1.40 CC[C@@H](O)Cc1ccccc1 Amb19375372 [0,0,0,0,0,0|1,0,2]=3 66 B11R1.40 CC[C@H](Cl)Cc1ccccc1 Amb25765719 [0,0,0,0,0,0|2,0,1]=3 67 B11R1.40 CC[C@H](N)Cc1cccc[n]1 Amb24432851 [0,0,0,0,0,0|3,0,1]=4 68 B11R1.40 CC[C@H](N)Cc1ccccc1 Amb19929690 [0,0,0,0,0,0|2,0,1]=3 69 B11R1.40 CC\C(\I)=C/c1ccccc1 Amb22641702 [0,0,0,0,0,0|2,0,1]=3 70 B11R1.40 CC\C(\N)=N\c1ccccc1 Amb24453266 [0,0,0,0,0,0|3,0,0]=3 71 B11R1.40 CN(CCl)Cc1ccccc1 Amb25324443 [0,0,0,0,0,0|4,0,0]=4 72 B11R1.40 CN(CO)Cc1ccccc1 Amb24555500 [0,0,0,0,0,0|4,0,0]=4 73 B11R1.40 CN(Cc1ccccc1)C#N Amb25072835 [0,0,0,0,0,0|4,0,0]=4 74 B11R1.40 CN(Cc1ccccc1)C=S Amb25793091 [0,0,0,0,0,0|4,0,0]=4 75 B11R1.40 CN(Cc1ccccc1)N=O Amb24074071 [0,0,0,0,0,0|4,0,0]=4 76 B11R1.40 CNC(=N)Cc1cccc[n]1 Amb25261557 [0,0,0,0,0,0|3,0,0]=3 77 B11R1.40 CNC(=N)Nc1c[n]ccc1 Amb18796636 [0,0,0,0,0,0|4,0,0]=4 78 B11R1.40 CNC(=O)C[n+]1ccccc1 Amb10553027 [0,0,0,0,0,0|2,0,0]=2 79 B11R1.40 CNC(=O)Cc1c[n]c[n]c1 Amb25787810 [0,0,0,0,0,0|3,0,0]=3 80 B11R1.40 CNC(=O)Cc1c[n]cc[n]1 Amb25284121 [0,0,0,0,0,0|3,0,0]=3 81 B11R1.40 CNC(=O)Cc1cccnc1 Amb16231203 [0,0,0,0,0,0|2,0,0]=2 82 B11R1.40 CNC(=O)Cc1ccncc1 Amb16231202 [0,0,0,0,0,0|2,0,0]=2 83 B11R1.40 CNC(=O)Nc1[n]ccc[n]1 Amb24398836 [0,0,0,0,0,0|4,0,0]=4 84 B11R1.40 CNC(=O)Nc1ccc[n][n]1 Amb24485350 [0,0,0,0,0,0|4,0,0]=4 85 B11R1.40 CNC(=O)Nc1ccccn1 Amb2132780 [0,0,0,0,0,0|3,0,0]=3 86 B11R1.40 CNC(=O)Nc1cccnc1 Amb2132752 [0,0,0,0,0,0|3,0,0]=3 87 B11R1.40 CNC(=O)Oc1ccc[n]c1 Amb24362237 [0,0,0,0,0,0|3,0,0]=3 88 B11R1.40 CNC(=S)Cc1ccccc1 Amb24559245 [0,0,0,0,0,0|1,1,0]=2 89 B11R1.40 CNC(=S)Nc1ccccn1 Amb2548911 [0,0,0,0,0,0|3,1,0]=4 90 B11R1.40 CNC(Cc1ccccc1)C Amb17616872 [0,0,0,0,0,0|2,0,1]=3 91 B11R1.40 CNC(Cc1ccccn1)C Amb1995150 [0,0,0,0,0,0|3,0,1]=4 92 B11R1.40 CN[C@H](Cc1ccccc1)C Amb17616868 [0,0,0,0,0,0|2,0,1]=3 93 B11R1.40 CN\C(\Cl)=N\c1ccccc1 Amb24670343 [0,0,0,0,0,0|3,0,0]=3 94 B11R1.40 COC(=N)Cc1cc[n]cc1 Amb18182737 [0,0,0,0,0,0|2,0,0]=2 95 B11R1.40 COC(=N)Cc1ccc[n]c1 Amb18799364 [0,0,0,0,0,0|2,0,0]=2 96 B11R1.40 COC(=N)Cc1cccc[n]1 Amb18179377 [0,0,0,0,0,0|2,0,0]=2 97 B11R1.40 COC(=N)Cc1ccccc1 Amb17673180 [0,0,0,0,0,0|1,0,0]=1 98 B11R1.40 COC(=N)Cc1ccccc1 Amb22366095 [0,0,0,0,0,0|1,0,0]=1 99 B11R1.40 COC(=N)Nc1ccccc1 Amb24509579 [0,0,0,0,0,0|2,0,0]=2 100 B11R1.40 COC(=O)CC=1CNCCC1 Amb24511481 [0,0,0,0,0,0|1,0,3]=4 101 B11R1.40 COC(=O)Cc1c[n]c[n]c1 Amb25763089 [0,0,0,0,0,0|2,0,0]=2 102 B11R1.40 COC(=O)Cc1cc[n][n]c1 Amb22405879 [0,0,0,0,0,0|2,0,0]=2 103 B11R1.40 COC(=O)Cc1cc[n]c[n]1 Amb22500240 [0,0,0,0,0,0|2,0,0]=2 104 B11R1.40 COC(=O)Cc1cc[n]cc1 Amb20240688 [0,0,0,0,0,0|1,0,0]=1 105 B11R1.40 COC(=O)Cc1ccc[n]c1 Amb22497118 [0,0,0,0,0,0|1,0,0]=1 106 B11R1.40 COC(=O)Cc1ccccn1 Amb1223230 [0,0,0,0,0,0|1,0,0]=1 107 B11R1.40 COC(=O)Cc1ncccn1 Amb17912090 [0,0,0,0,0,0|2,0,0]=2 108 B11R1.40 COC(=O)Nc1c[n]c[n]c1 Amb25122552 [0,0,0,0,0,0|3,0,0]=3 109 B11R1.40 COC(=O)Nc1cc[n]c[n]1 Amb25701812 [0,0,0,0,0,0|3,0,0]=3 110 B11R1.40 COC(=O)Nc1ccc[n][n]1 Amb24356600 [0,0,0,0,0,0|3,0,0]=3 111 B11R1.40 COC(=O)Nc1ccccc1 Amb1200636 [0,0,0,0,0,0|1,0,0]=1 112 B11R1.40 COC(=O)Nc1ccccn1 Amb17860931 [0,0,0,0,0,0|2,0,0]=2 113 B11R1.40 COC(=O)Nc1cccnc1 Amb2222993 [0,0,0,0,0,0|2,0,0]=2 114 B11R1.40 COC(=O)Oc1ccccc1 Amb10807421 [0,0,0,0,0,0|1,0,0]=1 115 B11R1.40 COC(C)Cc1cc[n]cc1 Amb24485830 [0,0,0,0,0,0|2,0,1]=3 116 B11R1.40 COC(Cl)Cc1ccccc1 Amb24711453 [0,0,0,0,0,0|1,0,1]=2 117 B11R1.40 COC(O)Cc1ccccc1 Amb24659514 [0,0,0,0,0,0|0,0,2]=2 118 B11R1.40 CON(C)Cc1[n]ccc[n]1 Amb25822146 [0,0,0,0,0,0|4,0,0]=4 119 B11R1.40 CO[SiH](C)Cc1ccccc1 Amb19893555 [0,0,0,0,0,0|1,1,0]=2 120 B11R1.40 CO\C(=N/c1ccccc1)\[O-] Amb16224823 [0,0,0,0,0,0|1,0,1]=2 121 B11R1.40 CO\[N+](\[O-])=C\c1c[n]ccc1 Amb25083494 [0,0,0,0,0,0|2,0,2]=4 122 B11R1.40 CSC(=N)Cc1ccccc1 Amb25211803 [0,0,0,0,0,0|1,1,0]=2 123 B11R1.40 CSC(=N)Nc1cccc[n]1 Amb25148222 [0,0,0,0,0,0|3,1,0]=4 124 B11R1.40 CSC(=O)Cc1ccccc1 Amb25293907 [0,0,0,0,0,0|0,1,0]=1 125 B11R1.40 CSC(=O)Nc1[n]ccc[n]1 Amb25685276 [0,0,0,0,0,0|3,1,0]=4 126 B11R1.40 CSC(=O)Nc1ccc[n]c1 Amb24486137 [0,0,0,0,0,0|2,1,0]=3 127 B11R1.40 CSC(=S)C[N]1=CC=CC=C1 Amb17835327 [0,0,0,0,0,0|1,2,0]=3 128 B11R1.40 CSC(=S)C[n+]1ccccc1 Amb2228085 [0,0,0,0,0,0|1,2,0]=3 129 B11R1.40 C[C@@H](CN)Cc1ccccc1 Amb24615612 [0,0,0,0,0,0|3,0,1]=4 130 B11R1.40 C[C@H](CO)Cc1ccccc1 Amb25266388 [0,0,0,0,0,0|3,0,1]=4 131 B11R1.40 C[C@H](Cc1ccccc1)C=O Amb25255421 [0,0,0,0,0,0|3,0,1]=4 132 B11R1.40 C\C(=C/Cl)\Sc1ccccc1 Amb24694004 [0,0,0,0,0,0|4,0,0]=4 133 B11R1.40 C\C(=C/c1cc[n]cc1)\NC Amb25727273 [0,0,0,0,0,0|3,0,1]=4 134 B11R1.40 C\C(=C/c1ccccc1)\C#N Amb18644009 [0,0,0,0,0,0|3,0,1]=4 135 B11R1.40 C\C(=C/c1ccccc1)\NC Amb25825428 [0,0,0,0,0,0|2,0,1]=3 136 B11R1.40 C\C(=C\c1ccccc1)\C=O Amb22058732 [0,0,0,0,0,0|3,0,1]=4 137 B11R1.40 C\C(=C\c1ccccc1)\N=O Amb25246172 [0,0,0,0,0,0|3,0,1]=4 138 B11R1.40 C\C(=N/c1[n]ccc[n]1)\OC Amb25279307 [0,0,0,0,0,0|4,0,0]=4 139 B11R1.40 C\C(=N\c1cccc[n]1)\OC Amb24095834 [0,0,0,0,0,0|3,0,0]=3 140 B11R1.40 C\C(\CBr)=C/c1ccccc1 Amb24605004 [0,0,0,0,0,0|3,0,1]=4 141 B11R1.40 C\C(\CC)=C\c1ccccc1 Amb22546773 [0,0,0,0,0,0|2,0,1]=3 142 B11R1.40 C\C(\CN)=C/c1ccccc1 Amb25076849 [0,0,0,0,0,0|3,0,1]=4 143 B11R1.40 C\C(\CN)=C\c1ccccc1 Amb24634730 [0,0,0,0,0,0|3,0,1]=4 144 B11R1.40 C\C(\Cc1cc[n]cc1)=N/O Amb24630186 [0,0,0,0,0,0|4,0,0]=4 145 B11R1.40 C\C(\Cc1cc[n]cc1)=N\O Amb24417230 [0,0,0,0,0,0|4,0,0]=4 146 B11R1.40 C\C(\Cc1cccc[n]1)=N\N Amb25760219 [0,0,0,0,0,0|4,0,0]=4 147 B11R1.40 C\C(\Cc1ccccc1)=C\Cl Amb24718044 [0,0,0,0,0,0|3,0,0]=3 148 B11R1.40 C\C(\Cc1ccccc1)=N\N Amb24501436 [0,0,0,0,0,0|3,0,0]=3 149 B11R1.40 C\C(\NC)=N/c1c[n]ccc1 Amb25145908 [0,0,0,0,0,0|4,0,0]=4 150 B11R1.40 C\C(\NC)=N/c1cccc[n]1 Amb24679597 [0,0,0,0,0,0|4,0,0]=4 151 B11R1.40 C\N=C(/N)\Cc1c[n]ccc1 Amb24062497 [0,0,0,0,0,0|3,0,0]=3 152 B11R1.40 C\N=C(\N)/Cc1ccccc1 Amb23569051 [0,0,0,0,0,0|2,0,0]=2 153 B11R1.40 ClC(Cc1ccccc1)C#N Amb1103676 [0,0,0,0,0,0|3,0,1]=4 154 B11R1.40 ClCC(=O)Cc1ccccc1 Amb2371529 [0,0,0,0,0,0|2,0,0]=2 155 B11R1.40 ClCC(=O)Nc1ccccn1 Amb1129705 [0,0,0,0,0,0|4,0,0]=4 156 B11R1.40 ClCC(=O)Nc1cccnc1 Amb1126278 [0,0,0,0,0,0|4,0,0]=4 157 B11R1.40 ClCC(=O)Nc1ccncc1 Amb1124841 [0,0,0,0,0,0|4,0,0]=4 158 B11R1.40 ClCC(=O)Oc1ccccc1 Amb1914503 [0,0,0,0,0,0|3,0,0]=3 159 B11R1.40 ClCC(Cc1ccccc1)C Amb17477588 [0,0,0,0,0,0|3,0,1]=4 160 B11R1.40 ClCC(Cl)Cc1ccccc1 Amb25061392 [0,0,0,0,0,0|3,0,1]=4 161 B11R1.40 ClC\C(\Br)=C\c1ccccc1 Amb25283246 [0,0,0,0,0,0|3,0,1]=4 162 B11R1.40 Cl\C(\CCl)=C/c1ccccc1 Amb25362063 [0,0,0,0,0,0|3,0,1]=4 163 B11R1.40 FCC(Br)Cc1ccccc1 Amb24611243 [0,0,0,0,0,0|3,0,1]=4 164 B11R1.40 FCC(Cc1ccccc1)N Amb17614462 [0,0,0,0,0,0|3,0,1]=4 165 B11R1.40 FCC(F)Cc1ccccc1 Amb22641518 [0,0,0,0,0,0|3,0,1]=4 166 B11R1.40 F\C(\CBr)=C\c1ccccc1 Amb24745736 [0,0,0,0,0,0|3,0,1]=4 167 B11R1.40 N#C[C@@H](O)Cc1ccccc1 Amb24715921 [0,0,0,0,0,0|2,0,2]=4 168 B11R1.40 N#C[C@H](O)Cc1ccccc1 Amb25846935 [0,0,0,0,0,0|2,0,2]=4 169 B11R1.40 N#C\C(\Cl)=C/c1ccccc1 Amb25209358 [0,0,0,0,0,0|3,0,1]=4 170 B11R1.40 N#C\C(\Cl)=C\c1ccccc1 Amb18126389 [0,0,0,0,0,0|3,0,1]=4 171 B11R1.40 N#C\C(\F)=C/c1ccccc1 Amb25187404 [0,0,0,0,0,0|3,0,1]=4 172 B11R1.40 N#C\C(\F)=C\c1ccccc1 Amb18644314 [0,0,0,0,0,0|3,0,1]=4 173 B11R1.40 N=C(CS)Nc1ccccc1 Amb25194642 [0,0,0,0,0,0|4,0,0]=4 174 B11R1.40 N=C(Cc1ccccc1)NO Amb20671380 [0,0,0,0,0,0|3,0,0]=3 175 B11R1.40 NC(CBr)Cc1ccccc1 Amb22489725 [0,0,0,0,0,0|3,0,1]=4 176 B11R1.40 NC(Cc1c[n]ccc1)=NN Amb18182746 [0,0,0,0,0,0|4,0,0]=4 177 B11R1.40 NC(Cc1cc[n]cc1)=NN Amb18182747 [0,0,0,0,0,0|4,0,0]=4 178 B11R1.40 NC(Cc1ccccc1)=S=O Amb25053951 [0,0,0,0,0,0|2,1,0]=3 179 B11R1.40 NC(Cc1ccccc1)C#N Amb1127111 [0,0,0,0,0,0|3,0,1]=4 180 B11R1.40 NC(Cc1ccccc1)NO Amb25047325 [0,0,0,0,0,0|3,0,1]=4 181 B11R1.40 NC(Nc1ccccc1)=NO Amb18799378 [0,0,0,0,0,0|4,0,0]=4 182 B11R1.40 NCC(=N)Nc1ccccc1 Amb24746458 [0,0,0,0,0,0|4,0,0]=4 183 B11R1.40 NCC(=O)Cc1c[n]ccc1 Amb18251321 [0,0,0,0,0,0|3,0,0]=3 184 B11R1.40 NCC(=O)Cc1cc[n]cc1 Amb18201930 [0,0,0,0,0,0|3,0,0]=3 185 B11R1.40 NCC(=O)Cc1cccc[n]1 Amb18908409 [0,0,0,0,0,0|3,0,0]=3 186 B11R1.40 NCC(=O)Cc1ccccc1 Amb18202084 [0,0,0,0,0,0|2,0,0]=2 187 B11R1.40 NCC(=O)Cc1ccccc1 Amb19516183 [0,0,0,0,0,0|2,0,0]=2 188 B11R1.40 NCC(=O)Nc1ccc[n]c1 Amb21987914 [0,0,0,0,0,0|4,0,0]=4 189 B11R1.40 NCC(=O)Nc1ccccc1 Amb10609338 [0,0,0,0,0,0|3,0,0]=3 190 B11R1.40 NCC(=O)Nc1ccccn1 Amb15741010 [0,0,0,0,0,0|4,0,0]=4 191 B11R1.40 NCC(=O)Nc1ccncc1 Amb15741011 [0,0,0,0,0,0|4,0,0]=4 192 B11R1.40 NCC(=O)Oc1ccccc1 Amb17334310 [0,0,0,0,0,0|3,0,0]=3 193 B11R1.40 NCC(=S)Nc1ccccc1 Amb25128037 [0,0,0,0,0,0|3,1,0]=4 194 B11R1.40 NCC(Cl)Cc1ccccc1 Amb24740670 [0,0,0,0,0,0|3,0,1]=4 195 B11R1.40 NCC(F)Cc1ccccc1 Amb24434017 [0,0,0,0,0,0|3,0,1]=4 196 B11R1.40 NCC(S)Cc1ccccc1 Amb18251941 [0,0,0,0,0,0|2,1,1]=4 197 B11R1.40 NC[C@@H](Cc1ccccc1)N Amb17619359 [0,0,0,0,0,0|3,0,1]=4 198 B11R1.40 NC[C@@H](O)Cc1ccccc1 Amb22746804 [0,0,0,0,0,0|2,0,2]=4 199 B11R1.40 NC[C@H](Cc1ccccc1)N Amb17619360 [0,0,0,0,0,0|3,0,1]=4 200 B11R1.40 NC[C@H](O)Cc1ccccc1 Amb24538166 [0,0,0,0,0,0|2,0,2]=4 201 B11R1.40 NC\C(\Cl)=C\c1ccccc1 Amb25259250 [0,0,0,0,0,0|3,0,1]=4 202 B11R1.40 NNC(=N)Nc1ccccc1 Amb22459345 [0,0,0,0,0,0|4,0,0]=4 203 B11R1.40 NNC(=O)C[N]1=CC=CC=C1 Amb17836433 [0,0,0,0,0,0|3,0,0]=3 204 B11R1.40 NNC(=O)C[n+]1ccccc1 Amb10552843 [0,0,0,0,0,0|3,0,0]=3 205 B11R1.40 NNC(=O)C[n+]1ccccc1 Amb1154171 [0,0,0,0,0,0|3,0,0]=3 206 B11R1.40 NNC(=O)C[n+]1ccccc1 Amb19748594 [0,0,0,0,0,0|3,0,0]=3 207 B11R1.40 NNC(=O)Cc1c[n]c[n]c1 Amb20092729 [0,0,0,0,0,0|4,0,0]=4 208 B11R1.40 NNC(=O)Cc1c[n]cc[n]1 Amb25306562 [0,0,0,0,0,0|4,0,0]=4 209 B11R1.40 NNC(=O)Cc1cccc[n]1 Amb19373217 [0,0,0,0,0,0|3,0,0]=3 210 B11R1.40 NNC(=O)Cc1ccccc1 Amb24081244 [0,0,0,0,0,0|2,0,0]=2 211 B11R1.40 NNC(=O)Cc1ccncc1 Amb1133661 [0,0,0,0,0,0|3,0,0]=3 212 B11R1.40 NNC(=O)Nc1c[n]ccc1 Amb24433263 [0,0,0,0,0,0|4,0,0]=4 213 B11R1.40 NNC(=O)Nc1cc[n]cc1 Amb25148277 [0,0,0,0,0,0|4,0,0]=4 214 B11R1.40 NNC(=O)Nc1ccccc1 Amb1204373 [0,0,0,0,0,0|3,0,0]=3 215 B11R1.40 NNC(=S)Cc1ccccc1 Amb24377114 [0,0,0,0,0,0|2,1,0]=3 216 B11R1.40 NN\C(=N/c1ccccc1)\S Amb2502886 [0,0,0,0,0,0|3,1,0]=4 217 B11R1.40 NOC(=O)Nc1ccccc1 Amb24484939 [0,0,0,0,0,0|2,0,0]=2 218 B11R1.40 N[C@@H](CBr)Cc1ccccc1 Amb22747782 [0,0,0,0,0,0|3,0,1]=4 219 B11R1.40 N[C@@H](CCl)Cc1ccccc1 Amb24758237 [0,0,0,0,0,0|3,0,1]=4 220 B11R1.40 N[C@@H](CF)Cc1ccccc1 Amb24484482 [0,0,0,0,0,0|3,0,1]=4 221 B11R1.40 N[C@@H](CO)Cc1ccccc1 Amb20242871 [0,0,0,0,0,0|3,0,1]=4 222 B11R1.40 N[C@@H](CS)Cc1ccccc1 Amb25073967 [0,0,0,0,0,0|3,0,1]=4 223 B11R1.40 N[C@@H](Cc1ccccc1)C#N Amb17399902 [0,0,0,0,0,0|3,0,1]=4 224 B11R1.40 N[C@H](CCl)Cc1ccccc1 Amb24533056 [0,0,0,0,0,0|3,0,1]=4 225 B11R1.40 N[C@H](CF)Cc1ccccc1 Amb25151303 [0,0,0,0,0,0|3,0,1]=4 226 B11R1.40 N[C@H](CS)Cc1ccccc1 Amb25765677 [0,0,0,0,0,0|3,0,1]=4 227 B11R1.40 N[C@H](Cc1ccccc1)C=O Amb24746755 [0,0,0,0,0,0|3,0,1]=4 228 B11R1.40 N\C(\C#N)=N\c1ccccc1 Amb24680966 [0,0,0,0,0,0|4,0,0]=4 229 B11R1.40 N\C(\Cc1cccc[n]1)=N\N Amb18177153 [0,0,0,0,0,0|4,0,0]=4 230 B11R1.40 N\C(\Cc1ccccc1)=C\O Amb25152159 [0,0,0,0,0,0|3,0,0]=3 231 B11R1.40 N\C(\Cc1ccccc1)=N/N Amb17933233 [0,0,0,0,0,0|3,0,0]=3 232 B11R1.40 N\C(\Cc1ccccc1)=N\Cl Amb25689858 [0,0,0,0,0,0|3,0,0]=3 233 B11R1.40 N\C(\Nc1ccccc1)=N\N Amb25046170 [0,0,0,0,0,0|4,0,0]=4 234 B11R1.40 N\N=C(\Cl)/Cc1ccccc1 Amb25188651 [0,0,0,0,0,0|3,0,0]=3 235 B11R1.40 O=C(C=O)Nc1cc[n]cc1 Amb24360354 [0,0,0,0,0,0|4,0,0]=4 236 B11R1.40 O=C(C=O)Oc1c[n]ccc1 Amb24484745 [0,0,0,0,0,0|4,0,0]=4 237 B11R1.40 O=C(C=O)Oc1ccccc1 Amb18125060 [0,0,0,0,0,0|3,0,0]=3 238 B11R1.40 O=C(CBr)C[n+]1ccccc1 Amb24641641 [0,0,0,0,0,0|3,0,0]=3 239 B11R1.40 O=C(CBr)Sc1ccccc1 Amb24730786 [0,0,0,0,0,0|3,0,0]=3 240 B11R1.40 O=C(CCl)Nc1cc[n]cc1 Amb20623041 [0,0,0,0,0,0|4,0,0]=4 241 B11R1.40 O=C(CCl)Nc1ccc[n]c1 Amb19373564 [0,0,0,0,0,0|4,0,0]=4 242 B11R1.40 O=C(CCl)Nc1cccc[n]1 Amb22054725 [0,0,0,0,0,0|4,0,0]=4 243 B11R1.40 O=C(CCl)Sc1ccccc1 Amb24712200 [0,0,0,0,0,0|3,0,0]=3 244 B11R1.40 O=C(CF)Nc1cccc[n]1 Amb24452192 [0,0,0,0,0,0|4,0,0]=4 245 B11R1.40 O=C(CF)Nc1ccccc1 Amb20246909 [0,0,0,0,0,0|3,0,0]=3 246 B11R1.40 O=C(CI)Nc1ccccc1 Amb21964671 [0,0,0,0,0,0|3,0,0]=3 247 B11R1.40 O=C(CP)Nc1ccccc1 Amb25032359 [0,0,0,0,0,0|3,0,0]=3 248 B11R1.40 O=C(CS)Nc1ccc[n]c1 Amb25147953 [0,0,0,0,0,0|4,0,0]=4 249 B11R1.40 O=C(CS)Nc1cccc[n]1 Amb20622356 [0,0,0,0,0,0|4,0,0]=4 250 B11R1.40 O=C(Cc1cc[n]cc1)CCl Amb22494556 [0,0,0,0,0,0|3,0,0]=3 251 B11R1.40 O=C(Cc1ccccc1)CF Amb22234964 [0,0,0,0,0,0|2,0,0]=2 252 B11R1.40 O=C(Cc1ccccc1)CS Amb25294429 [0,0,0,0,0,0|2,0,0]=2 253 B11R1.40 O=C(Cc1ccccc1)O[Ag] Amb22359200 [0,0,0,0,0,0|1,0,0]=1 254 B11R1.40 O=C(Nc1ccccc1)NCl Amb25756195 [0,0,0,0,0,0|3,0,0]=3 255 B11R1.40 O=C(Nc1ccccc1)SCl Amb25095177 [0,0,0,0,0,0|2,1,0]=3 256 B11R1.40 O=CC(=O)Cc1ccccc1 Amb17593687 [0,0,0,0,0,0|2,0,0]=2 257 B11R1.40 O=CC(Br)Cc1ccccc1 Amb18657408 [0,0,0,0,0,0|3,0,1]=4 258 B11R1.40 O=CC(Cc1ccccc1)Cl Amb17204312 [0,0,0,0,0,0|3,0,1]=4 259 B11R1.40 O=CC(F)Cc1ccccc1 Amb24714702 [0,0,0,0,0,0|3,0,1]=4 260 B11R1.40 O=C[C@@H](Br)Cc1ccccc1 Amb24461614 [0,0,0,0,0,0|3,0,1]=4 261 B11R1.40 O=C[C@@H](F)Cc1ccccc1 Amb24724556 [0,0,0,0,0,0|3,0,1]=4 262 B11R1.40 O=C[C@H](Br)Cc1ccccc1 Amb25778238 [0,0,0,0,0,0|3,0,1]=4 263 B11R1.40 O=C\C(\Br)=C/c1ccccc1 Amb25047719 [0,0,0,0,0,0|3,0,1]=4 264 B11R1.40 O=C\C(\F)=C/c1ccccc1 Amb25714375 [0,0,0,0,0,0|3,0,1]=4 265 B11R1.40 O=C\C(\F)=C\c1ccccc1 Amb18125101 [0,0,0,0,0,0|3,0,1]=4 266 B11R1.40 O=N\C(\Br)=C\c1ccccc1 Amb24666519 [0,0,0,0,0,0|3,0,1]=4 267 B11R1.40 O=S(CCl)Cc1ccccc1 Amb24373167 [0,0,0,0,0,0|3,0,0]=3 268 B11R1.40 OC(CF)Cc1ccccc1 Amb24733743 [0,0,0,0,0,0|2,0,2]=4 269 B11R1.40 OC(CS)Cc1ccccc1 Amb25740621 [0,0,0,0,0,0|2,0,2]=4 270 B11R1.40 OC(Cc1ccccc1)C=O Amb25065752 [0,0,0,0,0,0|2,0,2]=4 271 B11R1.40 OCC(=O)Cc1ccccc1 Amb18182729 [0,0,0,0,0,0|2,0,0]=2 272 B11R1.40 OCC(=O)Nc1ccccc1 Amb1110212 [0,0,0,0,0,0|3,0,0]=3 273 B11R1.40 OCC(=O)Oc1ccccc1 Amb25149728 [0,0,0,0,0,0|3,0,0]=3 274 B11R1.40 OCC(Cc1ccccc1)C Amb17477578 [0,0,0,0,0,0|3,0,1]=4 275 B11R1.40 OCC(Cc1ccccc1)O Amb17593786 [0,0,0,0,0,0|2,0,2]=4 276 B11R1.40 OCC(Cl)Cc1ccccc1 Amb24373181 [0,0,0,0,0,0|3,0,1]=4 277 B11R1.40 OCC(F)Cc1ccccc1 Amb25225922 [0,0,0,0,0,0|3,0,1]=4 278 B11R1.40 OC[C@@H](O)Cc1ccccc1 Amb25204361 [0,0,0,0,0,0|2,0,2]=4 279 B11R1.40 OC[C@H](Br)Cc1ccccc1 Amb24639076 [0,0,0,0,0,0|3,0,1]=4 280 B11R1.40 OC[C@H](O)Cc1ccccc1 Amb24392862 [0,0,0,0,0,0|2,0,2]=4 281 B11R1.40 OC\C(\Br)=C\c1ccccc1 Amb25187542 [0,0,0,0,0,0|3,0,1]=4 282 B11R1.40 ON=C(Cc1ccccn1)N Amb13994155 [0,0,0,0,0,0|4,0,0]=4 283 B11R1.40 ONC(=O)Cc1ccc[n]c1 Amb25052392 [0,0,0,0,0,0|3,0,0]=3 284 B11R1.40 ONC(=O)Oc1ccccc1 Amb22493600 [0,0,0,0,0,0|3,0,0]=3 285 B11R1.40 O[C@@H](CCl)Cc1ccccc1 Amb19929327 [0,0,0,0,0,0|2,0,2]=4 286 B11R1.40 O[C@H](CBr)Cc1ccccc1 Amb24392488 [0,0,0,0,0,0|2,0,2]=4 287 B11R1.40 O[C@H](CCl)Cc1ccccc1 Amb19929332 [0,0,0,0,0,0|2,0,2]=4 288 B11R1.40 O[C@H](Cc1ccccc1)C=O Amb25683436 [0,0,0,0,0,0|2,0,2]=4 289 B11R1.40 O\C(=C/c1ccccc1)\C=O Amb18124881 [0,0,0,0,0,0|2,0,2]=4 290 B11R1.40 O\C(=C\c1ccccc1)\C=O Amb24595210 [0,0,0,0,0,0|2,0,2]=4 291 B11R1.40 O\C(\Cc1ccccc1)=N/O Amb19986986 [0,0,0,0,0,0|2,0,1]=3 292 B11R1.40 O\N=C(/Cc1ccccc1)\N Amb1106303 [0,0,0,0,0,0|3,0,0]=3 293 B11R1.40 O\N=C(\Cc1ccccc1)/N Amb1159399 [0,0,0,0,0,0|3,0,0]=3 294 B11R1.40 O\N=C(\Cl)/Cc1ccccc1 Amb25721012 [0,0,0,0,0,0|3,0,0]=3 295 B11R1.40 SCC(=O)Nc1ccccc1 Amb1349645 [0,0,0,0,0,0|3,0,0]=3 296 B10R1.17 Br[Mg]CCc1ccccc1 Amb22000585 [1,0,0,0,0,0|2,0,1]=4 297 B10R1.17 Br[Zn]CCc1ccccc1 Amb22000434 [1,0,0,0,0,0|2,0,1]=4 298 B10R1.17 Br\C=C/Oc1ccccc1 Amb25794486 [1,0,0,0,0,0|3,0,0]=4 299 B10R1.17 Br\C=C\Cc1ccccc1 Amb22053885 [1,0,0,0,0,0|2,0,0]=3 300 B10R1.17 C#C\C=C\c1ccccc1 Amb25146407 [1,0,0,0,0,0|1,0,2]=4 301 B10R1.17 C=C/C=C/c1ccccc1 Amb17938988 [1,0,0,0,0,0|1,0,2]=4 302 B10R1.17 C=C=CCc1cccc[n]1 Amb24649907 [1,0,0,0,0,0|2,0,1]=4 303 B10R1.17 C=C=COc1ccccc1 Amb17673264 [1,0,0,0,0,0|2,0,1]=4 304 B10R1.17 C=CNCc1ccccc1 Amb24505107 [1,0,0,0,0,0|2,0,1]=4 305 B10R1.17 C=COCc1ccccc1 Amb17940722 [1,0,0,0,0,0|2,0,1]=4 306 B10R1.17 C=NOCc1ccccc1 Amb24704253 [1,0,0,0,0,0|2,0,1]=4 307 B10R1.17 CC#COc1ccccc1 Amb25146348 [1,0,0,0,0,0|2,0,1]=4 308 B10R1.17 CC/C=C/c1ccccc1 Amb17673826 [1,0,0,0,0,0|1,0,1]=3 309 B10R1.17 CCC=Cc1c[n]ccc1 Amb24085334 [1,0,0,0,0,0|2,0,1]=4 310 B10R1.17 CCCCc1ccccn1 Amb10574134 [1,0,0,0,0,0|2,0,1]=4 311 B10R1.17 CCCCc1ccncc1 Amb10555008 [1,0,0,0,0,0|2,0,1]=4 312 B10R1.17 CCCNc1ccccc1 Amb22284540 [1,0,0,0,0,0|2,0,1]=4 313 B10R1.17 CCN=Cc1ccccc1 Amb15692852 [1,0,0,0,0,0|2,0,1]=4 314 B10R1.17 CCNCc1c[n]ccc1 Amb21972163 [1,0,0,0,0,0|3,0,0]=4 315 B10R1.17 CCNCc1ccncc1 Amb1214646 [1,0,0,0,0,0|3,0,0]=4 316 B10R1.17 CC\C=C/c1c[n]ccc1 Amb24602371 [1,0,0,0,0,0|2,0,1]=4 317 B10R1.17 CC\C=C/c1cc[n]cc1 Amb25831273 [1,0,0,0,0,0|2,0,1]=4 318 B10R1.17 CC\C=C\c1cc[n]cc1 Amb25379243 [1,0,0,0,0,0|2,0,1]=4 319 B10R1.17 CC\C=C\c1cccc[n]1 Amb22170387 [1,0,0,0,0,0|2,0,1]=4 320 B10R1.17 CC\N=C\c1ccccc1 Amb10558476 [1,0,0,0,0,0|2,0,1]=4 321 B10R1.17 CN/N=C/c1ccccc1 Amb17867553 [1,0,0,0,0,0|2,0,1]=4 322 B10R1.17 CN=C=Nc1ccccc1 Amb24096797 [1,0,0,0,0,0|2,0,1]=4 323 B10R1.17 CNCCc1cc[n]cc1 Amb19958269 [1,0,0,0,0,0|2,0,1]=4 324 B10R1.17 CNCCc1cccc[n]1 Amb22167479 [1,0,0,0,0,0|2,0,1]=4 325 B10R1.17 CNCCc1ccccc1 Amb1132990 [1,0,0,0,0,0|1,0,1]=3 326 B10R1.17 CNCCc1ccccc1 Amb2119452 [1,0,0,0,0,0|1,0,1]=3 327 B10R1.17 CNCCc1ccccn1 Amb1651624 [1,0,0,0,0,0|2,0,1]=4 328 B10R1.17 CNCCc1cccnc1 Amb10068754 [1,0,0,0,0,0|2,0,1]=4 329 B10R1.17 CNCCc1cccnc1 Amb10576212 [1,0,0,0,0,0|2,0,1]=4 330 B10R1.17 CNCCc1cccnc1 Amb10576410 [1,0,0,0,0,0|2,0,1]=4 331 B10R1.17 CNCCc1ccncc1 Amb10071184 [1,0,0,0,0,0|2,0,1]=4 332 B10R1.17 CNNCc1c[n]ccc1 Amb24558769 [1,0,0,0,0,0|3,0,0]=4 333 B10R1.17 CNNCc1ccccc1 Amb10553073 [1,0,0,0,0,0|2,0,0]=3 334 B10R1.17 CNOCc1ccccc1 Amb22059601 [1,0,0,0,0,0|2,0,0]=3 335 B10R1.17 CN\C=N\c1c[n]ccc1 Amb24671021 [1,0,0,0,0,0|3,0,0]=4 336 B10R1.17 CN\C=N\c1cc[n]cc1 Amb25147549 [1,0,0,0,0,0|3,0,0]=4 337 B10R1.17 CN\C=N\c1ccccc1 Amb25348617 [1,0,0,0,0,0|2,0,0]=3 338 B10R1.17 CN\N=N\c1ccccc1 Amb25720206 [1,0,0,0,0,0|3,0,0]=4 339 B10R1.17 COCCN1CC=CC=C1 Amb24064033 [1,0,0,0,0,0|1,0,2]=4 340 B10R1.17 COCC[n+]1ccccc1 Amb10554471 [1,0,0,0,0,0|1,0,1]=3 341 B10R1.17 COCCc1cccc[n]1 Amb24089662 [1,0,0,0,0,0|1,0,1]=3 342 B10R1.17 COCNc1ccccc1 Amb10565397 [1,0,0,0,0,0|1,0,1]=3 343 B10R1.17 COCOc1cccnc1 Amb10561791 [1,0,0,0,0,0|2,0,1]=4 344 B10R1.17 COCSc1cc[n]cc1 Amb25185189 [1,0,0,0,0,0|2,0,1]=4 345 B10R1.17 COCSc1cccc[n]1 Amb24482838 [1,0,0,0,0,0|2,0,1]=4 346 B10R1.17 CON=Cc1ccccc1 Amb22896936 [1,0,0,0,0,0|1,0,1]=3 347 B10R1.17 CONCc1c[n]c[n]c1 Amb24756315 [1,0,0,0,0,0|3,0,0]=4 348 B10R1.17 CONCc1c[n]ccc1 Amb24062508 [1,0,0,0,0,0|2,0,0]=3 349 B10R1.17 CONCc1cc[n]cc1 Amb25046027 [1,0,0,0,0,0|2,0,0]=3 350 B10R1.17 CONCc1cccc[n]1 Amb25723329 [1,0,0,0,0,0|2,0,0]=3 351 B10R1.17 CO\C=C/c1c[n]ccc1 Amb24085685 [1,0,0,0,0,0|1,0,1]=3 352 B10R1.17 CO\C=C/c1cc[n]cc1 Amb24103279 [1,0,0,0,0,0|1,0,1]=3 353 B10R1.17 CO\C=C/c1cccc[n]1 Amb24106783 [1,0,0,0,0,0|1,0,1]=3 354 B10R1.17 CO\C=C\c1c[n]ccc1 Amb24085666 [1,0,0,0,0,0|1,0,1]=3 355 B10R1.17 CO\C=C\c1ccccc1 Amb22002452 [1,0,0,0,0,0|0,0,1]=2 356 B10R1.17 CO\C=N\c1c[n]ccc1 Amb25217756 [1,0,0,0,0,0|2,0,0]=3 357 B10R1.17 CO\N=C\c1cc[n]cc1 Amb25173617 [1,0,0,0,0,0|2,0,1]=4 358 B10R1.17 CO\N=C\c1cccc[n]1 Amb24719324 [1,0,0,0,0,0|2,0,1]=4 359 B10R1.17 CO\N=C\c1ccccc1 Amb25762975 [1,0,0,0,0,0|1,0,1]=3 360 B10R1.17 CSCCc1cccc[n]1 Amb24552366 [1,0,0,0,0,0|1,1,1]=4 361 B10R1.17 CSCCc1ccncc1 Amb1864660 [1,0,0,0,0,0|1,1,1]=4 362 B10R1.17 CSCOc1ccccc1 Amb22231357 [1,0,0,0,0,0|1,1,1]=4 363 B10R1.17 CSCSc1ccccc1 Amb25162526 [1,0,0,0,0,0|1,1,1]=4 364 B10R1.17 CSSCc1ccccc1 Amb22230274 [1,0,0,0,0,0|1,1,0]=3 365 B10R1.17 C\C=C/Oc1cccc[n]1 Amb24101907 [1,0,0,0,0,0|3,0,0]=4 366 B10R1.17 C\C=C\C[n+]1ccccc1 Amb24464480 [1,0,0,0,0,0|2,0,0]=3 367 B10R1.17 C\C=C\Oc1cccc[n]1 Amb24101879 [1,0,0,0,0,0|3,0,0]=4 368 B10R1.17 C\C=C\Oc1ccccc1 Amb10564701 [1,0,0,0,0,0|2,0,0]=3 369 B10R1.17 C\C=C\Sc1ccccc1 Amb24665698 [1,0,0,0,0,0|2,0,0]=3 370 B10R1.17 C\C=N\Cc1cc[n]cc1 Amb25243601 [1,0,0,0,0,0|3,0,0]=4 371 B10R1.17 ClC=CCc1ccccc1 Amb24093913 [1,0,0,0,0,0|2,0,0]=3 372 B10R1.17 ClCSCc1ccccc1 Amb16231183 [1,0,0,0,0,0|3,0,0]=4 373 B10R1.17 ClC[SiH2]Cc1ccccc1 Amb24433498 [1,0,0,0,0,0|2,1,0]=4 374 B10R1.17 Cl[Mg]CCc1ccccc1 Amb22338391 [1,0,0,0,0,0|2,0,1]=4 375 B10R1.17 Cl\C=C\C[n+]1ccccc1 Amb24396864 [1,0,0,0,0,0|3,0,0]=4 376 B10R1.17 Cl\C=C\Cc1cc[n]cc1 Amb24697784 [1,0,0,0,0,0|3,0,0]=4 377 B10R1.17 Cl\C=C\Cc1ccccc1 Amb24384369 [1,0,0,0,0,0|2,0,0]=3 378 B10R1.17 FCCCc1ccccc1 Amb25737014 [1,0,0,0,0,0|2,0,1]=4 379 B10R1.17 ICCCc1ccccc1 Amb10605506 [1,0,0,0,0,0|2,0,1]=4 380 B10R1.17 N#C[Se]Cc1ccccc1 Amb22731764 [1,0,0,0,0,0|3,0,0]=4 381 B10R1.17 N#C\C=C\c1ccccc1 Amb1678044 [1,0,0,0,0,0|2,0,1]=4 382 B10R1.17 N=COCc1ccccc1 Amb22269902 [1,0,0,0,0,0|3,0,0]=4 383 B10R1.17 N=COCc1ccccc1 Amb24652885 [1,0,0,0,0,0|3,0,0]=4 384 B10R1.17 NCCCc1ccccc1 Amb22490482 [1,0,0,0,0,0|2,0,1]=4 385 B10R1.17 NC\C=C/c1ccccc1 Amb24746209 [1,0,0,0,0,0|2,0,1]=4 386 B10R1.17 NC\C=C\c1ccccc1 Amb16187112 [1,0,0,0,0,0|2,0,1]=4 387 B10R1.17 NNCCc1ccccc1 Amb10608987 [1,0,0,0,0,0|2,0,1]=4 388 B10R1.17 NNCCc1ccccc1 Amb1117029 [1,0,0,0,0,0|2,0,1]=4 389 B10R1.17 NOCCc1c[n]ccc1 Amb25779030 [1,0,0,0,0,0|2,0,1]=4 390 B10R1.17 NOCCc1ccccn1 Amb17231907 [1,0,0,0,0,0|2,0,1]=4 391 B10R1.17 NOCCc1ccncc1 Amb17231908 [1,0,0,0,0,0|2,0,1]=4 392 B10R1.17 O=CNCc1ccccc1 Amb1916036 [1,0,0,0,0,0|3,0,0]=4 393 B10R1.17 O=C\C=C/c1ccccc1 Amb20246989 [1,0,0,0,0,0|2,0,1]=4 394 B10R1.17 O=C\C=N\c1ccccc1 Amb24561719 [1,0,0,0,0,0|3,0,0]=4 395 B10R1.17 OCNCc1ccccc1 Amb24756521 [1,0,0,0,0,0|3,0,0]=4 396 B10R1.17 OCOCc1ccccc1 Amb25727798 [1,0,0,0,0,0|3,0,0]=4 397 B10R1.17 OC\C=N\c1ccccc1 Amb25740591 [1,0,0,0,0,0|3,0,0]=4 398 B10R1.17 ONCCc1ccccc1 Amb24117032 [1,0,0,0,0,0|2,0,1]=4 399 B10R1.17 S=C=CNc1ccccc1 Amb25728146 [1,0,0,0,0,0|3,0,0]=4 400 B10R1.17 S=C=NCc1ccccc1 Amb1102095 [1,0,0,0,0,0|3,0,0]=4 401 B10R1.17 [C-]#[N+]CCc1ccccc1 Amb1981030 [1,0,0,0,0,0|1,0,2]=4 402 B10R1.17 [NH-]\[NH+]=N\Cc1ccccc1 Amb25857928 [1,0,0,0,0,0|3,0,0]=4 403 B10R1.17 [SiH3]CCCc1ccccc1 Amb22347053 [1,0,0,0,0,0|1,1,1]=4 404 B10R1.18 BrC(Br)=Cc1ccccc1 Amb17843371 [1,0,0,0,0,0|2,0,1]=4 405 B10R1.18 C=C(Cl)C[n+]1ccccc1 Amb24717958 [1,0,0,0,0,0|2,0,1]=4 406 B10R1.18 C=C(F)Sc1ccccc1 Amb24630548 [1,0,0,0,0,0|2,0,1]=4 407 B10R1.18 C=C(O)C=C1C=COC=C1 Amb24407180 [1,0,0,0,0,0|2,0,1]=4 408 B10R1.18 C=[N+]([O-])Cc1ccccc1 Amb24708106 [1,0,0,0,0,0|1,0,2]=4 409 B10R1.18 CC(=C)Nc1ccccc1 Amb25269461 [1,0,0,0,0,0|2,0,0]=3 410 B10R1.18 CC(=C)Oc1cccc[n]1 Amb24101320 [1,0,0,0,0,0|3,0,0]=4 411 B10R1.18 CC(=N)Cc1cccc[n]1 Amb25315666 [1,0,0,0,0,0|2,0,0]=3 412 B10R1.18 CC(=N)Nc1ccc[n]c1 Amb25848009 [1,0,0,0,0,0|3,0,0]=4 413 B10R1.18 CC(=N)Nc1ccccc1 Amb1086198 [1,0,0,0,0,0|2,0,0]=3 414 B10R1.18 CC(=O)CN1C=COC=C1 Amb25100926 [1,0,0,0,0,0|2,0,0]=3 415 B10R1.18 CC(=O)C[n+]1ccccc1 Amb1102043 [1,0,0,0,0,0|1,0,0]=2 416 B10R1.18 CC(=O)Cc1[n]ccc[n]1 Amb21864927 [1,0,0,0,0,0|2,0,0]=3 417 B10R1.18 CC(=O)Cc1c[n]c[n][n]1 Amb25174404 [1,0,0,0,0,0|3,0,0]=4 418 B10R1.18 CC(=O)Cc1c[n]c[n]c1 Amb25328576 [1,0,0,0,0,0|2,0,0]=3 419 B10R1.18 CC(=O)Cc1cc[n][n]c1 Amb22008576 [1,0,0,0,0,0|2,0,0]=3 420 B10R1.18 CC(=O)Cc1ccc[n]c1 Amb22587708 [1,0,0,0,0,0|1,0,0]=2 421 B10R1.18 CC(=O)Cc1ccccn1 Amb1995147 [1,0,0,0,0,0|1,0,0]=2 422 B10R1.18 CC(=O)Cc1cccnc1 Amb10608569 [1,0,0,0,0,0|1,0,0]=2 423 B10R1.18 CC(=O)Cc1ccncc1 Amb17935754 [1,0,0,0,0,0|1,0,0]=2 424 B10R1.18 CC(=O)Cc1cnccn1 Amb1995176 [1,0,0,0,0,0|2,0,0]=3 425 B10R1.18 CC(=O)N[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb17607311 [1,0,0,0,0,0|1,0,0]=2 426 B10R1.18 CC(=O)N[n+]1ccccc1 Amb10552800 [1,0,0,0,0,0|2,0,0]=3 427 B10R1.18 CC(=O)N[n+]1ccccc1 Amb10552804 [1,0,0,0,0,0|2,0,0]=3 428 B10R1.18 CC(=O)Nc1c[n]c[n]c1 Amb21962991 [1,0,0,0,0,0|3,0,0]=4 429 B10R1.18 CC(=O)Nc1cc[n]c[n]1 Amb24072458 [1,0,0,0,0,0|3,0,0]=4 430 B10R1.18 CC(=O)Nc1cc[n]cc1 Amb22451374 [1,0,0,0,0,0|2,0,0]=3 431 B10R1.18 CC(=O)Nc1cc[n]cc1 Amb24086636 [1,0,0,0,0,0|2,0,0]=3 432 B10R1.18 CC(=O)Oc1cc[n]c[n]1 Amb25357546 [1,0,0,0,0,0|3,0,0]=4 433 B10R1.18 CC(=O)Oc1cc[n]cc1 Amb22522585 [1,0,0,0,0,0|2,0,0]=3 434 B10R1.18 CC(=O)Oc1ccccc1 Amb22367025 [1,0,0,0,0,0|1,0,0]=2 435 B10R1.18 CC(=O)Oc1ccccn1 Amb17619694 [1,0,0,0,0,0|2,0,0]=3 436 B10R1.18 CC(=O)Sc1[n]ccc[n]1 Amb25365230 [1,0,0,0,0,0|3,0,0]=4 437 B10R1.18 CC(=O)Sc1ccccc1 Amb10575810 [1,0,0,0,0,0|1,0,0]=2 438 B10R1.18 CC(=O)[15NH]c1ccccc1 Amb22338649 [1,0,0,0,0,0|1,0,0]=2 439 B10R1.18 CC(=O)\C=C\1/C=CC=CS1 Amb24610243 [1,0,0,0,0,0|1,0,1]=3 440 B10R1.18 CC(Br)Cc1cc[n]cc1 Amb25208255 [1,0,0,0,0,0|2,0,1]=4 441 B10R1.18 CC(C)=Cc1c[n]ccc1 Amb24417745 [1,0,0,0,0,0|2,0,1]=4 442 B10R1.18 CC(C)=Nc1c[n]ccc1 Amb25337657 [1,0,0,0,0,0|3,0,0]=4 443 B10R1.18 CC(C)Cc1c[n]ccc1 Amb22043313 [1,0,0,0,0,0|2,0,1]=4 444 B10R1.18 CC(C)Cc1cc[n]cc1 Amb22353758 [1,0,0,0,0,0|2,0,1]=4 445 B10R1.18 CC(Cc1ccccc1)N Amb17608372 [1,0,0,0,0,0|1,0,1]=3 446 B10R1.18 CC(Cc1ccccn1)C Amb15691003 [1,0,0,0,0,0|2,0,1]=4 447 B10R1.18 CC(Cc1ccccn1)Cl Amb17477796 [1,0,0,0,0,0|2,0,1]=4 448 B10R1.18 CC(Cc1ccccn1)N Amb1995149 [1,0,0,0,0,0|2,0,1]=4 449 B10R1.18 CC(Cc1ccccn1)O Amb1995148 [1,0,0,0,0,0|1,0,2]=4 450 B10R1.18 CC(Cc1cccnc1)Cl Amb17477798 [1,0,0,0,0,0|2,0,1]=4 451 B10R1.18 CC(Cc1cccnc1)O Amb17477790 [1,0,0,0,0,0|1,0,2]=4 452 B10R1.18 CC(Cc1ccncc1)Cl Amb17477797 [1,0,0,0,0,0|2,0,1]=4 453 B10R1.18 CC(Cc1ccncc1)O Amb17477789 [1,0,0,0,0,0|1,0,2]=4 454 B10R1.18 CC(Cl)Cc1ccccc1 Amb18787554 [1,0,0,0,0,0|1,0,1]=3 455 B10R1.18 CC(Cl)Oc1ccccc1 Amb17689404 [1,0,0,0,0,0|2,0,1]=4 456 B10R1.18 CC(Cl)Sc1ccccc1 Amb17673697 [1,0,0,0,0,0|2,0,1]=4 457 B10R1.18 CC(I)Cc1ccccc1 Amb24616287 [1,0,0,0,0,0|1,0,1]=3 458 B10R1.18 CC(N)=Pc1ccccc1 Amb25351589 [1,0,0,0,0,0|2,0,0]=3 459 B10R1.18 CC(N)Cc1c[n]ccc1 Amb21972219 [1,0,0,0,0,0|2,0,1]=4 460 B10R1.18 CC(N)Cc1cc[n]cc1 Amb21972220 [1,0,0,0,0,0|2,0,1]=4 461 B10R1.18 CC(N)Cc1ccccc1 Amb22346639 [1,0,0,0,0,0|1,0,1]=3 462 B10R1.18 CC(N)Cc1ccccc1 Amb22352196 [1,0,0,0,0,0|1,0,1]=3 463 B10R1.18 CC(N)Oc1ccccc1 Amb25830517 [1,0,0,0,0,0|2,0,1]=4 464 B10R1.18 CC(O)Sc1ccccc1 Amb25045636 [1,0,0,0,0,0|1,0,2]=4 465 B10R1.18 CC(S)Cc1ccccc1 Amb18177239 [1,0,0,0,0,0|0,1,1]=3 466 B10R1.18 CN(C)Cc1cc[n]cc1 Amb20247602 [1,0,0,0,0,0|3,0,0]=4 467 B10R1.18 CN(C)Cc1ccccc1 Amb22359464 [1,0,0,0,0,0|2,0,0]=3 468 B10R1.18 CN(C)Nc1ccccc1 Amb25810299 [1,0,0,0,0,0|3,0,0]=4 469 B10R1.18 CS(=O)Cc1ccccc1 Amb10565296 [1,0,0,0,0,0|1,0,0]=2 470 B10R1.18 C[13C](=O)N[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367563 [1,0,0,0,0,0|1,0,0]=2 471 B10R1.18 C[C@@H](Cc1ccccc1)O Amb10068519 [1,0,0,0,0,0|0,0,2]=3 472 B10R1.18 C[C@@H](N)Cc1ccccc1 Amb19130510 [1,0,0,0,0,0|1,0,1]=3 473 B10R1.18 C[C@@H](N)Cc1ccccc1 Amb22745694 [1,0,0,0,0,0|1,0,1]=3 474 B10R1.18 C[C@@H](O)Cc1c[n]ccc1 Amb22896922 [1,0,0,0,0,0|1,0,2]=4 475 B10R1.18 C[C@@H](O)Cc1ccccc1 Amb17938083 [1,0,0,0,0,0|0,0,2]=3 476 B10R1.18 C[C@H](Cc1ccccc1)N Amb17608368 [1,0,0,0,0,0|1,0,1]=3 477 B10R1.18 C[C@H](N)Cc1cccc[n]1 Amb24451425 [1,0,0,0,0,0|2,0,1]=4 478 B10R1.18 C[SiH](C)Cc1ccccc1 Amb19893554 [1,0,0,0,0,0|1,1,0]=3 479 B10R1.18 C[Si](C)Cc1ccccc1 Amb24527863 [1,0,0,0,0,0|1,1,0]=3 480 B10R1.18 C\C(\N)=C\c1cccc[n]1 Amb24518492 [1,0,0,0,0,0|2,0,1]=4 481 B10R1.18 C\C(\O)=C/c1ccccc1 Amb24095309 [1,0,0,0,0,0|0,0,2]=3 482 B10R1.18 C\C(\O)=C\c1cccc[n]1 Amb24100261 [1,0,0,0,0,0|1,0,2]=4 483 B10R1.18 ClB(Cl)Cc1ccccc1 Amb25832795 [1,0,0,0,0,0|3,0,0]=4 484 B10R1.18 ClC(Cl)=Nc1ccccc1 Amb22336308 [1,0,0,0,0,0|3,0,0]=4 485 B10R1.18 ClC(Cl)Cc1ccccc1 Amb25783924 [1,0,0,0,0,0|2,0,1]=4 486 B10R1.18 ClP(Cl)Cc1ccccc1 Amb25838123 [1,0,0,0,0,0|3,0,0]=4 487 B10R1.18 FC(F)Cc1ccccc1 Amb19894546 [1,0,0,0,0,0|2,0,1]=4 488 B10R1.18 F\C(\Br)=C\c1ccccc1 Amb24053589 [1,0,0,0,0,0|2,0,1]=4 489 B10R1.18 N=C(O)Nc1ccccc1 Amb19516159 [1,0,0,0,0,0|2,0,0]=3 490 B10R1.18 NC(=N)Cc1cc[n]cc1 Amb22499359 [1,0,0,0,0,0|3,0,0]=4 491 B10R1.18 NC(=N)Cc1ccc[n]c1 Amb19890175 [1,0,0,0,0,0|3,0,0]=4 492 B10R1.18 NC(=N)Nc1ccccc1 Amb20249360 [1,0,0,0,0,0|3,0,0]=4 493 B10R1.18 NC(=N)Nc1ccccc1 Amb22732584 [1,0,0,0,0,0|3,0,0]=4 494 B10R1.18 NC(=N)Oc1ccccc1 Amb24432258 [1,0,0,0,0,0|3,0,0]=4 495 B10R1.18 NC(=O)C[n+]1ccccn1 Amb2228091 [1,0,0,0,0,0|3,0,0]=4 496 B10R1.18 NC(=O)Cc1[n]ccc[n]1 Amb22277045 [1,0,0,0,0,0|3,0,0]=4 497 B10R1.18 NC(=O)Cc1c[n]c[n]c1 Amb20092728 [1,0,0,0,0,0|3,0,0]=4 498 B10R1.18 NC(=O)Cc1cc[n]c[n]1 Amb23440836 [1,0,0,0,0,0|3,0,0]=4 499 B10R1.18 NC(=O)Cc1ccc[n]c1 Amb21856113 [1,0,0,0,0,0|2,0,0]=3 500 B10R1.18 NC(=O)Cc1ccccc1 Amb1224937 [1,0,0,0,0,0|1,0,0]=2 501 B10R1.18 NC(=O)Nc1cc[n]cc1 Amb23581130 [1,0,0,0,0,0|3,0,0]=4 502 B10R1.18 NC(=O)Nc1ccccc1 Amb2373965 [1,0,0,0,0,0|2,0,0]=3 503 B10R1.18 NC(=O)Nc1cccnc1 Amb1137270 [1,0,0,0,0,0|3,0,0]=4 504 B10R1.18 NC(=O)Oc1cccc[n]1 Amb25772133 [1,0,0,0,0,0|3,0,0]=4 505 B10R1.18 NC(=S)C[n+]1ccccc1 Amb17119656 [1,0,0,0,0,0|2,1,0]=4 506 B10R1.18 NC(=S)Cc1ccccc1 Amb1646714 [1,0,0,0,0,0|1,1,0]=3 507 B10R1.18 NC(=[NH2+])Nc1ccccc1 Amb22734963 [1,0,0,0,0,0|3,0,0]=4 508 B10R1.18 NC(O)Cc1ccccc1 Amb25348475 [1,0,0,0,0,0|1,0,1]=3 509 B10R1.18 NS(=N)Cc1ccccc1 Amb25258845 [1,0,0,0,0,0|3,0,0]=4 510 B10R1.18 N[C@@H](O)Cc1ccccc1 Amb25790547 [1,0,0,0,0,0|1,0,1]=3 511 B10R1.18 N[C@H](O)Cc1ccccc1 Amb24444592 [1,0,0,0,0,0|1,0,1]=3 512 B10R1.18 N\C(\O)=C\c1cccc[n]1 Amb24068863 [1,0,0,0,0,0|2,0,1]=4 513 B10R1.18 O=C(Br)Oc1ccccc1 Amb25174288 [1,0,0,0,0,0|2,0,0]=3 514 B10R1.18 O=C(Cl)Cc1cc[n]cc1 Amb24446208 [1,0,0,0,0,0|2,0,0]=3 515 B10R1.18 O=C(Cl)Cc1ccc[n]c1 Amb24605722 [1,0,0,0,0,0|2,0,0]=3 516 B10R1.18 O=C(Cl)Nc1ccccc1 Amb24425698 [1,0,0,0,0,0|2,0,0]=3 517 B10R1.18 O=C(Cl)Sc1cccc[n]1 Amb25273872 [1,0,0,0,0,0|3,0,0]=4 518 B10R1.18 O=C(F)Nc1ccccc1 Amb22731751 [1,0,0,0,0,0|2,0,0]=3 519 B10R1.18 OB(Cc1ccccc1)O Amb10071580 [1,0,0,0,0,0|1,0,1]=3 520 B10R1.18 OB(O)Cc1c[n]ccc1 Amb24699248 [1,0,0,0,0,0|2,0,1]=4 521 B10R1.18 OB(O)Cc1cc[n]cc1 Amb24105357 [1,0,0,0,0,0|2,0,1]=4 522 B10R1.18 OC(=O)CC=1CC=CCC1 Amb24120619 [1,0,0,0,0,0|0,0,2]=3 523 B10R1.18 OC(=O)C[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22353637 [1,0,0,0,0,0|0,0,0]=1 524 B10R1.18 OC(=O)C[N]1=CC=CC=C1 Amb17836439 [1,0,0,0,0,0|1,0,0]=2 525 B10R1.18 OC(=O)C[n+]1ccccc1 Amb10552774 [1,0,0,0,0,0|1,0,0]=2 526 B10R1.18 OC(=O)C[n+]1ccccc1 Amb23468426 [1,0,0,0,0,0|1,0,0]=2 527 B10R1.18 OC(=O)Cc1[n][n]cc[n]1 Amb18832133 [1,0,0,0,0,0|3,0,0]=4 528 B10R1.18 OC(=O)Cc1[n]c[n]c[n]1 Amb18223164 [1,0,0,0,0,0|3,0,0]=4 529 B10R1.18 OC(=O)Cc1c[n][n]c[n]1 Amb18832132 [1,0,0,0,0,0|3,0,0]=4 530 B10R1.18 OC(=O)Cc1c[n]cc[n]1 Amb19929342 [1,0,0,0,0,0|2,0,0]=3 531 B10R1.18 OC(=O)Cc1cc[nH+]cc1 Amb24113836 [1,0,0,0,0,0|1,0,0]=2 532 B10R1.18 OC(=O)Cc1cccc[nH+]1 Amb10807486 [1,0,0,0,0,0|1,0,0]=2 533 B10R1.18 OC(=O)Cc1cccc[nH+]1 Amb24113838 [1,0,0,0,0,0|1,0,0]=2 534 B10R1.18 OC(=O)Cc1cnccn1 Amb10602133 [1,0,0,0,0,0|2,0,0]=3 535 B10R1.18 OC(=O)Nc1[n]ccc[n]1 Amb24085046 [1,0,0,0,0,0|3,0,0]=4 536 B10R1.18 OC(=O)Nc1cc[n]cc1 Amb24070647 [1,0,0,0,0,0|2,0,0]=3 537 B10R1.18 OC(=O)Nc1ccc[n]c1 Amb24102579 [1,0,0,0,0,0|2,0,0]=3 538 B10R1.18 OC(=O)[13CH2]c1ccccc1 Amb22351854 [1,0,0,0,0,0|0,0,0]=1 539 B10R1.18 OC(=S)Cc1cc[n]cc1 Amb24099577 [1,0,0,0,0,0|1,1,0]=3 540 B10R1.18 OC(=S)Cc1ccccc1 Amb22262974 [1,0,0,0,0,0|0,1,0]=2 541 B10R1.18 OC(=S)Nc1ccccc1 Amb24669066 [1,0,0,0,0,0|1,1,0]=3 542 B10R1.18 OC(F)Cc1ccccc1 Amb25147731 [1,0,0,0,0,0|1,0,1]=3 543 B10R1.18 OC(O)C[n+]1ccccc1 Amb25149726 [1,0,0,0,0,0|1,0,2]=4 544 B10R1.18 OC(O)Cc1ccccc1 Amb24639712 [1,0,0,0,0,0|0,0,2]=3 545 B10R1.18 OP(=O)Cc1cccc[n]1 Amb25787147 [1,0,0,0,0,0|2,0,0]=3 546 B10R1.18 OP(=O)Cc1ccccc1 Amb24617740 [1,0,0,0,0,0|1,0,0]=2 547 B10R1.18 OP(=O)Oc1ccccc1 Amb24520486 [1,0,0,0,0,0|2,0,0]=3 548 B10R1.18 O[13C](=O)Cc1ccccc1 Amb22363120 [1,0,0,0,0,0|0,0,0]=1 549 B10R1.18 O[13C](=O)[13CH2]c1ccccc1 Amb22351754 [1,0,0,0,0,0|0,0,0]=1 550 B10R1.18 O[14C](=O)Cc1ccccc1 Amb22337596 [1,0,0,0,0,0|0,0,0]=1 551 B10R1.18 S=C(Cl)Cc1cc[n]cc1 Amb24401128 [1,0,0,0,0,0|2,1,0]=4 552 B10R1.18 SC(=O)Cc1ccccc1 Amb10561701 [1,0,0,0,0,0|0,1,0]=2 553 B10R1.18 [2H]C([2H])=Cc1ccccc1 Amb22363280 [1,0,0,0,0,0|2,0,1]=4 554 B10R1.18 [O-]C(=O)C[n+]1ccccc1 Amb10552724 [1,0,0,0,0,0|1,0,1]=3 555 B10R1.18 [O-]C(=O)C[n+]1ccccc1 Amb10552757 [1,0,0,0,0,0|1,0,1]=3 556 B10R1.18 [O-]C(=O)C[n+]1ccccc1 Amb10573238 [1,0,0,0,0,0|1,0,1]=3 557 B10R1.18 [O-]C(=O)C[n+]1ccccc1 Amb22345878 [1,0,0,0,0,0|1,0,1]=3 558 B10R1.18 [O-]C(=O)Cc1cc[n][n]c1 Amb22496781 [1,0,0,0,0,0|2,0,1]=4 559 B10R1.18 [O-]C(=O)Cc1cc[n][n]c1 Amb22899129 [1,0,0,0,0,0|2,0,1]=4 560 B10R1.18 [O-]C(=O)Cc1cc[n]c[n]1 Amb22755792 [1,0,0,0,0,0|2,0,1]=4 561 B10R1.18 [O-]C(=O)Cc1cc[n]c[n]1 Amb22899178 [1,0,0,0,0,0|2,0,1]=4 562 B10R1.18 [O-]C(=O)Cc1ccc[n][n]1 Amb22499484 [1,0,0,0,0,0|2,0,1]=4 563 B10R1.18 [O-]C(=O)Cc1ccc[n][n]1 Amb23439149 [1,0,0,0,0,0|2,0,1]=4 564 B10R1.18 [O-]C(=O)Cc1ccc[n]c1 Amb21618883 [1,0,0,0,0,0|1,0,1]=3 565 B10R1.18 [O-]C(=O)Cc1cccc[n]1 Amb22000882 [1,0,0,0,0,0|1,0,1]=3 566 B10R1.18 [O-]C(=O)Cc1ccccc1 Amb20240609 [1,0,0,0,0,0|0,0,1]=2 567 B10R1.18 [O-]C(=O)Cc1ccccc1 Amb20246797 [1,0,0,0,0,0|0,0,1]=2 568 B10R1.18 [O-][N+](=O)Cc1c[n]ccc1 Amb23589279 [1,0,0,0,0,0|2,0,1]=4 569 B10R1.18 [O-][N+](=O)Cc1cc[n]cc1 Amb23589332 [1,0,0,0,0,0|2,0,1]=4 570 B10R1.18 [O-][N+](=O)Cc1cccc[n]1 Amb22522599 [1,0,0,0,0,0|2,0,1]=4 571 B10R1.18 [O-][N+](=O)Cc1ccccc1 Amb10606416 [1,0,0,0,0,0|1,0,1]=3 572 B10R1.18 [O-][N+](=O)Nc1ccccc1 Amb17939349 [1,0,0,0,0,0|2,0,1]=4 573 B10R1.18 [O-]\[N+](=C/c1ccccc1)\C Amb2420785 [1,0,0,0,0,0|1,0,2]=4 574 B12R1.32 BrCCC(=O)Nc1ccccc1 Amb16191990 [0,1,0,0,0,0|2,0,0]=3 575 B12R1.32 BrCCC(=O)Nc1ccccn1 Amb17324145 [0,1,0,0,0,0|3,0,0]=4 576 B12R1.32 BrCCC(=O)Nc1cccnc1 Amb17330975 [0,1,0,0,0,0|3,0,0]=4 577 B12R1.32 BrCCC(Br)Cc1ccccc1 Amb23456171 [0,1,0,0,0,0|2,0,1]=4 578 B12R1.32 C#CCC(=O)Cc1cc[n]cc1 Amb18800091 [0,1,0,0,0,0|2,0,1]=4 579 B12R1.32 C#CCC(=O)Cc1ccc[n]c1 Amb18800090 [0,1,0,0,0,0|2,0,1]=4 580 B12R1.32 C#CCC(=O)Cc1cccc[n]1 Amb18800088 [0,1,0,0,0,0|2,0,1]=4 581 B12R1.32 C#CCC(=O)Cc1ccccc1 Amb18799925 [0,1,0,0,0,0|1,0,1]=3 582 B12R1.32 C=C(Cc1ccccc1)N=[N+]=[N-] Amb25207816 [0,1,0,0,0,0|3,0,0]=4 583 B12R1.32 C=C=CC(=O)Cc1ccccc1 Amb25713668 [0,1,0,0,0,0|1,0,1]=3 584 B12R1.32 C=CCC(=O)Nc1ccccc1 Amb25123880 [0,1,0,0,0,0|2,0,1]=4 585 B12R1.32 C=CNC(=O)Oc1ccccc1 Amb25159436 [0,1,0,0,0,0|2,0,1]=4 586 B12R1.32 C=COC(=O)Cc1ccccc1 Amb17934203 [0,1,0,0,0,0|0,0,1]=2 587 B12R1.32 C=NNC(=O)Nc1ccccc1 Amb24488786 [0,1,0,0,0,0|2,0,1]=4 588 B12R1.32 C=NOC(=O)Nc1ccccc1 Amb24420620 [0,1,0,0,0,0|1,0,1]=3 589 B12R1.32 CC#CC(=O)Nc1ccccc1 Amb17940360 [0,1,0,0,0,0|2,0,0]=3 590 B12R1.32 CC#CC(N)Cc1ccccc1 Amb24417700 [0,1,0,0,0,0|2,0,1]=4 591 B12R1.32 CCCC(=N)Nc1ccccc1 Amb24096810 [0,1,0,0,0,0|3,0,0]=4 592 B12R1.32 CCCC(C)Cc1ccccc1 Amb22224920 [0,1,0,0,0,0|2,0,1]=4 593 B12R1.32 CCCC(Cc1ccccc1)[NH3+] Amb10560244 [0,1,0,0,0,0|2,0,1]=4 594 B12R1.32 CCCC(N)Cc1ccccc1 Amb18180073 [0,1,0,0,0,0|2,0,1]=4 595 B12R1.32 CCC\C(\I)=C/c1ccccc1 Amb22546627 [0,1,0,0,0,0|2,0,1]=4 596 B12R1.32 CCNC(=N)Cc1cc[n]cc1 Amb25064531 [0,1,0,0,0,0|3,0,0]=4 597 B12R1.32 CCNC(=N)Nc1ccccc1 Amb18798223 [0,1,0,0,0,0|3,0,0]=4 598 B12R1.32 CCNC(=O)Cc1c[n]c[n]c1 Amb25725133 [0,1,0,0,0,0|3,0,0]=4 599 B12R1.32 CCNC(=O)Cc1c[n]ccc1 Amb25725646 [0,1,0,0,0,0|2,0,0]=3 600 B12R1.32 CCNC(=O)Cc1cc[n]cc1 Amb25205151 [0,1,0,0,0,0|2,0,0]=3 601 B12R1.32 CCNC(=O)Nc1cccc[n]1 Amb25240072 [0,1,0,0,0,0|3,0,0]=4 602 B12R1.32 CCNC(=O)Nc1ccccc1 Amb1233665 [0,1,0,0,0,0|2,0,0]=3 603 B12R1.32 CCNC(=O)Nc1cccnc1 Amb13958674 [0,1,0,0,0,0|3,0,0]=4 604 B12R1.32 CCNC(=O)Sc1ccccc1 Amb25827115 [0,1,0,0,0,0|2,0,0]=3 605 B12R1.32 CCNC(=S)Cc1ccccc1 Amb24066800 [0,1,0,0,0,0|1,1,0]=3 606 B12R1.32 CCNC(=S)Nc1ccccc1 Amb2548953 [0,1,0,0,0,0|2,1,0]=4 607 B12R1.32 CCNC(C)Cc1ccccc1 Amb18552940 [0,1,0,0,0,0|2,0,1]=4 608 B12R1.32 CCNC(C)Cc1ccccc1 Amb22055190 [0,1,0,0,0,0|2,0,1]=4 609 B12R1.32 CCO/C(C)=N/c1ccccc1 Amb17939699 [0,1,0,0,0,0|2,0,0]=3 610 B12R1.32 CCOC(=N)Cc1cc[n]cc1 Amb18800815 [0,1,0,0,0,0|2,0,0]=3 611 B12R1.32 CCOC(=N)Cc1cccc[n]1 Amb18792558 [0,1,0,0,0,0|2,0,0]=3 612 B12R1.32 CCOC(=N)Cc1ccccc1 Amb20673132 [0,1,0,0,0,0|1,0,0]=2 613 B12R1.32 CCOC(=N)Nc1ccccc1 Amb24496991 [0,1,0,0,0,0|2,0,0]=3 614 B12R1.32 CCOC(=O)C=C1C=COC=C1 Amb25848212 [0,1,0,0,0,0|1,0,1]=3 615 B12R1.32 CCOC(=O)C[n+]1ccncc1 Amb2228081 [0,1,0,0,0,0|2,0,0]=3 616 B12R1.32 CCOC(=O)Cc1c[n]c[n]c1 Amb18801018 [0,1,0,0,0,0|2,0,0]=3 617 B12R1.32 CCOC(=O)Cc1c[n]cc[n]1 Amb23399648 [0,1,0,0,0,0|2,0,0]=3 618 B12R1.32 CCOC(=O)Cc1c[n]ccc1 Amb22478803 [0,1,0,0,0,0|1,0,0]=2 619 B12R1.32 CCOC(=O)Cc1cc[n]c[n]1 Amb22001936 [0,1,0,0,0,0|2,0,0]=3 620 B12R1.32 CCOC(=O)Cc1cc[n]cc1 Amb20621993 [0,1,0,0,0,0|1,0,0]=2 621 B12R1.32 CCOC(=O)Cc1ccc[n][n]1 Amb23440008 [0,1,0,0,0,0|2,0,0]=3 622 B12R1.32 CCOC(=O)Cc1ncccn1 Amb17935863 [0,1,0,0,0,0|2,0,0]=3 623 B12R1.32 CCOC(=O)N[n+]1ccccc1 Amb10560832 [0,1,0,0,0,0|2,0,0]=3 624 B12R1.32 CCOC(=O)Nc1ccncn1 Amb17602618 [0,1,0,0,0,0|3,0,0]=4 625 B12R1.32 CCOC(=O)Nc1ncccn1 Amb17862869 [0,1,0,0,0,0|3,0,0]=4 626 B12R1.32 CCOC(=S)Nc1cc[n]cc1 Amb25293795 [0,1,0,0,0,0|2,1,0]=4 627 B12R1.32 CCOC(=S)Nc1cccc[n]1 Amb24640228 [0,1,0,0,0,0|2,1,0]=4 628 B12R1.32 CCSC(=N)Nc1ccccc1 Amb17614151 [0,1,0,0,0,0|2,1,0]=4 629 B12R1.32 CCSC(=O)Nc1cccc[n]1 Amb25131179 [0,1,0,0,0,0|2,1,0]=4 630 B12R1.32 CCSC(=O)Nc1ccccc1 Amb24310273 [0,1,0,0,0,0|1,1,0]=3 631 B12R1.32 CCSC(=S)Nc1ccccc1 Amb24757680 [0,1,0,0,0,0|1,2,0]=4 632 B12R1.32 CCS\C(=N\c1ccccc1)\N Amb11230603 [0,1,0,0,0,0|2,1,0]=4 633 B12R1.32 CC[N]C(=S)Nc1ccccc1 Amb22731669 [0,1,0,0,0,0|2,1,0]=4 634 B12R1.32 CC\N=C(\N)/Cc1ccccc1 Amb23569052 [0,1,0,0,0,0|2,0,0]=3 635 B12R1.32 CN(CCBr)Cc1ccccc1 Amb24357900 [0,1,0,0,0,0|3,0,0]=4 636 B12R1.32 CN(CCCl)Cc1ccccc1 Amb19895292 [0,1,0,0,0,0|3,0,0]=4 637 B12R1.32 CN(CCF)Cc1ccccc1 Amb25318241 [0,1,0,0,0,0|3,0,0]=4 638 B12R1.32 CN(CCI)Cc1ccccc1 Amb25235494 [0,1,0,0,0,0|3,0,0]=4 639 B12R1.32 CNCC(=O)Nc1cccnc1 Amb15740831 [0,1,0,0,0,0|3,0,0]=4 640 B12R1.32 CNCC(Cc1ccccc1)O Amb17193901 [0,1,0,0,0,0|1,0,2]=4 641 B12R1.32 CNCC(N)Cc1ccccc1 Amb19009730 [0,1,0,0,0,0|2,0,1]=4 642 B12R1.32 CNC\C(=C\c1ccccc1)\C Amb17100030 [0,1,0,0,0,0|2,0,1]=4 643 B12R1.32 CNNC(=O)Oc1cccc[n]1 Amb24704314 [0,1,0,0,0,0|3,0,0]=4 644 B12R1.32 CNNC(=S)Nc1ccccc1 Amb25119287 [0,1,0,0,0,0|2,1,0]=4 645 B12R1.32 COCC(=O)Nc1c[n]cc[n]1 Amb24370486 [0,1,0,0,0,0|3,0,0]=4 646 B12R1.32 COCC(=O)Nc1ccncc1 Amb1832638 [0,1,0,0,0,0|2,0,0]=3 647 B12R1.32 COCC(C)Nc1ccccc1 Amb19024307 [0,1,0,0,0,0|2,0,1]=4 648 B12R1.32 COCC(N)Cc1ccccc1 Amb20623561 [0,1,0,0,0,0|1,0,1]=3 649 B12R1.32 CONC(=O)Cc1c[n]c[n]c1 Amb25851913 [0,1,0,0,0,0|2,0,0]=3 650 B12R1.32 CONC(=O)Cc1ccccc1 Amb16969924 [0,1,0,0,0,0|0,0,0]=1 651 B12R1.32 CONC(=O)Nc1c[n]c[n]c1 Amb25078851 [0,1,0,0,0,0|3,0,0]=4 652 B12R1.32 CONC(=O)Oc1ccccc1 Amb16969957 [0,1,0,0,0,0|1,0,0]=2 653 B12R1.32 CONC(=S)Nc1ccccc1 Amb24497042 [0,1,0,0,0,0|1,1,0]=3 654 B12R1.32 CO\N=C(\N)/Cc1c[n]ccc1 Amb25669996 [0,1,0,0,0,0|2,0,0]=3 655 B12R1.32 CSCC(=O)Nc1cccc[n]1 Amb25133919 [0,1,0,0,0,0|2,1,0]=4 656 B12R1.32 CSCC(=O)Nc1ccccc1 Amb2373904 [0,1,0,0,0,0|1,1,0]=3 657 B12R1.32 CSCC(=O)Nc1cccnc1 Amb13957856 [0,1,0,0,0,0|2,1,0]=4 658 B12R1.32 C[SiH2]OC(=O)Nc1ccccc1 Amb24682546 [0,1,0,0,0,0|1,0,0]=2 659 B12R1.32 C\C(=C\CC)\Nc1ccccc1 Amb25678437 [0,1,0,0,0,0|3,0,0]=4 660 B12R1.32 C\C(\CCBr)=C/c1ccccc1 Amb18063581 [0,1,0,0,0,0|2,0,1]=4 661 B12R1.32 C\C(\CCN)=C/c1ccccc1 Amb18063553 [0,1,0,0,0,0|2,0,1]=4 662 B12R1.32 C\C(\CCO)=C\c1ccccc1 Amb24576953 [0,1,0,0,0,0|2,0,1]=4 663 B12R1.32 C\C(\Cc1cc[n]cc1)=N\OC Amb25763716 [0,1,0,0,0,0|2,0,0]=3 664 B12R1.32 C\C(\Cc1ccccc1)=C/C=O Amb18645380 [0,1,0,0,0,0|2,0,1]=4 665 B12R1.32 C\C(\Cc1ccccc1)=C\C#N Amb24595292 [0,1,0,0,0,0|2,0,1]=4 666 B12R1.32 C\C(\Cc1ccccc1)=C\CN Amb25669583 [0,1,0,0,0,0|2,0,0]=3 667 B12R1.32 C\C=C\C(=O)Nc1cccc[n]1 Amb25785202 [0,1,0,0,0,0|3,0,0]=4 668 B12R1.32 C\C=C\C(=O)Nc1ccccc1 Amb24497299 [0,1,0,0,0,0|2,0,0]=3 669 B12R1.32 C\C=C\C(=O)Oc1ccc[n]c1 Amb25154502 [0,1,0,0,0,0|3,0,0]=4 670 B12R1.32 C\C=C\C(N)Cc1ccccc1 Amb25142747 [0,1,0,0,0,0|2,0,1]=4 671 B12R1.32 C\C=C\[C@@H](O)Cc1ccccc1 Amb25741490 [0,1,0,0,0,0|1,0,2]=4 672 B12R1.32 C\C=C\[C@H](O)Cc1ccccc1 Amb24353018 [0,1,0,0,0,0|1,0,2]=4 673 B12R1.32 ClCCC(=O)Nc1ccccn1 Amb1141371 [0,1,0,0,0,0|3,0,0]=4 674 B12R1.32 ClCCC(=O)Nc1cccnc1 Amb1133566 [0,1,0,0,0,0|3,0,0]=4 675 B12R1.32 ClCCC(=O)Nc1ccncc1 Amb1128057 [0,1,0,0,0,0|3,0,0]=4 676 B12R1.32 ClCCC(=O)Oc1ccccc1 Amb16230794 [0,1,0,0,0,0|2,0,0]=3 677 B12R1.32 Cl\C(\Cc1ccccc1)=C/CCl Amb25035226 [0,1,0,0,0,0|2,0,0]=3 678 B12R1.32 Cl\C(\Cc1ccccc1)=C\CCl Amb24563867 [0,1,0,0,0,0|2,0,0]=3 679 B12R1.32 N#CCC(=O)Cc1ccccc1 Amb17232286 [0,1,0,0,0,0|1,0,1]=3 680 B12R1.32 N#CCC(=O)Nc1ccccc1 Amb1634628 [0,1,0,0,0,0|2,0,1]=4 681 B12R1.32 N#CCC(=O)Oc1ccccc1 Amb18645449 [0,1,0,0,0,0|2,0,1]=4 682 B12R1.32 N#CNC(=O)Cc1ccccc1 Amb25149956 [0,1,0,0,0,0|1,0,1]=3 683 B12R1.32 N=C(Cc1ccccc1)NC#N Amb25289104 [0,1,0,0,0,0|2,0,1]=4 684 B12R1.32 NCCC(=O)Nc1ccccc1 Amb1125528 [0,1,0,0,0,0|2,0,0]=3 685 B12R1.32 NCCC(=O)Nc1ccccc1 Amb15740909 [0,1,0,0,0,0|2,0,0]=3 686 B12R1.32 NCCC(=O)Nc1ccccn1 Amb1124759 [0,1,0,0,0,0|3,0,0]=4 687 B12R1.32 NCCC(=O)Nc1cccnc1 Amb1141841 [0,1,0,0,0,0|3,0,0]=4 688 B12R1.32 NCCC(=O)Nc1cccnc1 Amb13952219 [0,1,0,0,0,0|3,0,0]=4 689 B12R1.32 NCCC(=O)Nc1ccncc1 Amb1126146 [0,1,0,0,0,0|3,0,0]=4 690 B12R1.32 NCCC(=O)Nc1ccncc1 Amb13952138 [0,1,0,0,0,0|3,0,0]=4 691 B12R1.32 NCCC(=O)Nc1ccncc1 Amb13952153 [0,1,0,0,0,0|3,0,0]=4 692 B12R1.32 NCCC(=O)Oc1ccccc1 Amb17334633 [0,1,0,0,0,0|2,0,0]=3 693 B12R1.32 NCCC(Cc1ccccc1)C Amb17232439 [0,1,0,0,0,0|2,0,1]=4 694 B12R1.32 NCCC(Cc1ccccc1)O Amb17232552 [0,1,0,0,0,0|1,0,2]=4 695 B12R1.32 NCCS(=O)Cc1ccccc1 Amb18306046 [0,1,0,0,0,0|2,0,0]=3 696 B12R1.32 NN(CCO)Cc1ccccc1 Amb18646608 [0,1,0,0,0,0|3,0,0]=4 697 B12R1.32 NOCC(=O)Nc1ccc[n]c1 Amb25690769 [0,1,0,0,0,0|3,0,0]=4 698 B12R1.32 NOCC(=O)Nc1cccc[n]1 Amb25761175 [0,1,0,0,0,0|3,0,0]=4 699 B12R1.32 NOCC(=O)Nc1ccccc1 Amb24596278 [0,1,0,0,0,0|2,0,0]=3 700 B12R1.32 NOCC(=O)Oc1ccccc1 Amb24096859 [0,1,0,0,0,0|2,0,0]=3 701 B12R1.32 N\N=C\C(=O)Cc1ccccc1 Amb25046103 [0,1,0,0,0,0|2,0,0]=3 702 B12R1.32 O=C(C#CBr)Nc1ccccc1 Amb24621200 [0,1,0,0,0,0|2,0,1]=4 703 B12R1.32 O=C(C=C=O)Nc1ccccc1 Amb24441652 [0,1,0,0,0,0|2,0,1]=4 704 B12R1.32 O=C(CCCl)Nc1ccc[n]c1 Amb22587747 [0,1,0,0,0,0|3,0,0]=4 705 B12R1.32 O=C(CCF)Nc1ccccc1 Amb25276540 [0,1,0,0,0,0|2,0,0]=3 706 B12R1.32 O=C(CCI)Nc1ccccc1 Amb23447340 [0,1,0,0,0,0|2,0,0]=3 707 B12R1.32 O=C(Cc1c[n]ccc1)N=C=O Amb25071469 [0,1,0,0,0,0|2,0,1]=4 708 B12R1.32 O=C(Cc1cccc[n]1)N=C=O Amb25204303 [0,1,0,0,0,0|2,0,1]=4 709 B12R1.32 O=C(Cc1cccc[n]1)N=C=S Amb25675541 [0,1,0,0,0,0|2,0,1]=4 710 B12R1.32 O=C(Cc1ccccc1)\C=C\Cl Amb25216983 [0,1,0,0,0,0|1,0,1]=3 711 B12R1.32 O=C(N=C=O)Oc1ccccc1 Amb22348017 [0,1,0,0,0,0|2,0,1]=4 712 B12R1.32 O=C(NC#N)Nc1ccccc1 Amb17939016 [0,1,0,0,0,0|2,0,1]=4 713 B12R1.32 O=C(NC=O)Nc1ccccc1 Amb22347423 [0,1,0,0,0,0|2,0,1]=4 714 B12R1.32 O=C(Nc1ccccc1)N=C=S Amb24724734 [0,1,0,0,0,0|2,0,1]=4 715 B12R1.32 O=C(\C=C\F)Nc1ccccc1 Amb24386157 [0,1,0,0,0,0|2,0,1]=4 716 B12R1.32 O=C=NC(=O)Cc1ccccc1 Amb17232352 [0,1,0,0,0,0|1,0,1]=3 717 B12R1.32 OCCC(Cc1ccccc1)C Amb17232486 [0,1,0,0,0,0|2,0,1]=4 718 B12R1.32 OCCC(O)Cc1ccccc1 Amb22491209 [0,1,0,0,0,0|1,0,2]=4 719 B12R1.32 OCCN(O)Cc1ccccc1 Amb25284514 [0,1,0,0,0,0|2,0,1]=4 720 B12R1.32 OCNC(=O)C[n+]1ccccc1 Amb25046777 [0,1,0,0,0,0|2,0,0]=3 721 B12R1.32 OCNC(=O)Oc1ccccc1 Amb10552983 [0,1,0,0,0,0|2,0,0]=3 722 B12R1.32 ONCC(=O)Nc1ccccc1 Amb24495972 [0,1,0,0,0,0|3,0,0]=4 723 B12R1.32 O\C=C\C(=O)Cc1ccccc1 Amb25093804 [0,1,0,0,0,0|1,0,1]=3 724 B12R1.32 O\N=C\C(=O)Cc1ccccc1 Amb24577781 [0,1,0,0,0,0|2,0,0]=3 725 B12R1.32 O\N=C\C(=O)Nc1ccccc1 Amb1205570 [0,1,0,0,0,0|3,0,0]=4 726 B12R1.32 S=C(Cc1ccccc1)S[Mg]Cl Amb22264564 [0,1,0,0,0,0|1,2,0]=4 727 B12R1.32 SCCC(=O)Nc1ccccc1 Amb17305724 [0,1,0,0,0,0|2,0,0]=3 728 B12R1.32 SCCN(Cc1ccccc1)C Amb13881720 [0,1,0,0,0,0|3,0,0]=4 729 B12R1.32 [BH3]N(CCC)Cc1ccccc1 Amb24678772 [0,1,0,0,0,0|3,0,0]=4 730 B12R1.32 [C-]#[N+]CC(=O)Nc1ccccc1 Amb25695864 [0,1,0,0,0,0|2,0,1]=4 731 B12R1.32 [K]ONC(=O)Cc1ccccc1 Amb10558422 [0,1,0,0,0,0|1,0,0]=2 732 B12R1.32 [N-]=[N+]=CC(=O)Oc1ccccc1 Amb24576332 [0,1,0,0,0,0|3,0,0]=4 733 B12R1.32 [N-]=[N+]=NC(=O)Nc1ccccc1 Amb25233093 [0,1,0,0,0,0|3,0,0]=4 734 B12R1.34 BrCC(=O)C(=O)c1ccccc1 Amb17406921 [0,1,0,0,0,0|2,0,1]=4 735 B12R1.34 BrCC(=O)N(c1ccccc1)C Amb2081957 [0,1,0,0,0,0|3,0,0]=4 736 B12R1.34 C#CC(=O)C(N)c1ccccc1 Amb24460507 [0,1,0,0,0,0|1,0,1]=3 737 B12R1.34 C#CC(=O)C(O)c1ccccc1 Amb25373683 [0,1,0,0,0,0|1,0,1]=3 738 B12R1.34 C#CC(=O)[C@H](N)c1ccccc1 Amb24426693 [0,1,0,0,0,0|1,0,1]=3 739 B12R1.34 C=C(C#N)C(N)c1ccccc1 Amb25732983 [0,1,0,0,0,0|3,0,0]=4 740 B12R1.34 C=C(C(=O)C=C)c1ccccc1 Amb24559066 [0,1,0,0,0,0|1,0,2]=4 741 B12R1.34 C=C(C=C)C(O)c1ccccc1 Amb25334723 [0,1,0,0,0,0|2,0,1]=4 742 B12R1.34 C=C(C=C)[C@@H](O)c1ccccc1 Amb25215362 [0,1,0,0,0,0|2,0,1]=4 743 B12R1.34 C=C(C=O)C(O)c1ccccc1 Amb18645656 [0,1,0,0,0,0|3,0,0]=4 744 B12R1.34 C=C(CO)C(O)c1ccccc1 Amb24671500 [0,1,0,0,0,0|3,0,0]=4 745 B12R1.34 C=CC(=O)[C@H](F)c1ccccc1 Amb24676844 [0,1,0,0,0,0|1,0,1]=3 746 B12R1.34 CC(=C=C)[C@H](O)c1ccccc1 Amb24352242 [0,1,0,0,0,0|2,0,1]=4 747 B12R1.34 CC(C(=O)C=C)c1ccccc1 Amb24537754 [0,1,0,0,0,0|1,0,1]=3 748 B12R1.34 CC(C(=O)CBr)c1ccccc1 Amb25134301 [0,1,0,0,0,0|2,0,0]=3 749 B12R1.34 CC(C(=O)CCl)c1ccccc1 Amb25150842 [0,1,0,0,0,0|2,0,0]=3 750 B12R1.34 CC(C(=O)CN)c1ccccc1 Amb24535411 [0,1,0,0,0,0|2,0,0]=3 751 B12R1.34 CC(C(=O)NN)c1ccc[n]c1 Amb25163409 [0,1,0,0,0,0|3,0,0]=4 752 B12R1.34 CC(C(=O)NN)c1cccc[n]1 Amb25045003 [0,1,0,0,0,0|3,0,0]=4 753 B12R1.34 CC(C(=O)NO)c1ccccc1 Amb25800798 [0,1,0,0,0,0|2,0,0]=3 754 B12R1.34 CC(C(Br)CC)c1ccccc1 Amb25805104 [0,1,0,0,0,0|2,0,1]=4 755 B12R1.34 CC(C(N)CC)c1ccccc1 Amb18829127 [0,1,0,0,0,0|2,0,1]=4 756 B12R1.34 CC(C(N)CC)c1ccccc1 Amb20623710 [0,1,0,0,0,0|2,0,1]=4 757 B12R1.34 CC(CC)C(Br)c1ccccc1 Amb24618999 [0,1,0,0,0,0|2,0,1]=4 758 B12R1.34 CC(CC)C(Cl)c1ccccc1 Amb19057046 [0,1,0,0,0,0|2,0,1]=4 759 B12R1.34 CC(CC)C(O)c1ccccc1 Amb18792585 [0,1,0,0,0,0|2,0,1]=4 760 B12R1.34 CC(CC)[C@@H](N)c1ccccc1 Amb23438852 [0,1,0,0,0,0|2,0,1]=4 761 B12R1.34 CC(CC)[C@@H](O)c1ccccc1 Amb25158043 [0,1,0,0,0,0|2,0,1]=4 762 B12R1.34 CC(NC)C(N)c1ccccc1 Amb24652517 [0,1,0,0,0,0|2,0,1]=4 763 B12R1.34 CC(NC)C(O)c1ccccc1 Amb20246611 [0,1,0,0,0,0|2,0,1]=4 764 B12R1.34 CC(NC)C(O)c1ccccc1 Amb22489693 [0,1,0,0,0,0|2,0,1]=4 765 B12R1.34 CC(NC)C(O)c1ccccc1 Amb22729748 [0,1,0,0,0,0|2,0,1]=4 766 B12R1.34 CC(OC)C(Cl)c1ccccc1 Amb24391584 [0,1,0,0,0,0|1,0,1]=3 767 B12R1.34 CC(OC)C(N)c1c[n]ccc1 Amb25307005 [0,1,0,0,0,0|2,0,1]=4 768 B12R1.34 CC(OC)C(O)c1c[n]ccc1 Amb25847380 [0,1,0,0,0,0|2,0,1]=4 769 B12R1.34 CC(OC)C(O)c1ccccc1 Amb18801037 [0,1,0,0,0,0|1,0,1]=3 770 B12R1.34 CC(SC)C(N)c1ccccc1 Amb18648548 [0,1,0,0,0,0|1,1,1]=4 771 B12R1.34 CC(SC)[C@H](O)c1ccccc1 Amb24648340 [0,1,0,0,0,0|1,1,1]=4 772 B12R1.34 CC([NH2+]C)C(O)c1ccccc1 Amb22334155 [0,1,0,0,0,0|2,0,1]=4 773 B12R1.34 CC(\C(\N)=N\O)c1ccccc1 Amb24595995 [0,1,0,0,0,0|3,0,0]=4 774 B12R1.34 CC(c1ccccc1)\C(\N)=N\N Amb25159879 [0,1,0,0,0,0|3,0,0]=4 775 B12R1.34 CCC(=C)C(=O)c1ccccc1 Amb24722842 [0,1,0,0,0,0|2,0,1]=4 776 B12R1.34 CCC(=C)C(C)c1ccccc1 Amb24617256 [0,1,0,0,0,0|2,0,0]=3 777 B12R1.34 CCC(=C)C(O)c1ccc[n]c1 Amb24752184 [0,1,0,0,0,0|3,0,0]=4 778 B12R1.34 CCC(=C)[C@@H](O)c1ccccc1 Amb25356347 [0,1,0,0,0,0|2,0,0]=3 779 B12R1.34 CCC(=O)C(=O)c1cc[n]cc1 Amb25245097 [0,1,0,0,0,0|2,0,1]=4 780 B12R1.34 CCC(=O)C(=O)c1cccc[n]1 Amb25762144 [0,1,0,0,0,0|2,0,1]=4 781 B12R1.34 CCC(=O)C(=O)c1ccccc1 Amb17400106 [0,1,0,0,0,0|1,0,1]=3 782 B12R1.34 CCC(=O)C(O)c1cc[n]cc1 Amb25298507 [0,1,0,0,0,0|2,0,0]=3 783 B12R1.34 CCC(=O)C(c1ccccc1)Br Amb17596238 [0,1,0,0,0,0|1,0,0]=2 784 B12R1.34 CCC(=O)C(c1ccccn1)Cl Amb17477741 [0,1,0,0,0,0|2,0,0]=3 785 B12R1.34 CCC(=O)C(c1cccnc1)Cl Amb17477743 [0,1,0,0,0,0|2,0,0]=3 786 B12R1.34 CCC(=O)C(c1ccncc1)Cl Amb17477742 [0,1,0,0,0,0|2,0,0]=3 787 B12R1.34 CCC(=O)[C@@H](C)c1ccccc1 Amb25706991 [0,1,0,0,0,0|1,0,0]=2 788 B12R1.34 CCC(=O)[C@H](C)c1ccccc1 Amb25730209 [0,1,0,0,0,0|1,0,0]=2 789 B12R1.34 CCC(=O)[C@H](N)c1ccccc1 Amb25757342 [0,1,0,0,0,0|1,0,0]=2 790 B12R1.34 CCC(Cl)C(Cl)c1ccccc1 Amb25039087 [0,1,0,0,0,0|2,0,1]=4 791 B12R1.34 CCC(F)C(O)c1ccccc1 Amb25158096 [0,1,0,0,0,0|2,0,1]=4 792 B12R1.34 CCC(N)C(N)c1ccccc1 Amb25765179 [0,1,0,0,0,0|2,0,1]=4 793 B12R1.34 CCC(N)C(O)c1ccccc1 Amb19373101 [0,1,0,0,0,0|2,0,1]=4 794 B12R1.34 CC[C@@H](N)[C@@H](N)c1ccccc1 Amb25151083 [0,1,0,0,0,0|2,0,1]=4 795 B12R1.34 CC[C@@H](N)[C@H](O)c1ccccc1 Amb25793544 [0,1,0,0,0,0|2,0,1]=4 796 B12R1.34 CC[C@@H](O)[C@@H](N)c1ccccc1 Amb25760697 [0,1,0,0,0,0|1,0,2]=4 797 B12R1.34 CC[C@@H](O)[C@H](N)c1ccccc1 Amb25301206 [0,1,0,0,0,0|1,0,2]=4 798 B12R1.34 CC[C@H](N)[C@@H](O)c1ccccc1 Amb24677748 [0,1,0,0,0,0|2,0,1]=4 799 B12R1.34 CC[C@H](O)[C@@H](O)c1ccccc1 Amb25280169 [0,1,0,0,0,0|1,0,2]=4 800 B12R1.34 CN(C(=N)CC)c1ccccc1 Amb24634785 [0,1,0,0,0,0|3,0,0]=4 801 B12R1.34 CN(C(=N)NC)c1ccccc1 Amb18798220 [0,1,0,0,0,0|3,0,0]=4 802 B12R1.34 CN(C(=O)C#C)c1ccccc1 Amb24705229 [0,1,0,0,0,0|2,0,1]=4 803 B12R1.34 CN(C(=O)CI)c1ccccc1 Amb23447342 [0,1,0,0,0,0|3,0,0]=4 804 B12R1.34 CN(C(=O)CS)c1ccccc1 Amb24096794 [0,1,0,0,0,0|3,0,0]=4 805 B12R1.34 CN(C(=O)NC)c1ccccc1 Amb24488531 [0,1,0,0,0,0|2,0,0]=3 806 B12R1.34 CN(C(=O)OC)c1ccc[n]c1 Amb25667300 [0,1,0,0,0,0|2,0,0]=3 807 B12R1.34 CN(C(=O)OC)c1ccccc1 Amb24612519 [0,1,0,0,0,0|1,0,0]=2 808 B12R1.34 CNC(=O)C(=O)c1ccccc1 Amb17334577 [0,1,0,0,0,0|1,0,1]=3 809 B12R1.34 CNC(=O)C(C)c1c[n]c[n]c1 Amb24513527 [0,1,0,0,0,0|3,0,0]=4 810 B12R1.34 CNC(=O)C(C)c1ccc[n]c1 Amb25093295 [0,1,0,0,0,0|2,0,0]=3 811 B12R1.34 CNC(=O)C(Cl)c1ccc[n]c1 Amb19075150 [0,1,0,0,0,0|2,0,0]=3 812 B12R1.34 CNC(=O)C(N)c1cc[n]cc1 Amb24396250 [0,1,0,0,0,0|2,0,0]=3 813 B12R1.34 CNC(=O)C(O)c1cc[n]cc1 Amb24497547 [0,1,0,0,0,0|2,0,0]=3 814 B12R1.34 CNC(=O)C(c1ccccc1)N Amb10609276 [0,1,0,0,0,0|1,0,0]=2 815 B12R1.34 CNC(=O)C(c1ccccc1)O Amb17400179 [0,1,0,0,0,0|1,0,0]=2 816 B12R1.34 CNC(=O)N(N)c1ccccc1 Amb18646326 [0,1,0,0,0,0|2,0,0]=3 817 B12R1.34 CNC(=O)[C@@H](C)c1ccccc1 Amb24682080 [0,1,0,0,0,0|1,0,0]=2 818 B12R1.34 CNC(=O)[C@H](C)c1ccccc1 Amb25277288 [0,1,0,0,0,0|1,0,0]=2 819 B12R1.34 CNC(=O)[C@H](N)c1ccccc1 Amb24678684 [0,1,0,0,0,0|1,0,0]=2 820 B12R1.34 CNC(=O)[C@H](O)c1ccccc1 Amb25792321 [0,1,0,0,0,0|1,0,0]=2 821 B12R1.34 CNC(=O)[C@H](c1ccccc1)N Amb17232478 [0,1,0,0,0,0|1,0,0]=2 822 B12R1.34 CNC(=S)C(C)c1ccccc1 Amb24756688 [0,1,0,0,0,0|1,1,0]=3 823 B12R1.34 CNC(=S)N(N)c1ccccc1 Amb25732915 [0,1,0,0,0,0|2,1,0]=4 824 B12R1.34 CNC(=S)[C@@H](C)c1ccccc1 Amb24383001 [0,1,0,0,0,0|1,1,0]=3 825 B12R1.34 CNC(C(c1ccccc1)Cl)C Amb17594731 [0,1,0,0,0,0|2,0,1]=4 826 B12R1.34 CNC(C)C(C)c1ccccc1 Amb18645936 [0,1,0,0,0,0|2,0,1]=4 827 B12R1.34 CN[C@@H](C)[C@@H](C)c1ccccc1 Amb25674163 [0,1,0,0,0,0|2,0,1]=4 828 B12R1.34 CN[C@@H]([C@H](c1ccccc1)O)C Amb17613676 [0,1,0,0,0,0|2,0,1]=4 829 B12R1.34 CN[C@H](C)[C@@H](C)c1ccccc1 Amb24373827 [0,1,0,0,0,0|2,0,1]=4 830 B12R1.34 COC(=C)C(=O)c1ccccc1 Amb17594034 [0,1,0,0,0,0|1,0,1]=3 831 B12R1.34 COC(=N)C(=O)c1ccccc1 Amb24647710 [0,1,0,0,0,0|1,0,1]=3 832 B12R1.34 COC(=N)C(C)c1ccccc1 Amb24095998 [0,1,0,0,0,0|1,0,0]=2 833 B12R1.34 COC(=N)C(N)c1ccccc1 Amb22471822 [0,1,0,0,0,0|1,0,0]=2 834 B12R1.34 COC(=N)[C@H](O)c1ccccc1 Amb25832728 [0,1,0,0,0,0|1,0,0]=2 835 B12R1.34 COC(=O)C(=O)c1cc[n]cc1 Amb25370850 [0,1,0,0,0,0|1,0,1]=3 836 B12R1.34 COC(=O)C(=O)c1cccc[n]1 Amb25735105 [0,1,0,0,0,0|1,0,1]=3 837 B12R1.34 COC(=O)C(Br)c1cccc[n]1 Amb25381199 [0,1,0,0,0,0|1,0,0]=2 838 B12R1.34 COC(=O)C(C)c1[n]ccc[n]1 Amb24453470 [0,1,0,0,0,0|2,0,0]=3 839 B12R1.34 COC(=O)C(C)c1c[n]c[n]c1 Amb18801019 [0,1,0,0,0,0|2,0,0]=3 840 B12R1.34 COC(=O)C(C)c1c[n]cc[n]1 Amb20667850 [0,1,0,0,0,0|2,0,0]=3 841 B12R1.34 COC(=O)C(C)c1cc[n]cc1 Amb19374810 [0,1,0,0,0,0|1,0,0]=2 842 B12R1.34 COC(=O)C(C)c1ccc[n]c1 Amb18798400 [0,1,0,0,0,0|1,0,0]=2 843 B12R1.34 COC(=O)C(C)c1cccc[n]1 Amb19375013 [0,1,0,0,0,0|1,0,0]=2 844 B12R1.34 COC(=O)C(Cl)c1cc[n]cc1 Amb24497439 [0,1,0,0,0,0|1,0,0]=2 845 B12R1.34 COC(=O)C(Cl)c1ccc[n]c1 Amb19075672 [0,1,0,0,0,0|1,0,0]=2 846 B12R1.34 COC(=O)C(Cl)c1ccc[n]c1 Amb20668455 [0,1,0,0,0,0|1,0,0]=2 847 B12R1.34 COC(=O)C(F)c1ccccc1 Amb24179152 [0,1,0,0,0,0|0,0,0]=1 848 B12R1.34 COC(=O)C(N)c1[n]ccc[n]1 Amb25840293 [0,1,0,0,0,0|2,0,0]=3 849 B12R1.34 COC(=O)C(N)c1cc[n]cc1 Amb23400053 [0,1,0,0,0,0|1,0,0]=2 850 B12R1.34 COC(=O)C(N)c1cc[n]cc1 Amb23401700 [0,1,0,0,0,0|1,0,0]=2 851 B12R1.34 COC(=O)C(N)c1ccc[n][n]1 Amb18827262 [0,1,0,0,0,0|2,0,0]=3 852 B12R1.34 COC(=O)C(N)c1ccc[n]c1 Amb23401702 [0,1,0,0,0,0|1,0,0]=2 853 B12R1.34 COC(=O)C(N)c1cccc[n]1 Amb19148994 [0,1,0,0,0,0|1,0,0]=2 854 B12R1.34 COC(=O)C(N)c1cccc[n]1 Amb22640969 [0,1,0,0,0,0|1,0,0]=2 855 B12R1.34 COC(=O)C(O)c1c[n]c[n]c1 Amb24715473 [0,1,0,0,0,0|2,0,0]=3 856 B12R1.34 COC(=O)C(O)c1c[n]cc[n]1 Amb25378284 [0,1,0,0,0,0|2,0,0]=3 857 B12R1.34 COC(=O)C(O)c1cc[n]cc1 Amb23580591 [0,1,0,0,0,0|1,0,0]=2 858 B12R1.34 COC(=O)C(O)c1ccc[n]c1 Amb18805578 [0,1,0,0,0,0|1,0,0]=2 859 B12R1.34 COC(=O)C(O)c1ccc[n]c1 Amb19351687 [0,1,0,0,0,0|1,0,0]=2 860 B12R1.34 COC(=O)C(O)c1ccccc1 Amb22500374 [0,1,0,0,0,0|0,0,0]=1 861 B12R1.34 COC(=O)C(c1ccccc1)C Amb16185437 [0,1,0,0,0,0|0,0,0]=1 862 B12R1.34 COC(=O)C(c1ccccc1)Cl Amb1212399 [0,1,0,0,0,0|0,0,0]=1 863 B12R1.34 COC(=O)C(c1ccccc1)N Amb1196141 [0,1,0,0,0,0|0,0,0]=1 864 B12R1.34 COC(=O)C(c1ccccc1)N Amb1911591 [0,1,0,0,0,0|0,0,0]=1 865 B12R1.34 COC(=O)C(c1ccccn1)N Amb13883488 [0,1,0,0,0,0|1,0,0]=2 866 B12R1.34 COC(=O)C(c1cccnc1)N Amb13951620 [0,1,0,0,0,0|1,0,0]=2 867 B12R1.34 COC(=O)N(N)c1ccccc1 Amb24688001 [0,1,0,0,0,0|1,0,0]=2 868 B12R1.34 COC(=O)N(O)c1ccccc1 Amb25174008 [0,1,0,0,0,0|1,0,0]=2 869 B12R1.34 COC(=O)[C@@H](C)c1ccccc1 Amb24704365 [0,1,0,0,0,0|0,0,0]=1 870 B12R1.34 COC(=O)[C@H](Cl)c1ccccc1 Amb25210876 [0,1,0,0,0,0|0,0,0]=1 871 B12R1.34 COC(=O)[C@H](N)c1ccc[n]c1 Amb24447814 [0,1,0,0,0,0|1,0,0]=2 872 B12R1.34 COC(=O)[C@H](N)c1ccccc1 Amb20240647 [0,1,0,0,0,0|0,0,0]=1 873 B12R1.34 COC(Br)C(=O)c1ccccc1 Amb25729950 [0,1,0,0,0,0|1,0,2]=4 874 B12R1.34 COC(C(c1ccccc1)N)C Amb1139088 [0,1,0,0,0,0|1,0,1]=3 875 B12R1.34 COC(Cl)C(Cl)c1ccccc1 Amb24539299 [0,1,0,0,0,0|1,0,1]=3 876 B12R1.34 COC(O)C(=O)c1ccccc1 Amb24416714 [0,1,0,0,0,0|0,0,3]=4 877 B12R1.34 COC(O)C(N)c1ccccc1 Amb24599253 [0,1,0,0,0,0|0,0,2]=3 878 B12R1.34 COP(=O)[C@@H](O)c1ccccc1 Amb25065497 [0,1,0,0,0,0|1,0,0]=2 879 B12R1.34 CO[C@@H](C)C(=O)c1ccccc1 Amb25116501 [0,1,0,0,0,0|1,0,2]=4 880 B12R1.34 CO[C@H](N)[C@@H](O)c1ccccc1 Amb25322160 [0,1,0,0,0,0|1,0,1]=3 881 B12R1.34 CO[C@H](O)C(=O)c1ccccc1 Amb25735094 [0,1,0,0,0,0|0,0,3]=4 882 B12R1.34 CSC(=S)N(N)c1ccccc1 Amb24563488 [0,1,0,0,0,0|1,2,0]=4 883 B12R1.34 C[C@@H](C(=O)NN)c1ccccc1 Amb25361548 [0,1,0,0,0,0|2,0,0]=3 884 B12R1.34 C[C@@H](C(=O)NO)c1ccccc1 Amb24722255 [0,1,0,0,0,0|2,0,0]=3 885 B12R1.34 C[C@@H](NC)C(Cl)c1ccccc1 Amb25366190 [0,1,0,0,0,0|2,0,1]=4 886 B12R1.34 C[C@@H](NC)C(O)c1ccccc1 Amb25095866 [0,1,0,0,0,0|2,0,1]=4 887 B12R1.34 C[C@@H](NC)[C@@H](O)c1ccccc1 Amb22366967 [0,1,0,0,0,0|2,0,1]=4 888 B12R1.34 C[C@@H](NC)[C@@H](S)c1ccccc1 Amb25302304 [0,1,0,0,0,0|2,0,1]=4 889 B12R1.34 C[C@@H](NC)[C@H](F)c1ccccc1 Amb24367049 [0,1,0,0,0,0|2,0,1]=4 890 B12R1.34 C[C@@H](NC)[C@H](O)c1ccccc1 Amb19133732 [0,1,0,0,0,0|2,0,1]=4 891 B12R1.34 C[C@@H](OC)[C@@H](Cl)c1ccccc1 Amb25751354 [0,1,0,0,0,0|1,0,1]=3 892 B12R1.34 C[C@@H](OC)[C@@H](O)c1ccccc1 Amb24464720 [0,1,0,0,0,0|1,0,1]=3 893 B12R1.34 C[C@@H](SC)[C@@H](O)c1ccccc1 Amb25106008 [0,1,0,0,0,0|1,1,1]=4 894 B12R1.34 C[C@@H]([C@H](O)CC)c1ccccc1 Amb25317557 [0,1,0,0,0,0|1,0,2]=4 895 B12R1.34 C[C@H](C(=C)C=O)c1ccccc1 Amb25800041 [0,1,0,0,0,0|3,0,0]=4 896 B12R1.34 C[C@H](C(=O)NO)c1ccccc1 Amb24459061 [0,1,0,0,0,0|2,0,0]=3 897 B12R1.34 C[C@H](CC)C(O)c1ccccc1 Amb24735208 [0,1,0,0,0,0|2,0,1]=4 898 B12R1.34 C[C@H](CC)[C@@H](O)c1ccccc1 Amb25047673 [0,1,0,0,0,0|2,0,1]=4 899 B12R1.34 C[C@H](NC)[C@@H](Cl)c1ccccc1 Amb24692816 [0,1,0,0,0,0|2,0,1]=4 900 B12R1.34 C[C@H](NC)[C@@H](S)c1ccccc1 Amb24453442 [0,1,0,0,0,0|2,0,1]=4 901 B12R1.34 C[C@H](NC)[C@H](N)c1ccccc1 Amb24739761 [0,1,0,0,0,0|2,0,1]=4 902 B12R1.34 C[C@H](NC)[C@H](O)c1ccccc1 Amb22351362 [0,1,0,0,0,0|2,0,1]=4 903 B12R1.34 C[C@H](NC)[C@H](S)c1ccccc1 Amb24727185 [0,1,0,0,0,0|2,0,1]=4 904 B12R1.34 C[C@H](OC)C(O)c1cccc[n]1 Amb25306303 [0,1,0,0,0,0|2,0,1]=4 905 B12R1.34 C[C@H](OC)[C@@H](Cl)c1ccccc1 Amb25274934 [0,1,0,0,0,0|1,0,1]=3 906 B12R1.34 C[C@H](OC)[C@H](O)c1cccc[n]1 Amb25832718 [0,1,0,0,0,0|2,0,1]=4 907 B12R1.34 C[C@H](OC)[C@H](O)c1ccccc1 Amb25106038 [0,1,0,0,0,0|1,0,1]=3 908 B12R1.34 C[C@H]([C@@H](O)NC)c1ccccc1 Amb25803440 [0,1,0,0,0,0|1,0,2]=4 909 B12R1.34 C[C@H]([C@H](N)CC)c1ccccc1 Amb25800098 [0,1,0,0,0,0|2,0,1]=4 910 B12R1.34 C\C(=C\C)\C(=O)c1ccccc1 Amb25730208 [0,1,0,0,0,0|2,0,1]=4 911 B12R1.34 C\C(=C\C)\C(O)c1c[n]ccc1 Amb25157689 [0,1,0,0,0,0|3,0,0]=4 912 B12R1.34 C\C(=C\C)\C(O)c1cc[n]cc1 Amb25792477 [0,1,0,0,0,0|3,0,0]=4 913 B12R1.34 C\C(=N/C)\C(N)c1ccccc1 Amb24100399 [0,1,0,0,0,0|2,0,0]=3 914 B12R1.34 C\C(=N/N)\C(C)c1ccccc1 Amb25271286 [0,1,0,0,0,0|3,0,0]=4 915 B12R1.34 C\C(=N/O)\C(C)c1ccccc1 Amb24518613 [0,1,0,0,0,0|3,0,0]=4 916 B12R1.34 C\C(=N\C)\C(N)c1ccccc1 Amb24493500 [0,1,0,0,0,0|2,0,0]=3 917 B12R1.34 C\C=C(/Br)\C(=O)c1ccccc1 Amb22471932 [0,1,0,0,0,0|2,0,1]=4 918 B12R1.34 C\C=C(/Cl)\C(Cl)c1ccccc1 Amb24728456 [0,1,0,0,0,0|2,0,0]=3 919 B12R1.34 C\C=C(/N)\C(=O)c1ccccc1 Amb25144133 [0,1,0,0,0,0|2,0,1]=4 920 B12R1.34 C\C=C(\Cl)/C(Cl)c1ccccc1 Amb24593524 [0,1,0,0,0,0|2,0,0]=3 921 B12R1.34 C\C=C(\Cl)/C(O)c1ccccc1 Amb25092807 [0,1,0,0,0,0|2,0,0]=3 922 B12R1.34 C\C=C(\N)/C(=O)c1ccccc1 Amb25377894 [0,1,0,0,0,0|2,0,1]=4 923 B12R1.34 ClCC(=O)N(c1ccccc1)C Amb1207237 [0,1,0,0,0,0|3,0,0]=4 924 B12R1.34 NC(=S=O)C(N)c1ccccc1 Amb24739656 [0,1,0,0,0,0|2,1,0]=4 925 B12R1.34 NC(C(=O)CCl)c1ccccc1 Amb24341671 [0,1,0,0,0,0|2,0,0]=3 926 B12R1.34 NN(C(=O)CCl)c1ccccc1 Amb18649037 [0,1,0,0,0,0|3,0,0]=4 927 B12R1.34 NNC(=O)C(F)c1ccccc1 Amb25799083 [0,1,0,0,0,0|2,0,0]=3 928 B12R1.34 NNC(=O)C(N)c1ccccc1 Amb18061964 [0,1,0,0,0,0|2,0,0]=3 929 B12R1.34 NNC(=O)C(S)c1ccccc1 Amb24716717 [0,1,0,0,0,0|2,0,0]=3 930 B12R1.34 NNC(=O)C(c1ccccc1)O Amb1786264 [0,1,0,0,0,0|2,0,0]=3 931 B12R1.34 NNC(=O)[C@@H](O)c1ccccc1 Amb22587557 [0,1,0,0,0,0|2,0,0]=3 932 B12R1.34 NNC(=O)[C@H](O)c1ccccc1 Amb25121730 [0,1,0,0,0,0|2,0,0]=3 933 B12R1.34 N[C@@H](C(=O)C#N)c1ccccc1 Amb24483753 [0,1,0,0,0,0|2,0,0]=3 934 B12R1.34 N[C@@H](C(=O)NO)c1ccccc1 Amb25061821 [0,1,0,0,0,0|2,0,0]=3 935 B12R1.34 N\C(=N\O)\C(O)c1ccccc1 Amb22052910 [0,1,0,0,0,0|3,0,0]=4 936 B12R1.34 O=C(CCl)C(F)c1ccccc1 Amb24390277 [0,1,0,0,0,0|2,0,0]=3 937 B12R1.34 O=C(CCl)N(Cl)c1ccccc1 Amb25141365 [0,1,0,0,0,0|3,0,0]=4 938 B12R1.34 O=C(O[SiH3])C(Cl)c1ccccc1 Amb25313110 [0,1,0,0,0,0|0,1,0]=2 939 B12R1.34 OC(c1ccccc1)\C(\F)=C\F Amb25317636 [0,1,0,0,0,0|3,0,0]=4 940 B12R1.34 OCC(=O)C(O)c1ccc[n]c1 Amb25059701 [0,1,0,0,0,0|3,0,0]=4 941 B12R1.34 OCC(=O)C(O)c1ccccc1 Amb24364158 [0,1,0,0,0,0|2,0,0]=3 942 B12R1.34 OCC(=O)[C@@H](O)c1ccccc1 Amb24357245 [0,1,0,0,0,0|2,0,0]=3 943 B12R1.34 ONC(=O)C(Cl)c1ccccc1 Amb25361902 [0,1,0,0,0,0|2,0,0]=3 944 B12R1.34 ONC(=O)C(F)c1ccccc1 Amb25777677 [0,1,0,0,0,0|2,0,0]=3 945 B12R1.34 ONC(=O)C(O)c1ccc[n]c1 Amb25279670 [0,1,0,0,0,0|3,0,0]=4 946 B12R1.34 ONC(=O)C(c1ccccc1)N Amb2430893 [0,1,0,0,0,0|2,0,0]=3 947 B12R1.34 ONC(=O)[C@@H](O)c1ccccc1 Amb25071532 [0,1,0,0,0,0|2,0,0]=3 948 B12R1.34 ONC(=O)[C@H](O)c1ccccc1 Amb25787201 [0,1,0,0,0,0|2,0,0]=3 949 B12R1.34 O[C@H](c1ccccc1)C(=O)N=O Amb25157813 [0,1,0,0,0,0|2,0,0]=3 950 B12R1.34 O[C@H](c1ccccc1)\C(\F)=C\F Amb25157818 [0,1,0,0,0,0|3,0,0]=4 951 B12R1.43 BrC(C(=O)C)Cc1ccccc1 Amb17507835 [0,1,0,0,0,0|2,0,1]=4 952 B12R1.43 Br\C(=C/c1ccccc1)\C(=O)C Amb17596166 [0,1,0,0,0,0|2,0,1]=4 953 B12R1.43 C=C(Cc1ccccc1)C(N)=O Amb24634331 [0,1,0,0,0,0|3,0,0]=4 954 B12R1.43 C=C(Cc1ccccc1)C(N)=S Amb24359154 [0,1,0,0,0,0|3,0,0]=4 955 B12R1.43 C=C(F)C(=O)Cc1ccccc1 Amb25205433 [0,1,0,0,0,0|1,0,1]=3 956 B12R1.43 C=C(F)C(=O)Oc1ccccc1 Amb25174018 [0,1,0,0,0,0|2,0,1]=4 957 B12R1.43 CC(=C(C)C)C[n+]1ccccc1 Amb10552995 [0,1,0,0,0,0|3,0,0]=4 958 B12R1.43 CC(=C)C(=O)Cc1ccc[n]c1 Amb24703221 [0,1,0,0,0,0|2,0,0]=3 959 B12R1.43 CC(=C)C(=O)Nc1ccc[n]c1 Amb25320521 [0,1,0,0,0,0|3,0,0]=4 960 B12R1.43 CC(=C)C(=O)Nc1cccc[n]1 Amb25035026 [0,1,0,0,0,0|3,0,0]=4 961 B12R1.43 CC(=C)C(Cl)Cc1ccccc1 Amb24635687 [0,1,0,0,0,0|2,0,1]=4 962 B12R1.43 CC(=C)[C@@H](O)Cc1ccccc1 Amb25077949 [0,1,0,0,0,0|1,0,2]=4 963 B12R1.43 CC(=O)C(=C)Oc1ccccc1 Amb25714243 [0,1,0,0,0,0|3,0,0]=4 964 B12R1.43 CC(=O)C(=O)Cc1c[n]ccc1 Amb24556780 [0,1,0,0,0,0|2,0,0]=3 965 B12R1.43 CC(=O)C(=O)Cc1cc[n]cc1 Amb24555440 [0,1,0,0,0,0|2,0,0]=3 966 B12R1.43 CC(=O)C(=O)Cc1ccccc1 Amb23603619 [0,1,0,0,0,0|1,0,0]=2 967 B12R1.43 CC(=O)C(O)Cc1ccccc1 Amb25340966 [0,1,0,0,0,0|1,0,2]=4 968 B12R1.43 CC(=O)N(O)Cc1ccccc1 Amb25297453 [0,1,0,0,0,0|2,0,1]=4 969 B12R1.43 CC(=O)[C@@H](C)Cc1ccccc1 Amb24356281 [0,1,0,0,0,0|2,0,1]=4 970 B12R1.43 CC(=O)[C@@H](Cl)Cc1ccccc1 Amb24595784 [0,1,0,0,0,0|2,0,1]=4 971 B12R1.43 CC(=O)[C@@H](O)Cc1ccccc1 Amb24722888 [0,1,0,0,0,0|1,0,2]=4 972 B12R1.43 CC(=O)[C@H](C)Cc1ccccc1 Amb25233687 [0,1,0,0,0,0|2,0,1]=4 973 B12R1.43 CC(=O)\C(\O)=C\c1ccccc1 Amb24456527 [0,1,0,0,0,0|1,0,2]=4 974 B12R1.43 CC(=S)N(C)Cc1ccccc1 Amb24073637 [0,1,0,0,0,0|3,0,0]=4 975 B12R1.43 CC(Br)C(=O)Nc1cccc[n]1 Amb22588096 [0,1,0,0,0,0|3,0,0]=4 976 B12R1.43 CC(Br)C(=O)Oc1ccccc1 Amb24367978 [0,1,0,0,0,0|2,0,0]=3 977 B12R1.43 CC(C(=O)C)Cc1ccccc1 Amb17232407 [0,1,0,0,0,0|2,0,1]=4 978 B12R1.43 CC(C(=O)Cc1ccccc1)Cl Amb10609316 [0,1,0,0,0,0|1,0,0]=2 979 B12R1.43 CC(C(=O)Nc1ccccc1)Br Amb10786673 [0,1,0,0,0,0|2,0,0]=3 980 B12R1.43 CC(C(=O)Nc1ccccc1)Cl Amb1646335 [0,1,0,0,0,0|2,0,0]=3 981 B12R1.43 CC(C(=O)Nc1ccccc1)O Amb1230509 [0,1,0,0,0,0|2,0,0]=3 982 B12R1.43 CC(C(=O)Nc1ccncc1)Cl Amb1140684 [0,1,0,0,0,0|3,0,0]=4 983 B12R1.43 CC(C(=O)Oc1ccccc1)N Amb17334632 [0,1,0,0,0,0|2,0,0]=3 984 B12R1.43 CC(C(=O)Sc1ccccc1)C Amb10575811 [0,1,0,0,0,0|2,0,0]=3 985 B12R1.43 CC(C(=S)Nc1ccccc1)C Amb10562565 [0,1,0,0,0,0|2,1,0]=4 986 B12R1.43 CC(C(N)C)Cc1ccccc1 Amb17232438 [0,1,0,0,0,0|2,0,1]=4 987 B12R1.43 CC(C(O)C)Cc1ccccc1 Amb17232485 [0,1,0,0,0,0|2,0,1]=4 988 B12R1.43 CC(C)C(=O)Cc1cc[n]cc1 Amb18800716 [0,1,0,0,0,0|2,0,0]=3 989 B12R1.43 CC(C)C(=O)Cc1ccc[n]c1 Amb18800713 [0,1,0,0,0,0|2,0,0]=3 990 B12R1.43 CC(C)C(=O)Oc1cc[n]cc1 Amb24393755 [0,1,0,0,0,0|3,0,0]=4 991 B12R1.43 CC(C)C(Br)Cc1ccccc1 Amb25690703 [0,1,0,0,0,0|2,0,1]=4 992 B12R1.43 CC(C)C(Cl)Cc1ccccc1 Amb19045146 [0,1,0,0,0,0|2,0,1]=4 993 B12R1.43 CC(C)N(O)Cc1ccccc1 Amb25130380 [0,1,0,0,0,0|2,0,1]=4 994 B12R1.43 CC(C)S(=O)Nc1ccccc1 Amb24600688 [0,1,0,0,0,0|3,0,0]=4 995 B12R1.43 CC(Cc1ccccc1)C(C)Br Amb24751375 [0,1,0,0,0,0|2,0,1]=4 996 B12R1.43 CC(Cc1ccccc1)C(C)Cl Amb19074260 [0,1,0,0,0,0|2,0,1]=4 997 B12R1.43 CC(F)C(=O)Sc1ccccc1 Amb25174184 [0,1,0,0,0,0|2,0,0]=3 998 B12R1.43 CC(I)C(=O)Nc1ccccc1 Amb23579961 [0,1,0,0,0,0|2,0,0]=3 999 B12R1.43 CC(N(C)C)Cc1ccccc1 Amb1086747 [0,1,0,0,0,0|2,0,1]=4 1000 B12R1.43 CC(N(C)C)Cc1ccccc1 Amb2099764 [0,1,0,0,0,0|2,0,1]=4 1001 B12R1.43 CC(N)C(=O)Cc1ccc[n]c1 Amb18199768 [0,1,0,0,0,0|2,0,0]=3 1002 B12R1.43 CC(N)C(=O)Cc1ccccc1 Amb18829240 [0,1,0,0,0,0|1,0,0]=2 1003 B12R1.43 CC(N)C(=O)Nc1cc[n]cc1 Amb18951602 [0,1,0,0,0,0|3,0,0]=4 1004 B12R1.43 CC(N)C(=O)Nc1cccc[n]1 Amb23559278 [0,1,0,0,0,0|3,0,0]=4 1005 B12R1.43 CC(N)C(=O)Nc1ccccc1 Amb19419695 [0,1,0,0,0,0|2,0,0]=3 1006 B12R1.43 CC(N)C(=O)Oc1ccc[n]c1 Amb25314169 [0,1,0,0,0,0|3,0,0]=4 1007 B12R1.43 CC(N)C(=O)Oc1cccc[n]1 Amb25828418 [0,1,0,0,0,0|3,0,0]=4 1008 B12R1.43 CC(N)C(=O)Sc1ccccc1 Amb25321042 [0,1,0,0,0,0|2,0,0]=3 1009 B12R1.43 CC(N)C(F)Cc1ccccc1 Amb25850180 [0,1,0,0,0,0|2,0,1]=4 1010 B12R1.43 CC(N)C(O)Cc1ccccc1 Amb18828237 [0,1,0,0,0,0|1,0,2]=4 1011 B12R1.43 CC(N)[C@H](O)Cc1ccccc1 Amb24389484 [0,1,0,0,0,0|1,0,2]=4 1012 B12R1.43 CC(O)C(=C)Cc1ccccc1 Amb25155687 [0,1,0,0,0,0|2,0,0]=3 1013 B12R1.43 CC(O)C(=O)Cc1ccc[n]c1 Amb24344752 [0,1,0,0,0,0|2,0,0]=3 1014 B12R1.43 CC(O)C(=O)Cc1cccc[n]1 Amb25205815 [0,1,0,0,0,0|2,0,0]=3 1015 B12R1.43 CC(O)C(=O)Cc1ccccc1 Amb24487306 [0,1,0,0,0,0|1,0,0]=2 1016 B12R1.43 CC(O)C(=O)Nc1cc[n]cc1 Amb24748070 [0,1,0,0,0,0|3,0,0]=4 1017 B12R1.43 CC(O)C(=O)Nc1ccc[n]c1 Amb25159906 [0,1,0,0,0,0|3,0,0]=4 1018 B12R1.43 CC(O)C(=O)Oc1ccc[n]c1 Amb25182794 [0,1,0,0,0,0|3,0,0]=4 1019 B12R1.43 CC(O)C(=O)Oc1ccccc1 Amb25154221 [0,1,0,0,0,0|2,0,0]=3 1020 B12R1.43 CC(O)C(Cl)Cc1ccccc1 Amb25082706 [0,1,0,0,0,0|2,0,1]=4 1021 B12R1.43 CC(O)C(N)Cc1ccccc1 Amb18646379 [0,1,0,0,0,0|2,0,1]=4 1022 B12R1.43 CC(O)C(O)Cc1ccccc1 Amb25159724 [0,1,0,0,0,0|1,0,2]=4 1023 B12R1.43 CC(O)[C@@H](N)Cc1ccccc1 Amb24682603 [0,1,0,0,0,0|2,0,1]=4 1024 B12R1.43 CC(O)[C@@H](O)Cc1ccccc1 Amb24354395 [0,1,0,0,0,0|1,0,2]=4 1025 B12R1.43 CC(O)[C@H](N)Cc1ccccc1 Amb25730054 [0,1,0,0,0,0|2,0,1]=4 1026 B12R1.43 CC(S)C(=O)Nc1ccc[n]c1 Amb24718258 [0,1,0,0,0,0|3,0,0]=4 1027 B12R1.43 CC(S)C(=O)Nc1ccccc1 Amb25103698 [0,1,0,0,0,0|2,0,0]=3 1028 B12R1.43 CN(C(=O)Cc1ccccc1)C Amb1803686 [0,1,0,0,0,0|1,0,0]=2 1029 B12R1.43 CN(C(=O)Nc1ccccc1)C Amb1221366 [0,1,0,0,0,0|2,0,0]=3 1030 B12R1.43 CN(C(=S)Cc1ccccc1)C Amb1078624 [0,1,0,0,0,0|1,1,0]=3 1031 B12R1.43 CN(C(=S)Nc1ccccc1)C Amb1150328 [0,1,0,0,0,0|2,1,0]=4 1032 B12R1.43 CN(C(=S)Nc1ccccc1)N Amb1149646 [0,1,0,0,0,0|2,1,0]=4 1033 B12R1.43 CN(C)C(=N)Cc1ccccc1 Amb23447116 [0,1,0,0,0,0|2,0,0]=3 1034 B12R1.43 CN(C)C(=N)Nc1ccccc1 Amb18798222 [0,1,0,0,0,0|3,0,0]=4 1035 B12R1.43 CN(C)C(=O)Cc1c[n]c[n]c1 Amb25712053 [0,1,0,0,0,0|3,0,0]=4 1036 B12R1.43 CN(C)C(=O)Cc1cc[n]cc1 Amb24387884 [0,1,0,0,0,0|2,0,0]=3 1037 B12R1.43 CN(C)C(=O)Cc1ccc[n]c1 Amb24413047 [0,1,0,0,0,0|2,0,0]=3 1038 B12R1.43 CN(C)C(=O)Cc1cccc[n]1 Amb25369283 [0,1,0,0,0,0|2,0,0]=3 1039 B12R1.43 CN(C)C(=O)Nc1ccc[n]c1 Amb25325007 [0,1,0,0,0,0|3,0,0]=4 1040 B12R1.43 CN(C)C(=S)Cc1ccc[n]c1 Amb24062495 [0,1,0,0,0,0|2,1,0]=4 1041 B12R1.43 CN(C)\C(\S)=C/c1ccccc1 Amb25129445 [0,1,0,0,0,0|1,1,1]=4 1042 B12R1.43 C[C@@H](Cc1ccccc1)C(C)O Amb25769503 [0,1,0,0,0,0|2,0,1]=4 1043 B12R1.43 C[C@@H](Cc1ccccc1)N(C)C Amb22747859 [0,1,0,0,0,0|2,0,1]=4 1044 B12R1.43 C[C@@H](Cc1ccccc1)[C@@H](C)O Amb25795494 [0,1,0,0,0,0|2,0,1]=4 1045 B12R1.43 C[C@@H](Cc1ccccc1)[C@H](C)Cl Amb25275062 [0,1,0,0,0,0|2,0,1]=4 1046 B12R1.43 C[C@@H](N)C(=O)Nc1cc[n]cc1 Amb18792648 [0,1,0,0,0,0|3,0,0]=4 1047 B12R1.43 C[C@@H](N)C(=O)Nc1ccc[n]c1 Amb18792647 [0,1,0,0,0,0|3,0,0]=4 1048 B12R1.43 C[C@@H](N)C(=O)Nc1cccc[n]1 Amb18014737 [0,1,0,0,0,0|3,0,0]=4 1049 B12R1.43 C[C@@H](N)C(=O)Nc1ccccc1 Amb18527911 [0,1,0,0,0,0|2,0,0]=3 1050 B12R1.43 C[C@@H](N)[C@@H](N)Cc1ccccc1 Amb24407278 [0,1,0,0,0,0|2,0,1]=4 1051 B12R1.43 C[C@@H](N)[C@@H](O)Cc1ccccc1 Amb25202137 [0,1,0,0,0,0|1,0,2]=4 1052 B12R1.43 C[C@@H](N)[C@H](O)Cc1ccccc1 Amb25258010 [0,1,0,0,0,0|1,0,2]=4 1053 B12R1.43 C[C@@H](O)C(=O)Cc1ccccc1 Amb25792955 [0,1,0,0,0,0|1,0,0]=2 1054 B12R1.43 C[C@@H](O)C(=O)Nc1cc[n]cc1 Amb25734324 [0,1,0,0,0,0|3,0,0]=4 1055 B12R1.43 C[C@@H](O)C(=O)Nc1ccccc1 Amb25229042 [0,1,0,0,0,0|2,0,0]=3 1056 B12R1.43 C[C@@H](O)C(=O)Oc1ccc[n]c1 Amb24343534 [0,1,0,0,0,0|3,0,0]=4 1057 B12R1.43 C[C@@H](O)C(=O)Oc1ccccc1 Amb25763938 [0,1,0,0,0,0|2,0,0]=3 1058 B12R1.43 C[C@@H](O)C(=O)Sc1ccccc1 Amb25847054 [0,1,0,0,0,0|2,0,0]=3 1059 B12R1.43 C[C@@H](O)[C@@H](O)Cc1ccccc1 Amb25847064 [0,1,0,0,0,0|1,0,2]=4 1060 B12R1.43 C[C@@H](O)[C@H](Cl)Cc1ccccc1 Amb25823111 [0,1,0,0,0,0|2,0,1]=4 1061 B12R1.43 C[C@@H](O)[C@H](N)Cc1ccccc1 Amb24664138 [0,1,0,0,0,0|2,0,1]=4 1062 B12R1.43 C[C@H](Cc1ccccc1)[C@@H](C)O Amb25157972 [0,1,0,0,0,0|2,0,1]=4 1063 B12R1.43 C[C@H](Cc1ccccc1)[C@H](C)O Amb25769397 [0,1,0,0,0,0|2,0,1]=4 1064 B12R1.43 C[C@H](F)C(=O)Nc1ccccc1 Amb25159508 [0,1,0,0,0,0|2,0,0]=3 1065 B12R1.43 C[C@H](N)C(=O)Nc1cc[n]cc1 Amb25751324 [0,1,0,0,0,0|3,0,0]=4 1066 B12R1.43 C[C@H](N)C(=O)Sc1ccccc1 Amb24485426 [0,1,0,0,0,0|2,0,0]=3 1067 B12R1.43 C[C@H](N)[C@@H](N)Cc1ccccc1 Amb25152488 [0,1,0,0,0,0|2,0,1]=4 1068 B12R1.43 C[C@H](O)C(=O)Cc1ccccc1 Amb25143432 [0,1,0,0,0,0|1,0,0]=2 1069 B12R1.43 C[C@H](O)C(=O)Nc1cc[n]cc1 Amb25728744 [0,1,0,0,0,0|3,0,0]=4 1070 B12R1.43 C[C@H](O)C(=O)Nc1ccc[n]c1 Amb25052812 [0,1,0,0,0,0|3,0,0]=4 1071 B12R1.43 C[C@H](O)C(=O)Oc1ccccc1 Amb25769345 [0,1,0,0,0,0|2,0,0]=3 1072 B12R1.43 C[C@H](O)C(=O)Sc1cccc[n]1 Amb24355253 [0,1,0,0,0,0|3,0,0]=4 1073 B12R1.43 C[C@H](O)[C@@H](N)Cc1ccccc1 Amb25690953 [0,1,0,0,0,0|2,0,1]=4 1074 B12R1.43 C[C@H](O)[C@@H](O)Cc1ccccc1 Amb24496614 [0,1,0,0,0,0|1,0,2]=4 1075 B12R1.43 C[C@H](O)[C@H](N)Cc1ccccc1 Amb25375788 [0,1,0,0,0,0|2,0,1]=4 1076 B12R1.43 C\C(=C/c1ccccc1)\C(=O)C Amb17594004 [0,1,0,0,0,0|2,0,1]=4 1077 B12R1.43 C\C(=C/c1ccccc1)\[C@@H](C)O Amb25816522 [0,1,0,0,0,0|2,0,1]=4 1078 B12R1.43 C\C(=N/c1ccccc1)\C(C)=O Amb24537849 [0,1,0,0,0,0|3,0,0]=4 1079 B12R1.43 C\C(=N/c1ccccc1)\C(C)Cl Amb24677700 [0,1,0,0,0,0|3,0,0]=4 1080 B12R1.43 ClC(C(=O)C)Cc1ccccc1 Amb17204329 [0,1,0,0,0,0|2,0,1]=4 1081 B12R1.43 FC(F)C(=O)Nc1ccccc1 Amb17689208 [0,1,0,0,0,0|3,0,0]=4 1082 B12R1.43 NC(=O)C(=O)Cc1c[n]ccc1 Amb24400568 [0,1,0,0,0,0|3,0,0]=4 1083 B12R1.43 NC(C(=O)C)Cc1ccccc1 Amb1099237 [0,1,0,0,0,0|2,0,1]=4 1084 B12R1.43 NC(C(C)C)Cc1ccccc1 Amb17138565 [0,1,0,0,0,0|2,0,1]=4 1085 B12R1.43 O=C(C(=O)C)Nc1ccccc1 Amb2383839 [0,1,0,0,0,0|2,0,0]=3 1086 B12R1.43 O=C(C(=O)N)Nc1ccccc1 Amb1859924 [0,1,0,0,0,0|3,0,0]=4 1087 B12R1.43 O=C(C(=O)O)Cc1ccncc1 Amb17477816 [0,1,0,0,0,0|3,0,0]=4 1088 B12R1.43 O=C(C(Br)C)Nc1ccccn1 Amb10608726 [0,1,0,0,0,0|3,0,0]=4 1089 B12R1.43 O=C(C(Br)C)Nc1cccnc1 Amb17333020 [0,1,0,0,0,0|3,0,0]=4 1090 B12R1.43 O=C(C(Cl)C)Nc1ccccn1 Amb1133726 [0,1,0,0,0,0|3,0,0]=4 1091 B12R1.43 O=C(C(Cl)C)Nc1cccnc1 Amb1137108 [0,1,0,0,0,0|3,0,0]=4 1092 B12R1.43 O=C(Cc1cc[n]cc1)C(F)F Amb24377394 [0,1,0,0,0,0|3,0,0]=4 1093 B12R1.43 O=C(Cc1ccc[n]c1)C(F)F Amb25259697 [0,1,0,0,0,0|3,0,0]=4 1094 B12R1.43 O=C(Cc1cccc[n]1)C(F)F Amb24453669 [0,1,0,0,0,0|3,0,0]=4 1095 B12R1.43 O=C(Cc1ccccc1)C(F)F Amb18180246 [0,1,0,0,0,0|2,0,0]=3 1096 B12R1.43 O=C(N(C)C)Oc1cccnc1 Amb10068713 [0,1,0,0,0,0|3,0,0]=4 1097 B12R1.43 O=C(N(C)C)Sc1cccnc1 Amb13952479 [0,1,0,0,0,0|3,0,0]=4 1098 B12R1.43 O=C(Nc1ccccc1)C(=O)Cl Amb24537614 [0,1,0,0,0,0|3,0,0]=4 1099 B12R1.43 O=C(Nc1ccccc1)C(F)Cl Amb25138763 [0,1,0,0,0,0|3,0,0]=4 1100 B12R1.43 O=C(Oc1ccccc1)C(=O)Cl Amb25207901 [0,1,0,0,0,0|3,0,0]=4 1101 B12R1.43 O=C(Oc1ccccc1)C(F)F Amb25297093 [0,1,0,0,0,0|3,0,0]=4 1102 B12R1.43 OC(=O)C(=O)Cc1ccccn1 Amb17477815 [0,1,0,0,0,0|3,0,0]=4 1103 B12R1.43 OC(=O)C(=O)Cc1cccnc1 Amb17232515 [0,1,0,0,0,0|3,0,0]=4 1104 B12R1.43 OC(C(C)C)Cc1ccccc1 Amb17138584 [0,1,0,0,0,0|1,0,2]=4 1105 B12R1.43 OC(Cl)C(=O)Oc1ccccc1 Amb24658483 [0,1,0,0,0,0|3,0,0]=4 1106 B12R1.43 OC(S)C(=O)Oc1ccccc1 Amb25285714 [0,1,0,0,0,0|3,0,0]=4 1107 B12R1.43 [O-]C(=O)C(=O)Cc1ccccc1 Amb19884048 [0,1,0,0,0,0|2,0,0]=3 1108 B12R1.49 BrCC(=O)Nc1ccc(cc1)O Amb17323368 [0,1,0,0,0,0|3,0,0]=4 1109 B12R1.49 C#CC(=O)Cc1ccc(Br)cc1 Amb24700806 [0,1,0,0,0,0|1,0,1]=3 1110 B12R1.49 C#CC(=O)Cc1ccc(Cl)cc1 Amb25710197 [0,1,0,0,0,0|1,0,1]=3 1111 B12R1.49 C#CC(=O)Cc1ccc(F)cc1 Amb25340982 [0,1,0,0,0,0|1,0,1]=3 1112 B12R1.49 C#CC(=O)Nc1ccc(Cl)cc1 Amb25216189 [0,1,0,0,0,0|2,0,1]=4 1113 B12R1.49 C#CC(=O)Nc1ccc(F)cc1 Amb24606878 [0,1,0,0,0,0|2,0,1]=4 1114 B12R1.49 C#CC(=O)Nc1ccc(I)cc1 Amb24658895 [0,1,0,0,0,0|2,0,1]=4 1115 B12R1.49 C#CC(=O)Nc1ccc(N)cc1 Amb25732765 [0,1,0,0,0,0|2,0,1]=4 1116 B12R1.49 C#CC(=O)Oc1ccc(Cl)cc1 Amb25323485 [0,1,0,0,0,0|2,0,1]=4 1117 B12R1.49 C#CC(=O)Oc1ccc(F)cc1 Amb24555375 [0,1,0,0,0,0|2,0,1]=4 1118 B12R1.49 C=C(Cc1ccc(Cl)cc1)C=O Amb25733131 [0,1,0,0,0,0|3,0,0]=4 1119 B12R1.49 C=C(Cc1ccc(F)cc1)C=O Amb24380075 [0,1,0,0,0,0|3,0,0]=4 1120 B12R1.49 C=CC(=O)Cc1ccc(Br)cc1 Amb25710195 [0,1,0,0,0,0|1,0,1]=3 1121 B12R1.49 C=CC(=O)Cc1ccc(Cl)cc1 Amb25715125 [0,1,0,0,0,0|1,0,1]=3 1122 B12R1.49 C=CC(=O)Nc1ccc(N)cc1 Amb24483453 [0,1,0,0,0,0|2,0,1]=4 1123 B12R1.49 C=CC(=O)Nc1ccc(cc1)[Hg+] Amb17607706 [0,1,0,0,0,0|2,0,1]=4 1124 B12R1.49 C=CC(=O)Oc1ccc(Br)cc1 Amb22497276 [0,1,0,0,0,0|2,0,1]=4 1125 B12R1.49 C=CC(=O)Oc1ccc(Cl)cc1 Amb17933976 [0,1,0,0,0,0|2,0,1]=4 1126 B12R1.49 C=CC(=O)Oc1ccc(F)cc1 Amb25281891 [0,1,0,0,0,0|2,0,1]=4 1127 B12R1.49 CCC(=O)CN1C=CC(=O)C=C1 Amb18788345 [0,1,0,0,0,0|2,0,0]=3 1128 B12R1.49 CCC(=O)Cc1ccc(I)cc1 Amb25229794 [0,1,0,0,0,0|1,0,0]=2 1129 B12R1.49 CCC(=O)Cc1ccc(O)cc1 Amb18646040 [0,1,0,0,0,0|1,0,0]=2 1130 B12R1.49 CCC(=O)Cc1ccc(cc1)Br Amb17477612 [0,1,0,0,0,0|1,0,0]=2 1131 B12R1.49 CCC(=O)Cc1ccc(cc1)C Amb17138536 [0,1,0,0,0,0|1,0,0]=2 1132 B12R1.49 CCC(=O)Cc1ccc(cc1)Cl Amb17139038 [0,1,0,0,0,0|1,0,0]=2 1133 B12R1.49 CCC(=O)Cc1ccc(cc1)F Amb17138600 [0,1,0,0,0,0|1,0,0]=2 1134 B12R1.49 CCC(=O)N=C1C=CC(=O)C=C1 Amb24537744 [0,1,0,0,0,0|2,0,0]=3 1135 B12R1.49 CCC(=O)NC=1C=CC(=O)NC1 Amb25708793 [0,1,0,0,0,0|3,0,0]=4 1136 B12R1.49 CCC(=O)Nc1ccc(C)cn1 Amb17719879 [0,1,0,0,0,0|3,0,0]=4 1137 B12R1.49 CCC(=O)Nc1ccc(Cl)[n]c1 Amb24418747 [0,1,0,0,0,0|3,0,0]=4 1138 B12R1.49 CCC(=O)Nc1ccc(F)c[n]1 Amb17964821 [0,1,0,0,0,0|3,0,0]=4 1139 B12R1.49 CCC(=O)Nc1ccc(N)[n]c1 Amb18966110 [0,1,0,0,0,0|3,0,0]=4 1140 B12R1.49 CCC(=O)Nc1ccc(cc1)I Amb254968 [0,1,0,0,0,0|2,0,0]=3 1141 B12R1.49 CCC(=O)Nc1ccc(cc1)N Amb10187476 [0,1,0,0,0,0|2,0,0]=3 1142 B12R1.49 CCC(=O)Nc1ccc(cc1)N Amb1116465 [0,1,0,0,0,0|2,0,0]=3 1143 B12R1.49 CCC(=O)Nc1ccc(cc1)O Amb2041133 [0,1,0,0,0,0|2,0,0]=3 1144 B12R1.49 CCC(=O)Nc1ccc(cn1)Br Amb1819352 [0,1,0,0,0,0|3,0,0]=4 1145 B12R1.49 CCC(=O)Nc1ccc(nc1)Br Amb16982132 [0,1,0,0,0,0|3,0,0]=4 1146 B12R1.49 CCC(=O)Nc1ccc(nc1)S Amb17206132 [0,1,0,0,0,0|3,0,0]=4 1147 B12R1.49 CCC(=O)Oc1ccc(I)cc1 Amb24430745 [0,1,0,0,0,0|2,0,0]=3 1148 B12R1.49 CCC(=O)Oc1ccc(N)cc1 Amb18646257 [0,1,0,0,0,0|2,0,0]=3 1149 B12R1.49 CCC(=O)Oc1ccc(O)cc1 Amb18646456 [0,1,0,0,0,0|2,0,0]=3 1150 B12R1.49 CCC(=O)Sc1ccc(cc1)C Amb2447238 [0,1,0,0,0,0|2,0,0]=3 1151 B12R1.49 CCC(Br)Cc1ccc(Br)cc1 Amb18049412 [0,1,0,0,0,0|2,0,1]=4 1152 B12R1.49 CCC(C)Cc1ccc(N)cc1 Amb25798952 [0,1,0,0,0,0|2,0,1]=4 1153 B12R1.49 CCC(Cc1ccc(cc1)Br)Cl Amb17477596 [0,1,0,0,0,0|2,0,1]=4 1154 B12R1.49 CCC(Cc1ccc(cc1)Br)O Amb17477579 [0,1,0,0,0,0|1,0,2]=4 1155 B12R1.49 CCC(Cc1ccc(cc1)C)Cl Amb17477426 [0,1,0,0,0,0|2,0,1]=4 1156 B12R1.49 CCC(Cc1ccc(cc1)C)O Amb17138583 [0,1,0,0,0,0|1,0,2]=4 1157 B12R1.49 CCC(Cc1ccc(cc1)Cl)Cl Amb17477604 [0,1,0,0,0,0|2,0,1]=4 1158 B12R1.49 CCC(Cc1ccc(cc1)Cl)O Amb17139103 [0,1,0,0,0,0|1,0,2]=4 1159 B12R1.49 CCC(Cc1ccc(cc1)F)Cl Amb17477606 [0,1,0,0,0,0|2,0,1]=4 1160 B12R1.49 CCC(Cc1ccc(cc1)F)O Amb17138637 [0,1,0,0,0,0|1,0,2]=4 1161 B12R1.49 CCC(Cl)Cc1ccc(I)cc1 Amb25157799 [0,1,0,0,0,0|2,0,1]=4 1162 B12R1.49 CCC(N)Cc1ccc(Cl)cc1 Amb19374189 [0,1,0,0,0,0|2,0,1]=4 1163 B12R1.49 CCC(N)Cc1ccc(I)cc1 Amb24711014 [0,1,0,0,0,0|2,0,1]=4 1164 B12R1.49 CCC(N)Cc1ccc(N)cc1 Amb24738382 [0,1,0,0,0,0|2,0,1]=4 1165 B12R1.49 CCN(C)Cc1ccc(Br)cc1 Amb20784350 [0,1,0,0,0,0|3,0,0]=4 1166 B12R1.49 CCN(C)Cc1ccc(F)cc1 Amb25284151 [0,1,0,0,0,0|3,0,0]=4 1167 B12R1.49 CCN(C)Cc1ccc(F)cc1 Amb25706021 [0,1,0,0,0,0|3,0,0]=4 1168 B12R1.49 CCN(C)Cc1ccc(N)cc1 Amb20622466 [0,1,0,0,0,0|3,0,0]=4 1169 B12R1.49 CCS(=O)Cc1ccc(F)cc1 Amb25160320 [0,1,0,0,0,0|2,0,0]=3 1170 B12R1.49 CCS(=O)Cc1ccc(N)cc1 Amb18974551 [0,1,0,0,0,0|2,0,0]=3 1171 B12R1.49 CCS(=O)Nc1ccc(Br)cc1 Amb25273859 [0,1,0,0,0,0|3,0,0]=4 1172 B12R1.49 CCS(=O)Nc1ccc(O)cc1 Amb25347343 [0,1,0,0,0,0|3,0,0]=4 1173 B12R1.49 CC[C@@H](N)Cc1ccc(Cl)cc1 Amb24357569 [0,1,0,0,0,0|2,0,1]=4 1174 B12R1.49 CC[C@H](N)Cc1ccc(Cl)cc1 Amb25313710 [0,1,0,0,0,0|2,0,1]=4 1175 B12R1.49 CN(Cc1ccc(Br)cc1)OC Amb25283954 [0,1,0,0,0,0|2,0,0]=3 1176 B12R1.49 CN(Cc1ccc(N)c[n]1)OC Amb25856358 [0,1,0,0,0,0|3,0,0]=4 1177 B12R1.49 CNC(=N)Nc1ccc(Br)cc1 Amb25718051 [0,1,0,0,0,0|3,0,0]=4 1178 B12R1.49 CNC(=N)Nc1ccc(Cl)cc1 Amb19068648 [0,1,0,0,0,0|3,0,0]=4 1179 B12R1.49 CNC(=N)Nc1ccc(F)cc1 Amb18798761 [0,1,0,0,0,0|3,0,0]=4 1180 B12R1.49 CNC(=O)Cc1ccc(Br)c[n]1 Amb23586125 [0,1,0,0,0,0|2,0,0]=3 1181 B12R1.49 CNC(=O)Cc1ccc(Cl)[n]c1 Amb24351704 [0,1,0,0,0,0|2,0,0]=3 1182 B12R1.49 CNC(=O)Cc1ccc(F)c[n]1 Amb24719170 [0,1,0,0,0,0|2,0,0]=3 1183 B12R1.49 CNC(=O)Cc1ccc(I)cc1 Amb25680399 [0,1,0,0,0,0|1,0,0]=2 1184 B12R1.49 CNC(=O)Cc1ccc(O)cc1 Amb18646280 [0,1,0,0,0,0|1,0,0]=2 1185 B12R1.49 CNC(=O)Cc1ccc(S)cc1 Amb24346465 [0,1,0,0,0,0|1,0,0]=2 1186 B12R1.49 CNC(=O)Cc1ccc(cc1)C Amb1795465 [0,1,0,0,0,0|1,0,0]=2 1187 B12R1.49 CNC(=O)Cc1ccc(cc1)N Amb1117771 [0,1,0,0,0,0|1,0,0]=2 1188 B12R1.49 CNC(=O)Cc1ccc(cc1)N Amb15740907 [0,1,0,0,0,0|1,0,0]=2 1189 B12R1.49 CNC(=O)NC1=CNC(=O)C=C1 Amb24539829 [0,1,0,0,0,0|3,0,0]=4 1190 B12R1.49 CNC(=O)Nc1ccc(Br)c[n]1 Amb24065475 [0,1,0,0,0,0|3,0,0]=4 1191 B12R1.49 CNC(=O)Nc1ccc(I)c[n]1 Amb24685581 [0,1,0,0,0,0|3,0,0]=4 1192 B12R1.49 CNC(=O)Nc1ccc(O)cc1 Amb21858114 [0,1,0,0,0,0|2,0,0]=3 1193 B12R1.49 CNC(=O)Nc1ccc(cc1)Br Amb1794857 [0,1,0,0,0,0|2,0,0]=3 1194 B12R1.49 CNC(=O)Nc1ccc(cc1)Cl Amb1196554 [0,1,0,0,0,0|2,0,0]=3 1195 B12R1.49 CNC(=O)Oc1ccc(Cl)cc1 Amb22446687 [0,1,0,0,0,0|2,0,0]=3 1196 B12R1.49 CNC(=O)Oc1ccc(N)cc1 Amb24063598 [0,1,0,0,0,0|2,0,0]=3 1197 B12R1.49 CNC(C)Cc1ccc(F)cc1 Amb22055302 [0,1,0,0,0,0|2,0,1]=4 1198 B12R1.49 CNC(C)Cc1ccc(N)cc1 Amb18050449 [0,1,0,0,0,0|2,0,1]=4 1199 B12R1.49 CNC(Cc1ccc(cc1)O)C Amb17619384 [0,1,0,0,0,0|2,0,1]=4 1200 B12R1.49 CN[C@@H](C)Cc1ccc(Cl)cc1 Amb25123418 [0,1,0,0,0,0|2,0,1]=4 1201 B12R1.49 CN[C@@H](C)Cc1ccc(N)cc1 Amb24710324 [0,1,0,0,0,0|2,0,1]=4 1202 B12R1.49 CN[C@@H](C)Cc1ccc(O)cc1 Amb24451652 [0,1,0,0,0,0|2,0,1]=4 1203 B12R1.49 COC(=N)Cc1ccc(Cl)cc1 Amb19057372 [0,1,0,0,0,0|1,0,0]=2 1204 B12R1.49 COC(=N)Cc1ccc(F)cc1 Amb18180127 [0,1,0,0,0,0|1,0,0]=2 1205 B12R1.49 COC(=N)Cc1ccc(O)cc1 Amb18792627 [0,1,0,0,0,0|1,0,0]=2 1206 B12R1.49 COC(=N)Nc1ccc(Cl)cc1 Amb25075628 [0,1,0,0,0,0|2,0,0]=3 1207 B12R1.49 COC(=O)C=C1C=CN(C)C=C1 Amb24099075 [0,1,0,0,0,0|1,0,1]=3 1208 B12R1.49 COC(=O)CC1CCC(=O)C=C1 Amb25053075 [0,1,0,0,0,0|0,0,3]=4 1209 B12R1.49 COC(=O)CC=1CCC(=O)CC1 Amb25059547 [0,1,0,0,0,0|0,0,3]=4 1210 B12R1.49 COC(=O)CN1C=CC(=O)C=C1 Amb18788533 [0,1,0,0,0,0|1,0,0]=2 1211 B12R1.49 COC(=O)C[n+]1ccc(cc1)C Amb10553711 [0,1,0,0,0,0|1,0,0]=2 1212 B12R1.49 COC(=O)C[n+]1ccc(cc1)C Amb2228082 [0,1,0,0,0,0|1,0,0]=2 1213 B12R1.49 COC(=O)Cc1[n]cc(Br)c[n]1 Amb22494764 [0,1,0,0,0,0|2,0,0]=3 1214 B12R1.49 COC(=O)Cc1[n]cc(F)c[n]1 Amb21857270 [0,1,0,0,0,0|2,0,0]=3 1215 B12R1.49 COC(=O)Cc1[n]cc(O)c[n]1 Amb20248625 [0,1,0,0,0,0|2,0,0]=3 1216 B12R1.49 COC(=O)Cc1c[n]c(N)c[n]1 Amb24452100 [0,1,0,0,0,0|2,0,0]=3 1217 B12R1.49 COC(=O)Cc1cc[n+](cc1)C Amb10553717 [0,1,0,0,0,0|1,0,0]=2 1218 B12R1.49 COC(=O)Cc1ccc(Br)c[n]1 Amb22388580 [0,1,0,0,0,0|1,0,0]=2 1219 B12R1.49 COC(=O)Cc1ccc(Cl)[n]c1 Amb22494153 [0,1,0,0,0,0|1,0,0]=2 1220 B12R1.49 COC(=O)Cc1ccc(Cl)c[n]1 Amb23437494 [0,1,0,0,0,0|1,0,0]=2 1221 B12R1.49 COC(=O)Cc1ccc(I)[n]c1 Amb25223569 [0,1,0,0,0,0|1,0,0]=2 1222 B12R1.49 COC(=O)Cc1ccc(N)c[n]1 Amb20248326 [0,1,0,0,0,0|1,0,0]=2 1223 B12R1.49 COC(=O)Cc1ccc(cc1)I Amb10601390 [0,1,0,0,0,0|0,0,0]=1 1224 B12R1.49 COC(=O)Nc1c[n]c(Br)c[n]1 Amb24483759 [0,1,0,0,0,0|3,0,0]=4 1225 B12R1.49 COC(=O)Nc1ccc(C)cc1 Amb17787412 [0,1,0,0,0,0|1,0,0]=2 1226 B12R1.49 COC(=O)Nc1ccc(Cl)[n][n]1 Amb22443674 [0,1,0,0,0,0|3,0,0]=4 1227 B12R1.49 COC(=O)Nc1ccc(Cl)[n]c1 Amb22449324 [0,1,0,0,0,0|2,0,0]=3 1228 B12R1.49 COC(=O)Nc1ccc(F)c[n]1 Amb25838414 [0,1,0,0,0,0|2,0,0]=3 1229 B12R1.49 COC(=O)Nc1ccc(I)c[n]1 Amb24358514 [0,1,0,0,0,0|2,0,0]=3 1230 B12R1.49 COC(=O)Nc1ccc(I)cc1 Amb17861293 [0,1,0,0,0,0|1,0,0]=2 1231 B12R1.49 COC(=O)Nc1ccc(N)[n]c1 Amb18965518 [0,1,0,0,0,0|2,0,0]=3 1232 B12R1.49 COC(=O)Nc1ccc(nc1)Br Amb16982206 [0,1,0,0,0,0|2,0,0]=3 1233 B12R1.49 COC(=O)Oc1ccc(Br)cc1 Amb25307376 [0,1,0,0,0,0|1,0,0]=2 1234 B12R1.49 COC(=O)Oc1ccc(F)cc1 Amb25821230 [0,1,0,0,0,0|1,0,0]=2 1235 B12R1.49 COC(=S)Cc1ccc(N)c[n]1 Amb24483893 [0,1,0,0,0,0|1,1,0]=3 1236 B12R1.49 COC(=S)Nc1ccc(Cl)cc1 Amb25800054 [0,1,0,0,0,0|1,1,0]=3 1237 B12R1.49 COC(C)CN1C=CC(=O)C=C1 Amb25291800 [0,1,0,0,0,0|2,0,1]=4 1238 B12R1.49 COC(C)C[n+]1ccc(C)cc1 Amb25663674 [0,1,0,0,0,0|2,0,1]=4 1239 B12R1.49 CSC(=N)Nc1ccc(F)cc1 Amb25277282 [0,1,0,0,0,0|2,1,0]=4 1240 B12R1.49 CSC(=N)Nc1ccc(O)cc1 Amb24435377 [0,1,0,0,0,0|2,1,0]=4 1241 B12R1.49 CSC(=O)Nc1ccc(Cl)cc1 Amb25326091 [0,1,0,0,0,0|1,1,0]=3 1242 B12R1.49 CSC(=S)Nc1ccc(cc1)F Amb2445316 [0,1,0,0,0,0|1,2,0]=4 1243 B12R1.49 CSC(S)=Nc1ccc(Br)cc1 Amb21953087 [0,1,0,0,0,0|1,2,0]=4 1244 B12R1.49 CSC(S)=Nc1ccc(Cl)cc1 Amb21953080 [0,1,0,0,0,0|1,2,0]=4 1245 B12R1.49 CSC(S)=Nc1ccc(N)cc1 Amb21953083 [0,1,0,0,0,0|1,2,0]=4 1246 B12R1.49 CS\C(\N)=N\c1ccc(Cl)cc1 Amb24447079 [0,1,0,0,0,0|2,1,0]=4 1247 B12R1.49 CS\C(\N)=N\c1ccc(N)cc1 Amb25064749 [0,1,0,0,0,0|2,1,0]=4 1248 B12R1.49 C\C(=N/c1ccc(Cl)cc1)\SC Amb24597532 [0,1,0,0,0,0|2,1,0]=4 1249 B12R1.49 C\C(\Cc1ccc(Cl)cc1)=N\O Amb25159945 [0,1,0,0,0,0|3,0,0]=4 1250 B12R1.49 C\C(\Cc1ccc(F)cc1)=N\N Amb25310183 [0,1,0,0,0,0|3,0,0]=4 1251 B12R1.49 C\C(\Cc1ccc(F)cc1)=N\O Amb24359271 [0,1,0,0,0,0|3,0,0]=4 1252 B12R1.49 C\C(\Cc1ccc(I)cc1)=N\O Amb25258473 [0,1,0,0,0,0|3,0,0]=4 1253 B12R1.49 C\C(\Cc1ccc(O)cc1)=N\O Amb25371887 [0,1,0,0,0,0|3,0,0]=4 1254 B12R1.49 C\C(\NC)=N/c1ccc(N)cc1 Amb25109918 [0,1,0,0,0,0|3,0,0]=4 1255 B12R1.49 C\C=C(\C)/Nc1ccc(C)cc1 Amb24536767 [0,1,0,0,0,0|3,0,0]=4 1256 B12R1.49 Cc1[n]cc(c[n]1)NC(=O)OC Amb25160209 [0,1,0,0,0,0|3,0,0]=4 1257 B12R1.49 Cc1ccc(CC(=C)C=O)cc1 Amb24653692 [0,1,0,0,0,0|3,0,0]=4 1258 B12R1.49 Cc1ccc(CC(=N)NC)cc1 Amb25187482 [0,1,0,0,0,0|2,0,0]=3 1259 B12R1.49 Cc1ccc(CC(=N)OC)cc1 Amb18798199 [0,1,0,0,0,0|1,0,0]=2 1260 B12R1.49 Cc1ccc(CC(=O)C=C)cc1 Amb25069127 [0,1,0,0,0,0|1,0,1]=3 1261 B12R1.49 Cc1ccc(CC(=O)C=O)cc1 Amb24567096 [0,1,0,0,0,0|2,0,0]=3 1262 B12R1.49 Cc1ccc(CC(=O)CC)[n]c1 Amb24717709 [0,1,0,0,0,0|2,0,0]=3 1263 B12R1.49 Cc1ccc(CC(=O)CN)cc1 Amb18829243 [0,1,0,0,0,0|2,0,0]=3 1264 B12R1.49 Cc1ccc(CC(=O)CO)cc1 Amb18563613 [0,1,0,0,0,0|2,0,0]=3 1265 B12R1.49 Cc1ccc(CC(=O)NC)[n]c1 Amb25141982 [0,1,0,0,0,0|2,0,0]=3 1266 B12R1.49 Cc1ccc(CC(=O)NN)[n]c1 Amb25375047 [0,1,0,0,0,0|3,0,0]=4 1267 B12R1.49 Cc1ccc(CC(=O)NO)c[n]1 Amb25144208 [0,1,0,0,0,0|3,0,0]=4 1268 B12R1.49 Cc1ccc(CC(=O)OC)[n]c1 Amb22750281 [0,1,0,0,0,0|1,0,0]=2 1269 B12R1.49 Cc1ccc(CC(=O)OC)c[n]1 Amb24179228 [0,1,0,0,0,0|1,0,0]=2 1270 B12R1.49 Cc1ccc(CC(Br)CC)cc1 Amb24399086 [0,1,0,0,0,0|2,0,1]=4 1271 B12R1.49 Cc1ccc(CC(C)CC)cc1 Amb25241788 [0,1,0,0,0,0|2,0,1]=4 1272 B12R1.49 Cc1ccc(CC(N)=NN)cc1 Amb18788209 [0,1,0,0,0,0|3,0,0]=4 1273 B12R1.49 Cc1ccc(CN(C)CC)cc1 Amb25115746 [0,1,0,0,0,0|3,0,0]=4 1274 B12R1.49 Cc1ccc(CN(C)OC)cc1 Amb25048286 [0,1,0,0,0,0|2,0,0]=3 1275 B12R1.49 Cc1ccc(CS(=O)CC)cc1 Amb25160319 [0,1,0,0,0,0|2,0,0]=3 1276 B12R1.49 Cc1ccc(C[C@@H](C)NC)cc1 Amb25233407 [0,1,0,0,0,0|2,0,1]=4 1277 B12R1.49 Cc1ccc(C\C(\C)=N/O)cc1 Amb24563486 [0,1,0,0,0,0|3,0,0]=4 1278 B12R1.49 Cc1ccc(c[n]1)NC(=O)NC Amb25144167 [0,1,0,0,0,0|3,0,0]=4 1279 B12R1.49 Cc1ccc(c[n]1)NC(=O)OC Amb24388337 [0,1,0,0,0,0|2,0,0]=3 1280 B12R1.49 Cc1ccc(c[n]1)OC(=O)CC Amb25154583 [0,1,0,0,0,0|3,0,0]=4 1281 B12R1.49 Cc1ccc(cc1)N=C(S)SC Amb21953081 [0,1,0,0,0,0|1,2,0]=4 1282 B12R1.49 Cc1ccc(cc1)NC(=N)NC Amb18798224 [0,1,0,0,0,0|3,0,0]=4 1283 B12R1.49 Cc1ccc(cc1)NC(=N)SC Amb22450889 [0,1,0,0,0,0|2,1,0]=4 1284 B12R1.49 Cc1ccc(cc1)NC(=O)C#N Amb24566097 [0,1,0,0,0,0|3,0,0]=4 1285 B12R1.49 Cc1ccc(cc1)NC(=O)C=O Amb25690866 [0,1,0,0,0,0|3,0,0]=4 1286 B12R1.49 Cc1ccc(cc1)NC(=O)CF Amb25857022 [0,1,0,0,0,0|3,0,0]=4 1287 B12R1.49 Cc1ccc(cc1)NC(=O)CI Amb23440933 [0,1,0,0,0,0|3,0,0]=4 1288 B12R1.49 Cc1ccc(cc1)NC(=O)CN Amb21959025 [0,1,0,0,0,0|3,0,0]=4 1289 B12R1.49 Cc1ccc(cc1)NC(=O)SC Amb25326064 [0,1,0,0,0,0|1,1,0]=3 1290 B12R1.49 Cc1ccc(cc1)NC(=S)OC Amb24452259 [0,1,0,0,0,0|1,1,0]=3 1291 B12R1.49 Cc1ccc(cc1)OC(=O)C=C Amb24493128 [0,1,0,0,0,0|2,0,1]=4 1292 B12R1.49 Cc1ccc(cc1)OC(=O)CN Amb19115308 [0,1,0,0,0,0|3,0,0]=4 1293 B12R1.49 Cc1ccc(cc1)OC(=O)CO Amb25829911 [0,1,0,0,0,0|3,0,0]=4 1294 B12R1.49 Cc1ccc(cc1)OC(=O)OC Amb24676402 [0,1,0,0,0,0|1,0,0]=2 1295 B12R1.49 Cc1ccc(cc1)SC(=O)CCl Amb22002676 [0,1,0,0,0,0|3,0,0]=4 1296 B12R1.49 Cc1ccc(cc1)SC(=O)NC Amb25691145 [0,1,0,0,0,0|2,0,0]=3 1297 B12R1.49 Cc1ccc(cc1)[C]C(=O)OC Amb22831259 [0,1,0,0,0,0|0,0,1]=2 1298 B12R1.49 ClCC(=O)Nc1ccc(cc1)I Amb1205407 [0,1,0,0,0,0|3,0,0]=4 1299 B12R1.49 ClCC(=O)Nc1ccc(cc1)N Amb17068368 [0,1,0,0,0,0|3,0,0]=4 1300 B12R1.49 ClCC(=O)Nc1ccc(cc1)O Amb1106223 [0,1,0,0,0,0|3,0,0]=4 1301 B12R1.49 N#CC(=O)Cc1ccc(Cl)[n]c1 Amb25178952 [0,1,0,0,0,0|3,0,0]=4 1302 B12R1.49 N#CC(=O)Cc1ccc(Cl)cc1 Amb22498650 [0,1,0,0,0,0|2,0,0]=3 1303 B12R1.49 N#CC(=O)Nc1ccc(F)cc1 Amb25707940 [0,1,0,0,0,0|3,0,0]=4 1304 B12R1.49 N=C(Cc1ccc(O)cc1)NO Amb22494626 [0,1,0,0,0,0|3,0,0]=4 1305 B12R1.49 NCC(=O)Cc1ccc(Br)c[n]1 Amb25703201 [0,1,0,0,0,0|3,0,0]=4 1306 B12R1.49 NCC(=O)Cc1ccc(Br)cc1 Amb18160380 [0,1,0,0,0,0|2,0,0]=3 1307 B12R1.49 NCC(=O)Cc1ccc(Cl)cc1 Amb18823029 [0,1,0,0,0,0|2,0,0]=3 1308 B12R1.49 NCC(=O)Cc1ccc(F)cc1 Amb18827238 [0,1,0,0,0,0|2,0,0]=3 1309 B12R1.49 NCC(=O)Cc1ccc(O)cc1 Amb25369044 [0,1,0,0,0,0|2,0,0]=3 1310 B12R1.49 NCC(=O)Nc1ccc(F)cc1 Amb21959093 [0,1,0,0,0,0|3,0,0]=4 1311 B12R1.49 NCC(=O)Nc1ccc(cc1)Br Amb10609297 [0,1,0,0,0,0|3,0,0]=4 1312 B12R1.49 NCC(=O)Nc1ccc(cc1)Br Amb1289627 [0,1,0,0,0,0|3,0,0]=4 1313 B12R1.49 NCC(=O)Nc1ccc(cc1)Cl Amb10609916 [0,1,0,0,0,0|3,0,0]=4 1314 B12R1.49 NCC(=O)Nc1ccc(cc1)O Amb13951460 [0,1,0,0,0,0|3,0,0]=4 1315 B12R1.49 NCC(=O)Oc1ccc(cc1)Br Amb17344448 [0,1,0,0,0,0|3,0,0]=4 1316 B12R1.49 NCC(=O)Oc1ccc(cc1)C Amb17334636 [0,1,0,0,0,0|3,0,0]=4 1317 B12R1.49 NCC(=O)Oc1ccc(cc1)Cl Amb17335805 [0,1,0,0,0,0|3,0,0]=4 1318 B12R1.49 NCC(=O)Oc1ccc(cc1)F Amb17334754 [0,1,0,0,0,0|3,0,0]=4 1319 B12R1.49 NNC(=O)CN1C=CC(=O)C=C1 Amb24427264 [0,1,0,0,0,0|3,0,0]=4 1320 B12R1.49 NNC(=O)Cc1cc[n+]([O-])cc1 Amb25202196 [0,1,0,0,0,0|3,0,0]=4 1321 B12R1.49 NNC(=O)Cc1ccc(Cl)[n]c1 Amb22898935 [0,1,0,0,0,0|3,0,0]=4 1322 B12R1.49 NNC(=O)Cc1ccc(cc1)C Amb1921793 [0,1,0,0,0,0|2,0,0]=3 1323 B12R1.49 NNC(=O)Nc1ccc(cc1)Cl Amb2411255 [0,1,0,0,0,0|3,0,0]=4 1324 B12R1.49 NNC(=O)Nc1ccc(cc1)F Amb10839092 [0,1,0,0,0,0|3,0,0]=4 1325 B12R1.49 NNC(=O)Oc1ccc(Cl)cc1 Amb25299876 [0,1,0,0,0,0|3,0,0]=4 1326 B12R1.49 NNC(=O)Oc1ccc(O)cc1 Amb24633295 [0,1,0,0,0,0|3,0,0]=4 1327 B12R1.49 NOC(=O)Nc1ccc(F)cc1 Amb25054608 [0,1,0,0,0,0|2,0,0]=3 1328 B12R1.49 N\C(\Cc1ccc(Br)cc1)=N\N Amb25056234 [0,1,0,0,0,0|3,0,0]=4 1329 B12R1.49 N\C(\Cc1ccc(Cl)cc1)=N\N Amb19045347 [0,1,0,0,0,0|3,0,0]=4 1330 B12R1.49 N\C(\Cc1ccc(F)cc1)=N\N Amb18788561 [0,1,0,0,0,0|3,0,0]=4 1331 B12R1.49 N\C(\Cc1ccc(I)cc1)=N\O Amb24454140 [0,1,0,0,0,0|3,0,0]=4 1332 B12R1.49 Nc1ccc(CC(=O)CBr)cc1 Amb25247650 [0,1,0,0,0,0|2,0,0]=3 1333 B12R1.49 Nc1ccc(CC(=O)NN)cc1 Amb23247868 [0,1,0,0,0,0|2,0,0]=3 1334 B12R1.49 Nc1ccc(CC(=O)NO)[n]c1 Amb25347985 [0,1,0,0,0,0|3,0,0]=4 1335 B12R1.49 Nc1ccc(CC(=O)NO)cc1 Amb25222304 [0,1,0,0,0,0|2,0,0]=3 1336 B12R1.49 Nc1ccc(cc1)NC(=O)NN Amb24483837 [0,1,0,0,0,0|3,0,0]=4 1337 B12R1.49 Nc1ccc(cc1)OC(=O)CO Amb24730945 [0,1,0,0,0,0|3,0,0]=4 1338 B12R1.49 O=C(CBr)Oc1ccc(Br)cc1 Amb25246512 [0,1,0,0,0,0|3,0,0]=4 1339 B12R1.49 O=C(CCl)Oc1ccc(Br)cc1 Amb22411419 [0,1,0,0,0,0|3,0,0]=4 1340 B12R1.49 O=C(CCl)Oc1ccc(F)cc1 Amb25295534 [0,1,0,0,0,0|3,0,0]=4 1341 B12R1.49 O=C(CF)Cc1ccc(Cl)cc1 Amb23454833 [0,1,0,0,0,0|2,0,0]=3 1342 B12R1.49 O=C(CF)Nc1ccc(Br)cc1 Amb24072327 [0,1,0,0,0,0|3,0,0]=4 1343 B12R1.49 O=C(CI)Nc1ccc(Br)cc1 Amb22346045 [0,1,0,0,0,0|3,0,0]=4 1344 B12R1.49 O=C(CI)Nc1ccc(F)cc1 Amb24634942 [0,1,0,0,0,0|3,0,0]=4 1345 B12R1.49 O=C(Cc1ccc(Br)cc1)CBr Amb25364120 [0,1,0,0,0,0|2,0,0]=3 1346 B12R1.49 O=C(Cc1ccc(F)cc1)CBr Amb25082934 [0,1,0,0,0,0|2,0,0]=3 1347 B12R1.49 O=C(Nc1ccc(Cl)cc1)NCl Amb25686053 [0,1,0,0,0,0|3,0,0]=4 1348 B12R1.49 OCC(=O)Cc1ccc(Br)cc1 Amb18069830 [0,1,0,0,0,0|2,0,0]=3 1349 B12R1.49 OCC(=O)Cc1ccc(Cl)cc1 Amb18564300 [0,1,0,0,0,0|2,0,0]=3 1350 B12R1.49 OCC(=O)Cc1ccc(F)cc1 Amb18805789 [0,1,0,0,0,0|2,0,0]=3 1351 B12R1.49 OCC(=O)Nc1ccc(cc1)Br Amb1111396 [0,1,0,0,0,0|3,0,0]=4 1352 B12R1.49 OCC(=O)Nc1ccc(cc1)C Amb1109727 [0,1,0,0,0,0|3,0,0]=4 1353 B12R1.49 OCC(=O)Nc1ccc(cc1)Cl Amb1111272 [0,1,0,0,0,0|3,0,0]=4 1354 B12R1.49 OCC(=O)Nc1ccc(cc1)F Amb1110979 [0,1,0,0,0,0|3,0,0]=4 1355 B12R1.49 OCC(=O)Nc1ccc(cc1)I Amb1110138 [0,1,0,0,0,0|3,0,0]=4 1356 B12R1.49 ONC(=O)Cc1ccc(I)cc1 Amb25119664 [0,1,0,0,0,0|2,0,0]=3 1357 B12R1.49 ONC(=O)Nc1ccc(I)cc1 Amb22475257 [0,1,0,0,0,0|3,0,0]=4 1358 B12R1.49 O\N=C(/Cc1ccc(cc1)O)\N Amb2224478 [0,1,0,0,0,0|3,0,0]=4 1359 B12R1.49 O\N=C(\Cc1ccc(cc1)Cl)/N Amb1114808 [0,1,0,0,0,0|3,0,0]=4 1360 B12R1.49 O\N=C(\Cc1ccc(cc1)N)/N Amb1114107 [0,1,0,0,0,0|3,0,0]=4 1361 B12R1.49 O\N=C(\Cc1ccc(cc1)O)/N Amb1113789 [0,1,0,0,0,0|3,0,0]=4 1362 B12R1.49 Oc1ccc(CC(=O)C=O)cc1 Amb25359086 [0,1,0,0,0,0|2,0,0]=3 1363 B12R1.49 Oc1ccc(CC(=O)NO)cc1 Amb24686463 [0,1,0,0,0,0|2,0,0]=3 1364 B12R1.49 Oc1ccc(cc1)OC(=O)CCl Amb22232555 [0,1,0,0,0,0|3,0,0]=4 1365 B12R1.49 Oc1ccc(cc1)SC(=O)CCl Amb25799516 [0,1,0,0,0,0|3,0,0]=4 1366 B12R1.50 C#CC(=O)Cc1cc(Cl)cc[n]1 Amb25371934 [0,1,0,0,0,0|2,0,1]=4 1367 B12R1.50 C#CC(=O)Cc1cccc(Br)c1 Amb25042972 [0,1,0,0,0,0|1,0,1]=3 1368 B12R1.50 C#CC(=O)Cc1cccc(Cl)[n]1 Amb25202731 [0,1,0,0,0,0|2,0,1]=4 1369 B12R1.50 C#CC(=O)Oc1cccc(Br)c1 Amb25680293 [0,1,0,0,0,0|2,0,1]=4 1370 B12R1.50 C#CC(=O)Oc1cccc(F)c1 Amb25859643 [0,1,0,0,0,0|2,0,1]=4 1371 B12R1.50 C=CC(=O)Cc1c[n]cc(Br)c1 Amb25849642 [0,1,0,0,0,0|2,0,1]=4 1372 B12R1.50 C=CC(=O)Cc1cc[n]c(N)c1 Amb25840227 [0,1,0,0,0,0|2,0,1]=4 1373 B12R1.50 C=CC(=O)Cc1cccc(Br)c1 Amb24450582 [0,1,0,0,0,0|1,0,1]=3 1374 B12R1.50 C=CC(=O)Cc1cccc(N)c1 Amb25809299 [0,1,0,0,0,0|1,0,1]=3 1375 B12R1.50 C=CC(=O)Nc1cccc(N)c1 Amb24740871 [0,1,0,0,0,0|2,0,1]=4 1376 B12R1.50 C=CC(=O)Oc1cccc(F)c1 Amb25156555 [0,1,0,0,0,0|2,0,1]=4 1377 B12R1.50 CCC(=N)Nc1cccc(Cl)c1 Amb24361088 [0,1,0,0,0,0|3,0,0]=4 1378 B12R1.50 CCC(=N)Nc1cccc(I)c1 Amb24372338 [0,1,0,0,0,0|3,0,0]=4 1379 B12R1.50 CCC(=O)Cc1cc(Br)c[n]c1 Amb25339304 [0,1,0,0,0,0|2,0,0]=3 1380 B12R1.50 CCC(=O)Cc1cccc(c1)Br Amb17477613 [0,1,0,0,0,0|1,0,0]=2 1381 B12R1.50 CCC(=O)Cc1cccc(c1)C Amb17138543 [0,1,0,0,0,0|1,0,0]=2 1382 B12R1.50 CCC(=O)Cc1cccc(c1)Cl Amb17139042 [0,1,0,0,0,0|1,0,0]=2 1383 B12R1.50 CCC(=O)Cc1cccc(c1)F Amb17138604 [0,1,0,0,0,0|1,0,0]=2 1384 B12R1.50 CCC(=O)Nc1c[n]cc(Br)c1 Amb22002187 [0,1,0,0,0,0|3,0,0]=4 1385 B12R1.50 CCC(=O)Nc1cc(Cl)cc[n]1 Amb22170444 [0,1,0,0,0,0|3,0,0]=4 1386 B12R1.50 CCC(=O)Nc1cccc(Cl)[n]1 Amb25220374 [0,1,0,0,0,0|3,0,0]=4 1387 B12R1.50 CCC(=O)Nc1cccc(c1)Br Amb1885365 [0,1,0,0,0,0|2,0,0]=3 1388 B12R1.50 CCC(=O)Nc1cccc(c1)N Amb1118353 [0,1,0,0,0,0|2,0,0]=3 1389 B12R1.50 CCC(=O)Nc1cccc(c1)O Amb2025988 [0,1,0,0,0,0|2,0,0]=3 1390 B12R1.50 CCC(=O)OC1=CC(=O)NC=C1 Amb24586553 [0,1,0,0,0,0|3,0,0]=4 1391 B12R1.50 CCC(=O)Oc1c[n]cc(Br)c1 Amb24403638 [0,1,0,0,0,0|3,0,0]=4 1392 B12R1.50 CCC(=O)Oc1c[n]cc(Cl)c1 Amb25295997 [0,1,0,0,0,0|3,0,0]=4 1393 B12R1.50 CCC(=O)Oc1cccc(Br)c1 Amb25219957 [0,1,0,0,0,0|2,0,0]=3 1394 B12R1.50 CCC(=O)Oc1cccc(Cl)c1 Amb25800916 [0,1,0,0,0,0|2,0,0]=3 1395 B12R1.50 CCC(=O)Oc1cccc(F)c1 Amb25153440 [0,1,0,0,0,0|2,0,0]=3 1396 B12R1.50 CCC(=O)Oc1cccc(I)c1 Amb25220812 [0,1,0,0,0,0|2,0,0]=3 1397 B12R1.50 CCC(=O)Oc1cccc(O)c1 Amb22167292 [0,1,0,0,0,0|2,0,0]=3 1398 B12R1.50 CCC(Br)Cc1cc(Br)ccc1 Amb18049408 [0,1,0,0,0,0|2,0,1]=4 1399 B12R1.50 CCC(Br)Cc1cc(F)ccc1 Amb25039883 [0,1,0,0,0,0|2,0,1]=4 1400 B12R1.50 CCC(Cc1cccc(c1)Br)Cl Amb17477597 [0,1,0,0,0,0|2,0,1]=4 1401 B12R1.50 CCC(Cc1cccc(c1)Br)O Amb17477580 [0,1,0,0,0,0|1,0,2]=4 1402 B12R1.50 CCC(Cc1cccc(c1)C)Cl Amb17477424 [0,1,0,0,0,0|2,0,1]=4 1403 B12R1.50 CCC(Cc1cccc(c1)C)O Amb17138582 [0,1,0,0,0,0|1,0,2]=4 1404 B12R1.50 CCC(Cc1cccc(c1)Cl)Cl Amb17477605 [0,1,0,0,0,0|2,0,1]=4 1405 B12R1.50 CCC(Cc1cccc(c1)Cl)O Amb17139102 [0,1,0,0,0,0|1,0,2]=4 1406 B12R1.50 CCC(Cc1cccc(c1)F)O Amb17138636 [0,1,0,0,0,0|1,0,2]=4 1407 B12R1.50 CCC(Cl)Cc1cc(F)ccc1 Amb19046367 [0,1,0,0,0,0|2,0,1]=4 1408 B12R1.50 CCC(N)Cc1cc(I)ccc1 Amb25800100 [0,1,0,0,0,0|2,0,1]=4 1409 B12R1.50 CCN(C)Cc1cccc(Cl)c1 Amb24619073 [0,1,0,0,0,0|3,0,0]=4 1410 B12R1.50 CCN(C)Cc1cccc(Cl)c1 Amb25769163 [0,1,0,0,0,0|3,0,0]=4 1411 B12R1.50 CCS(=O)Cc1cc(N)[n]cc1 Amb25061639 [0,1,0,0,0,0|3,0,0]=4 1412 B12R1.50 CCS(=O)Cc1cc(N)ccc1 Amb18977540 [0,1,0,0,0,0|2,0,0]=3 1413 B12R1.50 CCS(=O)Nc1cccc(I)c1 Amb24588845 [0,1,0,0,0,0|3,0,0]=4 1414 B12R1.50 CCS(=O)Nc1cccc(N)c1 Amb24583485 [0,1,0,0,0,0|3,0,0]=4 1415 B12R1.50 CCS(=O)Nc1cccc(O)c1 Amb24536718 [0,1,0,0,0,0|3,0,0]=4 1416 B12R1.50 CC[C@@H](N)Cc1cc(F)ccc1 Amb24535474 [0,1,0,0,0,0|2,0,1]=4 1417 B12R1.50 CC[C@H](N)Cc1cc(Cl)ccc1 Amb24668259 [0,1,0,0,0,0|2,0,1]=4 1418 B12R1.50 CN(Cc1cccc(Br)c1)OC Amb25317009 [0,1,0,0,0,0|2,0,0]=3 1419 B12R1.50 CN(Cc1cccc(Cl)[n]1)OC Amb25057418 [0,1,0,0,0,0|3,0,0]=4 1420 B12R1.50 CN(Cc1cccc(Cl)c1)OC Amb24557097 [0,1,0,0,0,0|2,0,0]=3 1421 B12R1.50 CNC(=N)Cc1cccc(Br)c1 Amb25830995 [0,1,0,0,0,0|2,0,0]=3 1422 B12R1.50 CNC(=N)Nc1cc(Cl)ccc1 Amb19068647 [0,1,0,0,0,0|3,0,0]=4 1423 B12R1.50 CNC(=N)Nc1cc(F)ccc1 Amb18798760 [0,1,0,0,0,0|3,0,0]=4 1424 B12R1.50 CNC(=O)C[n+]1cccc(O)c1 Amb25663671 [0,1,0,0,0,0|2,0,0]=3 1425 B12R1.50 CNC(=O)Cc1cc(Cl)cc[n]1 Amb25102643 [0,1,0,0,0,0|2,0,0]=3 1426 B12R1.50 CNC(=O)Cc1cccc(Br)c1 Amb23111023 [0,1,0,0,0,0|1,0,0]=2 1427 B12R1.50 CNC(=O)Cc1cccc(Cl)c1 Amb22984156 [0,1,0,0,0,0|1,0,0]=2 1428 B12R1.50 CNC(=O)Cc1cccc(O)c1 Amb18788342 [0,1,0,0,0,0|1,0,0]=2 1429 B12R1.50 CNC(=O)Cc1cccc(c1)C Amb2106610 [0,1,0,0,0,0|1,0,0]=2 1430 B12R1.50 CNC(=O)Nc1cc(Br)[n]cc1 Amb25172697 [0,1,0,0,0,0|3,0,0]=4 1431 B12R1.50 CNC(=O)Nc1cc(Cl)[n]cc1 Amb24633079 [0,1,0,0,0,0|3,0,0]=4 1432 B12R1.50 CNC(=O)Nc1cc(F)ccc1 Amb22435126 [0,1,0,0,0,0|2,0,0]=3 1433 B12R1.50 CNC(=O)Nc1cccc(Br)[n]1 Amb24359345 [0,1,0,0,0,0|3,0,0]=4 1434 B12R1.50 CNC(=O)Nc1cccc(Cl)[n]1 Amb24388391 [0,1,0,0,0,0|3,0,0]=4 1435 B12R1.50 CNC(=O)Nc1cccc(c1)I Amb11258974 [0,1,0,0,0,0|2,0,0]=3 1436 B12R1.50 CNC(=O)Oc1cccc(Cl)c1 Amb24309165 [0,1,0,0,0,0|2,0,0]=3 1437 B12R1.50 CNC(=O)Oc1cccc(F)c1 Amb25674242 [0,1,0,0,0,0|2,0,0]=3 1438 B12R1.50 CNC(=O)Oc1cccc(O)c1 Amb24063537 [0,1,0,0,0,0|2,0,0]=3 1439 B12R1.50 CNC(=S)Nc1cc(I)ccc1 Amb24420247 [0,1,0,0,0,0|2,1,0]=4 1440 B12R1.50 CNC(C)Cc1cccc(F)c1 Amb18792939 [0,1,0,0,0,0|2,0,1]=4 1441 B12R1.50 CNC(C)Cc1cccc(S)c1 Amb24542790 [0,1,0,0,0,0|2,0,1]=4 1442 B12R1.50 CNC(Cc1cccc(c1)F)C Amb17614425 [0,1,0,0,0,0|2,0,1]=4 1443 B12R1.50 CN[C@@H](C)Cc1cccc(O)c1 Amb25697180 [0,1,0,0,0,0|2,0,1]=4 1444 B12R1.50 COC(=N)Cc1cccc(Br)c1 Amb25046776 [0,1,0,0,0,0|1,0,0]=2 1445 B12R1.50 COC(=N)Cc1cccc(Cl)c1 Amb19057373 [0,1,0,0,0,0|1,0,0]=2 1446 B12R1.50 COC(=N)Cc1cccc(F)c1 Amb18788552 [0,1,0,0,0,0|1,0,0]=2 1447 B12R1.50 COC(=O)CC1=CC(=O)NC=N1 Amb25311905 [0,1,0,0,0,0|2,0,0]=3 1448 B12R1.50 COC(=O)CC1CC=CC(=O)C1 Amb24405383 [0,1,0,0,0,0|0,0,3]=4 1449 B12R1.50 COC(=O)C[n+]1cc(Br)ccc1 Amb24389497 [0,1,0,0,0,0|1,0,0]=2 1450 B12R1.50 COC(=O)C[n+]1cccc(c1)O Amb11238724 [0,1,0,0,0,0|1,0,0]=2 1451 B12R1.50 COC(=O)Cc1[n]c(Br)cc[n]1 Amb24483869 [0,1,0,0,0,0|2,0,0]=3 1452 B12R1.50 COC(=O)Cc1[n]c(F)cc[n]1 Amb24679461 [0,1,0,0,0,0|2,0,0]=3 1453 B12R1.50 COC(=O)Cc1[n]c(I)cc[n]1 Amb24579042 [0,1,0,0,0,0|2,0,0]=3 1454 B12R1.50 COC(=O)Cc1[n]c(O)cc[n]1 Amb18646856 [0,1,0,0,0,0|2,0,0]=3 1455 B12R1.50 COC(=O)Cc1c[n]cc(Br)c1 Amb21857140 [0,1,0,0,0,0|1,0,0]=2 1456 B12R1.50 COC(=O)Cc1c[n]cc(O)c1 Amb25808579 [0,1,0,0,0,0|1,0,0]=2 1457 B12R1.50 COC(=O)Cc1cc(Cl)[n]c[n]1 Amb24074128 [0,1,0,0,0,0|2,0,0]=3 1458 B12R1.50 COC(=O)Cc1cc(Cl)cc[n]1 Amb22752816 [0,1,0,0,0,0|1,0,0]=2 1459 B12R1.50 COC(=O)Cc1cc(Cl)cc[n]1 Amb22899188 [0,1,0,0,0,0|1,0,0]=2 1460 B12R1.50 COC(=O)Cc1cc(F)cc[n]1 Amb24747640 [0,1,0,0,0,0|1,0,0]=2 1461 B12R1.50 COC(=O)Cc1cc[n]c(Br)[n]1 Amb24663544 [0,1,0,0,0,0|2,0,0]=3 1462 B12R1.50 COC(=O)Cc1cc[n]c(Br)c1 Amb24483854 [0,1,0,0,0,0|1,0,0]=2 1463 B12R1.50 COC(=O)Cc1cc[n]c(Cl)[n]1 Amb23440850 [0,1,0,0,0,0|2,0,0]=3 1464 B12R1.50 COC(=O)Cc1cc[n]c(F)c1 Amb25106259 [0,1,0,0,0,0|1,0,0]=2 1465 B12R1.50 COC(=O)Cc1cc[n]c(N)[n]1 Amb24365949 [0,1,0,0,0,0|2,0,0]=3 1466 B12R1.50 COC(=O)Cc1cc[n]c(N)c1 Amb25299195 [0,1,0,0,0,0|1,0,0]=2 1467 B12R1.50 COC(=O)Cc1cccc(Br)[n]1 Amb22232089 [0,1,0,0,0,0|1,0,0]=2 1468 B12R1.50 COC(=O)Cc1cccc(F)[n]1 Amb24422962 [0,1,0,0,0,0|1,0,0]=2 1469 B12R1.50 COC(=O)Cc1cccc(N)[n]1 Amb25336485 [0,1,0,0,0,0|1,0,0]=2 1470 B12R1.50 COC(=O)Cc1cccc(S)c1 Amb22490996 [0,1,0,0,0,0|0,0,0]=1 1471 B12R1.50 COC(=O)Cc1cccc(c1)N Amb10071208 [0,1,0,0,0,0|0,0,0]=1 1472 B12R1.50 COC(=O)Cc1cccc(n1)Cl Amb10976128 [0,1,0,0,0,0|1,0,0]=2 1473 B12R1.50 COC(=O)NC=1C=CNC(=O)N1 Amb24495787 [0,1,0,0,0,0|3,0,0]=4 1474 B12R1.50 COC(=O)NC=1NC(=O)C=CN1 Amb25703597 [0,1,0,0,0,0|3,0,0]=4 1475 B12R1.50 COC(=O)Nc1c[n]cc(Br)c1 Amb25732556 [0,1,0,0,0,0|2,0,0]=3 1476 B12R1.50 COC(=O)Nc1c[n]cc(I)c1 Amb24331628 [0,1,0,0,0,0|2,0,0]=3 1477 B12R1.50 COC(=O)Nc1cc(Br)[n]c[n]1 Amb25055726 [0,1,0,0,0,0|3,0,0]=4 1478 B12R1.50 COC(=O)Nc1cc(Cl)ccn1 Amb10070699 [0,1,0,0,0,0|2,0,0]=3 1479 B12R1.50 COC(=O)Nc1cccc(C)c1 Amb17731515 [0,1,0,0,0,0|1,0,0]=2 1480 B12R1.50 COC(=O)Nc1cccc(I)c1 Amb25774750 [0,1,0,0,0,0|1,0,0]=2 1481 B12R1.50 COC(=O)Nc1cccc(c1)Cl Amb1625032 [0,1,0,0,0,0|1,0,0]=2 1482 B12R1.50 COC(=O)Nc1cccc(c1)N Amb17622185 [0,1,0,0,0,0|1,0,0]=2 1483 B12R1.50 COC(=O)Oc1cc(N)ccc1 Amb25759843 [0,1,0,0,0,0|1,0,0]=2 1484 B12R1.50 COC(=S)Nc1cccc(O)c1 Amb25311054 [0,1,0,0,0,0|1,1,0]=3 1485 B12R1.50 CON(C)Cc1c[n]cc(Br)c1 Amb24544294 [0,1,0,0,0,0|3,0,0]=4 1486 B12R1.50 CON(C)Cc1c[n]cc(F)c1 Amb25816737 [0,1,0,0,0,0|3,0,0]=4 1487 B12R1.50 COS(=O)Nc1ccc[n+](c1)C Amb10552857 [0,1,0,0,0,0|3,0,0]=4 1488 B12R1.50 CSC(=O)Nc1cccc(N)c1 Amb24531527 [0,1,0,0,0,0|1,1,0]=3 1489 B12R1.50 CS\C(\N)=N/c1cccc(Cl)c1 Amb24462812 [0,1,0,0,0,0|2,1,0]=4 1490 B12R1.50 C[n+]1cc(ccc1)NC(=O)OC Amb24225243 [0,1,0,0,0,0|2,0,0]=3 1491 B12R1.50 C\C(\Cc1cc(O)ccc1)=N/O Amb24487234 [0,1,0,0,0,0|3,0,0]=4 1492 B12R1.50 C\C(\Cc1cc(O)ccc1)=N\O Amb25227653 [0,1,0,0,0,0|3,0,0]=4 1493 B12R1.50 C\C(\Cc1cccc(Br)c1)=N\O Amb24634595 [0,1,0,0,0,0|3,0,0]=4 1494 B12R1.50 C\C(\Cc1cccc(Cl)c1)=N\N Amb24636219 [0,1,0,0,0,0|3,0,0]=4 1495 B12R1.50 C\C(\Cc1cccc(F)c1)=N\N Amb25725343 [0,1,0,0,0,0|3,0,0]=4 1496 B12R1.50 C\C(\Cc1cccc(F)c1)=N\O Amb25225688 [0,1,0,0,0,0|3,0,0]=4 1497 B12R1.50 Cc1c[n]cc(c1)NC(=O)CC Amb24703475 [0,1,0,0,0,0|3,0,0]=4 1498 B12R1.50 Cc1cc(CC(=N)OC)ccc1 Amb18798192 [0,1,0,0,0,0|1,0,0]=2 1499 B12R1.50 Cc1cc(CC(=O)C=C)ccc1 Amb25278058 [0,1,0,0,0,0|1,0,1]=3 1500 B12R1.50 Cc1cc(CC(=O)CBr)ccc1 Amb25089939 [0,1,0,0,0,0|2,0,0]=3 1501 B12R1.50 Cc1cc(CC(=O)CN)ccc1 Amb18829247 [0,1,0,0,0,0|2,0,0]=3 1502 B12R1.50 Cc1cc(CC(=O)CO)ccc1 Amb18563612 [0,1,0,0,0,0|2,0,0]=3 1503 B12R1.50 Cc1cc(CC(=O)NN)[n]cc1 Amb24501374 [0,1,0,0,0,0|3,0,0]=4 1504 B12R1.50 Cc1cc(CC(=O)NN)cc[n]1 Amb24615780 [0,1,0,0,0,0|3,0,0]=4 1505 B12R1.50 Cc1cc(CC(=O)NO)ccc1 Amb18798398 [0,1,0,0,0,0|2,0,0]=3 1506 B12R1.50 Cc1cc(CC(=O)OC)cc[n]1 Amb23441228 [0,1,0,0,0,0|1,0,0]=2 1507 B12R1.50 Cc1cc(CC(N)=NN)ccc1 Amb18798212 [0,1,0,0,0,0|3,0,0]=4 1508 B12R1.50 Cc1cc(cc[n]1)NC(=O)CC Amb24566091 [0,1,0,0,0,0|3,0,0]=4 1509 B12R1.50 Cc1cc(cc[n]1)NC(=O)OC Amb25358566 [0,1,0,0,0,0|2,0,0]=3 1510 B12R1.50 Cc1cc(ccc1)NC(=N)CC Amb24723153 [0,1,0,0,0,0|3,0,0]=4 1511 B12R1.50 Cc1cc(ccc1)NC(=N)NC Amb18798225 [0,1,0,0,0,0|3,0,0]=4 1512 B12R1.50 Cc1cc(ccc1)NC(=O)C#C Amb25252501 [0,1,0,0,0,0|2,0,1]=4 1513 B12R1.50 Cc1cc(ccc1)NC(=O)C=O Amb24468252 [0,1,0,0,0,0|3,0,0]=4 1514 B12R1.50 Cc1cc(ccc1)NC(=O)CN Amb21958998 [0,1,0,0,0,0|3,0,0]=4 1515 B12R1.50 Cc1cc(ccc1)NC(=O)SC Amb24743264 [0,1,0,0,0,0|1,1,0]=3 1516 B12R1.50 Cc1cc(ccc1)NC(=S)OC Amb25743468 [0,1,0,0,0,0|1,1,0]=3 1517 B12R1.50 Cc1cc(ccc1)OC(=O)C=C Amb25330984 [0,1,0,0,0,0|2,0,1]=4 1518 B12R1.50 Cc1cc(ccc1)OC(=O)CC Amb25198730 [0,1,0,0,0,0|2,0,0]=3 1519 B12R1.50 Cc1cc(ccc1)OC(=O)CN Amb19115307 [0,1,0,0,0,0|3,0,0]=4 1520 B12R1.50 Cc1cc(ccc1)OC(=O)CO Amb25160233 [0,1,0,0,0,0|3,0,0]=4 1521 B12R1.50 Cc1cc(ccc1)\N=C(/N)\SC Amb24378057 [0,1,0,0,0,0|2,1,0]=4 1522 B12R1.50 Cc1cc[n]c(CC(=O)OC)c1 Amb22750287 [0,1,0,0,0,0|1,0,0]=2 1523 B12R1.50 Cc1cc[n]c(CN(C)OC)c1 Amb24450809 [0,1,0,0,0,0|3,0,0]=4 1524 B12R1.50 Cc1cc[n]c(c1)NC(=O)NC Amb24452181 [0,1,0,0,0,0|3,0,0]=4 1525 B12R1.50 Cc1cccc(CC(=O)NC)[n]1 Amb25315061 [0,1,0,0,0,0|2,0,0]=3 1526 B12R1.50 Cc1cccc(CC(=O)NN)[n]1 Amb24501362 [0,1,0,0,0,0|3,0,0]=4 1527 B12R1.50 Cc1cccc(CC(=O)OC)[n]1 Amb21857032 [0,1,0,0,0,0|1,0,0]=2 1528 B12R1.50 Cc1cccc(CC(Br)CC)c1 Amb24483315 [0,1,0,0,0,0|2,0,1]=4 1529 B12R1.50 Cc1cccc(CN(C)CC)c1 Amb25749187 [0,1,0,0,0,0|3,0,0]=4 1530 B12R1.50 Cc1cccc(CN(C)OC)c1 Amb24474494 [0,1,0,0,0,0|2,0,0]=3 1531 B12R1.50 Cc1cccc(CS(=O)CC)c1 Amb24408190 [0,1,0,0,0,0|2,0,0]=3 1532 B12R1.50 Cc1cccc(C\C(\C)=N\O)c1 Amb24487383 [0,1,0,0,0,0|3,0,0]=4 1533 B12R1.50 Cc1cccc(NC(=O)NC)[n]1 Amb25253519 [0,1,0,0,0,0|3,0,0]=4 1534 B12R1.50 ClCC(=O)Nc1cccc(c1)Br Amb1207240 [0,1,0,0,0,0|3,0,0]=4 1535 B12R1.50 ClCC(=O)Nc1cccc(c1)F Amb1643744 [0,1,0,0,0,0|3,0,0]=4 1536 B12R1.50 ClCC(=O)Nc1cccc(c1)I Amb1635732 [0,1,0,0,0,0|3,0,0]=4 1537 B12R1.50 ICC(=O)Nc1cccc(c1)C Amb16207226 [0,1,0,0,0,0|3,0,0]=4 1538 B12R1.50 NCC(=O)Cc1cc(Br)ccc1 Amb18160371 [0,1,0,0,0,0|2,0,0]=3 1539 B12R1.50 NCC(=O)Cc1cc(Cl)ccc1 Amb18823030 [0,1,0,0,0,0|2,0,0]=3 1540 B12R1.50 NCC(=O)Cc1cc(F)ccc1 Amb18199528 [0,1,0,0,0,0|2,0,0]=3 1541 B12R1.50 NCC(=O)Cc1cc(O)ccc1 Amb18251724 [0,1,0,0,0,0|2,0,0]=3 1542 B12R1.50 NCC(=O)Nc1cccc(O)c1 Amb18951677 [0,1,0,0,0,0|3,0,0]=4 1543 B12R1.50 NCC(=O)Nc1cccc(c1)Cl Amb15740916 [0,1,0,0,0,0|3,0,0]=4 1544 B12R1.50 NCC(=O)Oc1cccc(c1)Br Amb17344447 [0,1,0,0,0,0|3,0,0]=4 1545 B12R1.50 NCC(=O)Oc1cccc(c1)C Amb17334635 [0,1,0,0,0,0|3,0,0]=4 1546 B12R1.50 NCC(=O)Oc1cccc(c1)Cl Amb17335804 [0,1,0,0,0,0|3,0,0]=4 1547 B12R1.50 NCC(=O)Oc1cccc(c1)F Amb17334753 [0,1,0,0,0,0|3,0,0]=4 1548 B12R1.50 NNC(=O)Cc1cc[n]c(Cl)c1 Amb25169036 [0,1,0,0,0,0|3,0,0]=4 1549 B12R1.50 NNC(=O)Cc1cccc(I)c1 Amb25092748 [0,1,0,0,0,0|2,0,0]=3 1550 B12R1.50 NNC(=O)Cc1cccc(O)c1 Amb18788433 [0,1,0,0,0,0|2,0,0]=3 1551 B12R1.50 NNC(=O)Cc1cccc(c1)C Amb10075484 [0,1,0,0,0,0|2,0,0]=3 1552 B12R1.50 NNC(=O)Nc1cc(O)ccc1 Amb25159314 [0,1,0,0,0,0|3,0,0]=4 1553 B12R1.50 NNC(=O)Oc1cccc(Cl)c1 Amb25772432 [0,1,0,0,0,0|3,0,0]=4 1554 B12R1.50 N\C(\Cc1cc(O)ccc1)=N\O Amb25103462 [0,1,0,0,0,0|3,0,0]=4 1555 B12R1.50 N\C(\Cc1cccc(Br)c1)=N\N Amb25149906 [0,1,0,0,0,0|3,0,0]=4 1556 B12R1.50 N\C(\Cc1cccc(Cl)c1)=N\N Amb19045348 [0,1,0,0,0,0|3,0,0]=4 1557 B12R1.50 N\C(\Cc1cccc(F)c1)=N\N Amb18788562 [0,1,0,0,0,0|3,0,0]=4 1558 B12R1.50 Nc1cc(CC(=O)CN)cc[n]1 Amb25062881 [0,1,0,0,0,0|3,0,0]=4 1559 B12R1.50 Nc1cc(ccc1)OC(=O)CN Amb25291404 [0,1,0,0,0,0|3,0,0]=4 1560 B12R1.50 Nc1cccc(C\C(\N)=N/O)c1 Amb24711722 [0,1,0,0,0,0|3,0,0]=4 1561 B12R1.50 O=C(CF)Cc1cc(Cl)ccc1 Amb23454832 [0,1,0,0,0,0|2,0,0]=3 1562 B12R1.50 O=C(CS)Nc1cccc(I)c1 Amb22270162 [0,1,0,0,0,0|3,0,0]=4 1563 B12R1.50 O=C(Cc1cc(Br)ccc1)CBr Amb22233785 [0,1,0,0,0,0|2,0,0]=3 1564 B12R1.50 O=C(Cc1cccc(Br)c1)C=O Amb24402453 [0,1,0,0,0,0|2,0,0]=3 1565 B12R1.50 O=C(Cc1cccc(Cl)c1)CBr Amb24627962 [0,1,0,0,0,0|2,0,0]=3 1566 B12R1.50 OCC(=O)Cc1cc(Br)ccc1 Amb18572003 [0,1,0,0,0,0|2,0,0]=3 1567 B12R1.50 OCC(=O)Cc1cc(Cl)ccc1 Amb18564304 [0,1,0,0,0,0|2,0,0]=3 1568 B12R1.50 OCC(=O)Cc1cc(F)ccc1 Amb25232023 [0,1,0,0,0,0|2,0,0]=3 1569 B12R1.50 OCC(=O)Nc1cccc(c1)Cl Amb1110353 [0,1,0,0,0,0|3,0,0]=4 1570 B12R1.50 OCC(=O)Nc1cccc(c1)F Amb1110282 [0,1,0,0,0,0|3,0,0]=4 1571 B12R1.50 OCC(=O)Oc1cccc(Cl)c1 Amb25043439 [0,1,0,0,0,0|3,0,0]=4 1572 B12R1.50 ONC(=O)Cc1cccc(Br)c1 Amb25751442 [0,1,0,0,0,0|2,0,0]=3 1573 B12R1.50 ONC(=O)Cc1cccc(Cl)c1 Amb19075673 [0,1,0,0,0,0|2,0,0]=3 1574 B12R1.50 O\N=C(\Cc1cccc(c1)Cl)/N Amb1117604 [0,1,0,0,0,0|3,0,0]=4 1575 B12R1.50 Oc1cc(CC(=O)NO)ccc1 Amb18788532 [0,1,0,0,0,0|2,0,0]=3 1576 B12R1.50 Oc1cc(ccc1)NC(=O)CS Amb24072204 [0,1,0,0,0,0|3,0,0]=4 1577 B12R1.50 Oc1cc(ccc1)OC(=O)CCl Amb18649457 [0,1,0,0,0,0|3,0,0]=4 1578 B12R1.118 C=C=C(CCl)Cc1ccccc1 Amb25211674 [0,1,0,0,0,0|2,0,1]=4 1579 B12R1.118 C=C=C(CO)Cc1ccccc1 Amb25777134 [0,1,0,0,0,0|1,0,2]=4 1580 B12R1.118 C=C=C(Cc1ccccc1)C=O Amb25123884 [0,1,0,0,0,0|1,0,1]=3 1581 B12R1.118 C=C\C(\C=O)=C\c1ccccc1 Amb24553053 [0,1,0,0,0,0|1,0,2]=4 1582 B12R1.118 CCC(Cc1ccccc1)CN Amb10778756 [0,1,0,0,0,0|2,0,1]=4 1583 B12R1.118 CCC(Cc1ccccc1)NC Amb18792514 [0,1,0,0,0,0|2,0,1]=4 1584 B12R1.118 CCC(Nc1ccccc1)=NN Amb18788210 [0,1,0,0,0,0|3,0,0]=4 1585 B12R1.118 CCN(Cc1ccccc1)C#N Amb24700837 [0,1,0,0,0,0|3,0,0]=4 1586 B12R1.118 CCN(Cc1ccccc1)C=O Amb25034769 [0,1,0,0,0,0|2,0,0]=3 1587 B12R1.118 CCN(Cc1ccccc1)CC Amb22348278 [0,1,0,0,0,0|3,0,0]=4 1588 B12R1.118 CCN(Cc1ccccc1)N=O Amb24376725 [0,1,0,0,0,0|2,0,0]=3 1589 B12R1.118 CC\C(=C/c1ccccn1)\C=O Amb17334523 [0,1,0,0,0,0|2,0,1]=4 1590 B12R1.118 CC\C(=C/c1cccnc1)\C=O Amb17334524 [0,1,0,0,0,0|2,0,1]=4 1591 B12R1.118 CC\C(=C/c1ccncc1)\C=O Amb17334525 [0,1,0,0,0,0|2,0,1]=4 1592 B12R1.118 CC\C(\C=O)=C\c1cc[n]cc1 Amb25271672 [0,1,0,0,0,0|2,0,1]=4 1593 B12R1.118 CC\C(\C=O)=C\c1cccc[n]1 Amb24474541 [0,1,0,0,0,0|2,0,1]=4 1594 B12R1.118 CC\C(\CN)=C\c1ccccc1 Amb25138398 [0,1,0,0,0,0|2,0,1]=4 1595 B12R1.118 CC\C(\Cc1ccccc1)=N\N Amb25057429 [0,1,0,0,0,0|2,0,0]=3 1596 B12R1.118 CC\C(\Nc1ccccc1)=N\O Amb24356045 [0,1,0,0,0,0|2,0,1]=4 1597 B12R1.118 CNC(Cc1ccccc1)C#C Amb25797878 [0,1,0,0,0,0|2,0,1]=4 1598 B12R1.118 CN[C@@H](CO)Cc1ccccc1 Amb22745072 [0,1,0,0,0,0|1,0,2]=4 1599 B12R1.118 CN\C(=N\C)\Sc1ccccc1 Amb24451577 [0,1,0,0,0,0|3,0,0]=4 1600 B12R1.118 CN\C(\Cc1ccccc1)=N/N Amb18788196 [0,1,0,0,0,0|2,0,0]=3 1601 B12R1.118 CN\C(\Cc1ccccc1)=N\O Amb25376955 [0,1,0,0,0,0|1,0,1]=3 1602 B12R1.118 CN\C(\Nc1ccccc1)=N\N Amb25256907 [0,1,0,0,0,0|3,0,0]=4 1603 B12R1.118 COC(CN)Cc1ccccc1 Amb21954040 [0,1,0,0,0,0|1,0,1]=3 1604 B12R1.118 COC(CN)Oc1ccccc1 Amb24061283 [0,1,0,0,0,0|2,0,1]=4 1605 B12R1.118 COC(Cc1ccccc1)C#N Amb25681947 [0,1,0,0,0,0|1,0,1]=3 1606 B12R1.118 COC(OC)Sc1ccccc1 Amb22347498 [0,1,0,0,0,0|1,0,2]=4 1607 B12R1.118 CO[SiH](Cc1ccccc1)C=C Amb22231750 [0,1,0,0,0,0|1,1,0]=3 1608 B12R1.118 CO\C(=C\c1ccccc1)\C=O Amb17594035 [0,1,0,0,0,0|0,0,1]=2 1609 B12R1.118 CO\C(\C=O)=C/c1ccc[n]c1 Amb25713631 [0,1,0,0,0,0|1,0,1]=3 1610 B12R1.118 CSC(Cc1ccccc1)C#N Amb17594511 [0,1,0,0,0,0|1,1,1]=4 1611 B12R1.118 CS\C(=C\c1ccccc1)\C#N Amb17594452 [0,1,0,0,0,0|1,1,1]=4 1612 B12R1.118 C\C=C(/C#N)\Nc1ccccc1 Amb24682777 [0,1,0,0,0,0|3,0,0]=4 1613 B12R1.118 C\C=C(/C=C)\Oc1ccccc1 Amb24068923 [0,1,0,0,0,0|3,0,0]=4 1614 B12R1.118 C\C=C(/C=O)\Oc1ccccc1 Amb24697807 [0,1,0,0,0,0|2,0,0]=3 1615 B12R1.118 C\C=C(/Cc1ccccc1)\C=O Amb18645376 [0,1,0,0,0,0|1,0,0]=2 1616 B12R1.118 C\C=C(\C=O)/Sc1ccccc1 Amb18648151 [0,1,0,0,0,0|2,0,0]=3 1617 B12R1.118 C\C=C(\Cc1ccccc1)/C=O Amb25743406 [0,1,0,0,0,0|1,0,0]=2 1618 B12R1.118 C\N=C(\Cc1ccc[n]c1)/NC Amb24062496 [0,1,0,0,0,0|3,0,0]=4 1619 B12R1.118 N#CC(Cc1ccccc1)C=O Amb22371309 [0,1,0,0,0,0|2,0,1]=4 1620 B12R1.118 N#C\C(\C=O)=C/c1ccccc1 Amb24566216 [0,1,0,0,0,0|2,0,1]=4 1621 B12R1.118 N#C\C(\C=O)=C\c1ccccc1 Amb18644900 [0,1,0,0,0,0|2,0,1]=4 1622 B12R1.118 N\C=C(\Cc1ccccc1)/C#N Amb24743507 [0,1,0,0,0,0|3,0,0]=4 1623 B12R1.118 O=CC(=Cc1ccccc1)C=O Amb18645276 [0,1,0,0,0,0|2,0,1]=4 1624 B12R1.118 O=C\C(\CCl)=C\c1ccccc1 Amb25669592 [0,1,0,0,0,0|2,0,1]=4 1625 B12R1.118 O=C\C(\Cc1ccccc1)=C/Cl Amb25300287 [0,1,0,0,0,0|2,0,0]=3 1626 B12R1.118 OC\C(\Cc1ccccc1)=C\F Amb25037074 [0,1,0,0,0,0|2,0,1]=4 1627 B12R1.118 OC\C(\Cc1ccccc1)=N\O Amb25052256 [0,1,0,0,0,0|2,0,1]=4 1628 B12R1.118 O\C=C(/C=O)\Oc1ccccc1 Amb24625847 [0,1,0,0,0,0|3,0,0]=4 1629 B12R1.194 C=CS(=O)(=O)Cc1ccccc1 Amb2459233 [0,1,0,0,0,0|2,0,1]=4 1630 B12R1.194 CC(C)(Cc1ccccc1)NC Amb22349936 [0,1,0,0,0,0|2,0,1]=4 1631 B12R1.194 CCC(C)(Cl)Cc1ccccc1 Amb25080041 [0,1,0,0,0,0|2,0,1]=4 1632 B12R1.194 CCS(=O)(=O)Cc1cccc[n]1 Amb24473735 [0,1,0,0,0,0|3,0,0]=4 1633 B12R1.194 CCS(=O)(=O)Oc1ccccc1 Amb23496964 [0,1,0,0,0,0|3,0,0]=4 1634 B12R1.194 CNS(=O)(=O)Cc1c[n]ccc1 Amb22301453 [0,1,0,0,0,0|3,0,0]=4 1635 B12R1.194 CNS(=O)(=O)Cc1cc[n]cc1 Amb22301454 [0,1,0,0,0,0|3,0,0]=4 1636 B12R1.194 CNS(=O)(=O)Cc1cccc[n]1 Amb22301447 [0,1,0,0,0,0|3,0,0]=4 1637 B12R1.194 CNS(=O)(=O)Cc1ccccc1 Amb1125735 [0,1,0,0,0,0|2,0,0]=3 1638 B12R1.194 COC(Cc1ccccc1)(C)C Amb10555866 [0,1,0,0,0,0|1,0,1]=3 1639 B12R1.194 COP(O)(=O)Cc1ccccc1 Amb25353668 [0,1,0,0,0,0|1,0,0]=2 1640 B12R1.194 CO[Si](C)(C)Cc1ccccc1 Amb22167044 [0,1,0,0,0,0|1,1,0]=3 1641 B12R1.194 O=S(=O)(CCl)Cc1ccccc1 Amb22364602 [0,1,0,0,0,0|3,0,0]=4 1642 B12R1.371 BrCC(=O)Nc1ccccc1F Amb2089069 [0,1,0,0,0,0|3,0,0]=4 1643 B12R1.371 BrCC(=O)Nc1ccccc1O Amb17325450 [0,1,0,0,0,0|3,0,0]=4 1644 B12R1.371 C#CC(=O)Cc1ccccc1Br Amb24483898 [0,1,0,0,0,0|1,0,1]=3 1645 B12R1.371 C#CC(=O)Nc1ccccc1Cl Amb23556962 [0,1,0,0,0,0|2,0,1]=4 1646 B12R1.371 C#CC(=O)Nc1ccccc1I Amb25149785 [0,1,0,0,0,0|2,0,1]=4 1647 B12R1.371 C#CC(=O)Oc1ccccc1F Amb24498038 [0,1,0,0,0,0|2,0,1]=4 1648 B12R1.371 C=C(Cc1ccccc1Cl)C=O Amb25373181 [0,1,0,0,0,0|3,0,0]=4 1649 B12R1.371 C=C(Cc1ccccc1F)C=O Amb25674264 [0,1,0,0,0,0|3,0,0]=4 1650 B12R1.371 C=CC(=O)Cc1cc[n]cc1Cl Amb25160000 [0,1,0,0,0,0|2,0,1]=4 1651 B12R1.371 C=CC(=O)Cc1ccccc1Cl Amb24350181 [0,1,0,0,0,0|1,0,1]=3 1652 B12R1.371 C=CC(=O)Nc1ccccc1O Amb18645794 [0,1,0,0,0,0|2,0,1]=4 1653 B12R1.371 C=CC(=O)Oc1ccccc1Br Amb25156556 [0,1,0,0,0,0|2,0,1]=4 1654 B12R1.371 CCC(=C)CN1C=CC=CC1=O Amb25757647 [0,1,0,0,0,0|3,0,0]=4 1655 B12R1.371 CCC(=N)Nc1ccccc1Br Amb25323152 [0,1,0,0,0,0|3,0,0]=4 1656 B12R1.371 CCC(=O)CN1C=CC=CC1=O Amb18800894 [0,1,0,0,0,0|2,0,0]=3 1657 B12R1.371 CCC(=O)CN1C=CC=NC1=O Amb18801013 [0,1,0,0,0,0|3,0,0]=4 1658 B12R1.371 CCC(=O)CN1C=CN=CC1=O Amb24360154 [0,1,0,0,0,0|3,0,0]=4 1659 B12R1.371 CCC(=O)CN1N=CC=CC1=O Amb18792743 [0,1,0,0,0,0|3,0,0]=4 1660 B12R1.371 CCC(=O)Cc1ccccc1Br Amb19148340 [0,1,0,0,0,0|1,0,0]=2 1661 B12R1.371 CCC(=O)Cc1ccccc1C Amb17138542 [0,1,0,0,0,0|1,0,0]=2 1662 B12R1.371 CCC(=O)Cc1ccccc1Cl Amb17139041 [0,1,0,0,0,0|1,0,0]=2 1663 B12R1.371 CCC(=O)Cc1ccccc1F Amb17138603 [0,1,0,0,0,0|1,0,0]=2 1664 B12R1.371 CCC(=O)Cc1ccccc1O Amb18646038 [0,1,0,0,0,0|1,0,0]=2 1665 B12R1.371 CCC(=O)NN1C=CC=CC1=O Amb25120523 [0,1,0,0,0,0|3,0,0]=4 1666 B12R1.371 CCC(=O)Nc1[n]cccc1Cl Amb24629082 [0,1,0,0,0,0|3,0,0]=4 1667 B12R1.371 CCC(=O)Nc1[n]cccc1N Amb25035069 [0,1,0,0,0,0|3,0,0]=4 1668 B12R1.371 CCC(=O)Nc1[n]cccc1O Amb25832301 [0,1,0,0,0,0|3,0,0]=4 1669 B12R1.371 CCC(=O)Nc1c[n]ccc1O Amb25235914 [0,1,0,0,0,0|3,0,0]=4 1670 B12R1.371 CCC(=O)Nc1cc[n]cc1Br Amb24456665 [0,1,0,0,0,0|3,0,0]=4 1671 B12R1.371 CCC(=O)Nc1cc[n]cc1F Amb24533641 [0,1,0,0,0,0|3,0,0]=4 1672 B12R1.371 CCC(=O)Nc1cc[n]cc1I Amb25851978 [0,1,0,0,0,0|3,0,0]=4 1673 B12R1.371 CCC(=O)Nc1cc[n]cc1N Amb18288772 [0,1,0,0,0,0|3,0,0]=4 1674 B12R1.371 CCC(=O)Nc1ccc[n]c1I Amb24380431 [0,1,0,0,0,0|3,0,0]=4 1675 B12R1.371 CCC(=O)Nc1ccccc1Br Amb2222500 [0,1,0,0,0,0|2,0,0]=3 1676 B12R1.371 CCC(=O)Nc1ccccc1I Amb1788758 [0,1,0,0,0,0|2,0,0]=3 1677 B12R1.371 CCC(=O)Nc1ccccc1N Amb1114296 [0,1,0,0,0,0|2,0,0]=3 1678 B12R1.371 CCC(=O)Oc1ccc[nH]c1=O Amb24084911 [0,1,0,0,0,0|3,0,0]=4 1679 B12R1.371 CCC(=O)Oc1ccc[n]c1Br Amb25820275 [0,1,0,0,0,0|3,0,0]=4 1680 B12R1.371 CCC(=O)Oc1ccccc1F Amb25039137 [0,1,0,0,0,0|2,0,0]=3 1681 B12R1.371 CCC(=O)Oc1ccccc1N Amb24743412 [0,1,0,0,0,0|2,0,0]=3 1682 B12R1.371 CCC(=O)Oc1ccccc1O Amb22167293 [0,1,0,0,0,0|2,0,0]=3 1683 B12R1.371 CCC(Br)Cc1ccccc1Cl Amb24675424 [0,1,0,0,0,0|2,0,1]=4 1684 B12R1.371 CCC(C)Cc1ccccc1N Amb25034567 [0,1,0,0,0,0|2,0,1]=4 1685 B12R1.371 CCC(Cc1ccccc1C)Cl Amb17477425 [0,1,0,0,0,0|2,0,1]=4 1686 B12R1.371 CCC(Cc1ccccc1C)O Amb17138581 [0,1,0,0,0,0|1,0,2]=4 1687 B12R1.371 CCC(Cc1ccccc1Cl)Cl Amb17477603 [0,1,0,0,0,0|2,0,1]=4 1688 B12R1.371 CCC(Cc1ccccc1Cl)O Amb17139101 [0,1,0,0,0,0|1,0,2]=4 1689 B12R1.371 CCC(Cc1ccccc1F)O Amb17138635 [0,1,0,0,0,0|1,0,2]=4 1690 B12R1.371 CCC(Cl)Cc1ccccc1F Amb19046368 [0,1,0,0,0,0|2,0,1]=4 1691 B12R1.371 CCC(N)Cc1ccccc1Br Amb20627508 [0,1,0,0,0,0|2,0,1]=4 1692 B12R1.371 CCC(O)Cc1ccccc1Br Amb24465632 [0,1,0,0,0,0|1,0,2]=4 1693 B12R1.371 CCC(O)Cc1ccccc1N Amb25335274 [0,1,0,0,0,0|1,0,2]=4 1694 B12R1.371 CCN(C)Cc1ccccc1Br Amb24370391 [0,1,0,0,0,0|3,0,0]=4 1695 B12R1.371 CCN(C)Cc1ccccc1Cl Amb25107530 [0,1,0,0,0,0|3,0,0]=4 1696 B12R1.371 CCN(C)Cc1ccccc1F Amb25749463 [0,1,0,0,0,0|3,0,0]=4 1697 B12R1.371 CCN(C)Cc1ccccc1F Amb25846054 [0,1,0,0,0,0|3,0,0]=4 1698 B12R1.371 CCN(C)Cc1ccccc1O Amb24493028 [0,1,0,0,0,0|3,0,0]=4 1699 B12R1.371 CCN(N)Cc1ccccc1Br Amb25738572 [0,1,0,0,0,0|3,0,0]=4 1700 B12R1.371 CCS(=O)Cc1ccc[n]c1Cl Amb24627715 [0,1,0,0,0,0|3,0,0]=4 1701 B12R1.371 CCS(=O)Cc1ccccc1F Amb24449347 [0,1,0,0,0,0|2,0,0]=3 1702 B12R1.371 CCS(=O)Cc1ccccc1N Amb18290934 [0,1,0,0,0,0|2,0,0]=3 1703 B12R1.371 CCS(=O)Cc1ccccc1O Amb18648969 [0,1,0,0,0,0|2,0,0]=3 1704 B12R1.371 CN(Cc1[n]cccc1Br)OC Amb24343519 [0,1,0,0,0,0|3,0,0]=4 1705 B12R1.371 CN(Cc1[n]cccc1N)OC Amb25083515 [0,1,0,0,0,0|3,0,0]=4 1706 B12R1.371 CN(Cc1ccccc1Cl)OC Amb25284132 [0,1,0,0,0,0|2,0,0]=3 1707 B12R1.371 CN/1C=CC=C\C1=C/C(=O)CC Amb25203895 [0,1,0,0,0,0|2,0,1]=4 1708 B12R1.371 CNC(=N)Cc1ccccc1F Amb24483570 [0,1,0,0,0,0|2,0,0]=3 1709 B12R1.371 CNC(=N)Nc1ccccc1Br Amb25143004 [0,1,0,0,0,0|3,0,0]=4 1710 B12R1.371 CNC(=N)Nc1ccccc1Cl Amb19068649 [0,1,0,0,0,0|3,0,0]=4 1711 B12R1.371 CNC(=N)Nc1ccccc1F Amb18798762 [0,1,0,0,0,0|3,0,0]=4 1712 B12R1.371 CNC(=O)CN1C=CC=CC1=O Amb25789798 [0,1,0,0,0,0|2,0,0]=3 1713 B12R1.371 CNC(=O)CN1C=NC=CC1=O Amb25667482 [0,1,0,0,0,0|3,0,0]=4 1714 B12R1.371 CNC(=O)C[n+]1ccccc1Br Amb25663673 [0,1,0,0,0,0|2,0,0]=3 1715 B12R1.371 CNC(=O)Cc1[n]cccc1F Amb24673177 [0,1,0,0,0,0|2,0,0]=3 1716 B12R1.371 CNC(=O)Cc1ccc[n]c1N Amb25728841 [0,1,0,0,0,0|2,0,0]=3 1717 B12R1.371 CNC(=O)Cc1ccccc1Br Amb22001453 [0,1,0,0,0,0|1,0,0]=2 1718 B12R1.371 CNC(=O)Cc1ccccc1C Amb2106609 [0,1,0,0,0,0|1,0,0]=2 1719 B12R1.371 CNC(=O)Cc1ccccc1Cl Amb23014080 [0,1,0,0,0,0|1,0,0]=2 1720 B12R1.371 CNC(=O)Cc1ccccc1F Amb23014294 [0,1,0,0,0,0|1,0,0]=2 1721 B12R1.371 CNC(=O)Cc1ccccc1N Amb1114729 [0,1,0,0,0,0|1,0,0]=2 1722 B12R1.371 CNC(=O)Nc1[n]cccc1Cl Amb25757214 [0,1,0,0,0,0|3,0,0]=4 1723 B12R1.371 CNC(=O)Nc1[n]cccc1N Amb25129890 [0,1,0,0,0,0|3,0,0]=4 1724 B12R1.371 CNC(=O)Nc1cc[n]cc1Br Amb25682806 [0,1,0,0,0,0|3,0,0]=4 1725 B12R1.371 CNC(=O)Nc1cc[n]cc1Cl Amb24621491 [0,1,0,0,0,0|3,0,0]=4 1726 B12R1.371 CNC(=O)Nc1cc[n]cc1F Amb24635354 [0,1,0,0,0,0|3,0,0]=4 1727 B12R1.371 CNC(=O)Nc1ccc[n]c1Br Amb25834066 [0,1,0,0,0,0|3,0,0]=4 1728 B12R1.371 CNC(=O)Nc1ccc[n]c1Cl Amb25066225 [0,1,0,0,0,0|3,0,0]=4 1729 B12R1.371 CNC(=O)Nc1ccccc1Br Amb11316867 [0,1,0,0,0,0|2,0,0]=3 1730 B12R1.371 CNC(=O)Nc1ccccc1F Amb2444100 [0,1,0,0,0,0|2,0,0]=3 1731 B12R1.371 CNC(=O)Nc1ccccc1I Amb14010753 [0,1,0,0,0,0|2,0,0]=3 1732 B12R1.371 CNC(=O)Nc1ccccc1N Amb25242450 [0,1,0,0,0,0|2,0,0]=3 1733 B12R1.371 CNC(=O)Nc1ncccc1C Amb2132784 [0,1,0,0,0,0|3,0,0]=4 1734 B12R1.371 CNC(=O)Oc1ccc[n]c1N Amb25172417 [0,1,0,0,0,0|3,0,0]=4 1735 B12R1.371 CNC(=O)Oc1ccccc1Cl Amb22479442 [0,1,0,0,0,0|2,0,0]=3 1736 B12R1.371 CNC(=O)Oc1ccccc1F Amb24669113 [0,1,0,0,0,0|2,0,0]=3 1737 B12R1.371 CNC(=O)Oc1ccccc1N Amb24429125 [0,1,0,0,0,0|2,0,0]=3 1738 B12R1.371 CNC(=O)Oc1ccccc1O Amb18646674 [0,1,0,0,0,0|2,0,0]=3 1739 B12R1.371 CNC(=S)Nc1ccccc1Br Amb1811707 [0,1,0,0,0,0|2,1,0]=4 1740 B12R1.371 CNC(=S)Nc1ccccc1Cl Amb1841527 [0,1,0,0,0,0|2,1,0]=4 1741 B12R1.371 CNC(=S)Nc1ccccc1I Amb24386371 [0,1,0,0,0,0|2,1,0]=4 1742 B12R1.371 CNC(=S)Nc1ccccc1N Amb2423166 [0,1,0,0,0,0|2,1,0]=4 1743 B12R1.371 CNC(C)Cc1ccccc1Br Amb25149882 [0,1,0,0,0,0|2,0,1]=4 1744 B12R1.371 CN[C@@H](C)Cc1ccccc1F Amb25264769 [0,1,0,0,0,0|2,0,1]=4 1745 B12R1.371 COC(=N)Cc1ccccc1Cl Amb19074651 [0,1,0,0,0,0|1,0,0]=2 1746 B12R1.371 COC(=N)Cc1ccccc1F Amb18792903 [0,1,0,0,0,0|1,0,0]=2 1747 B12R1.371 COC(=O)CC1=CN=CNC1=O Amb22959758 [0,1,0,0,0,0|2,0,0]=3 1748 B12R1.371 COC(=O)CC1=NC=CNC1=O Amb25317862 [0,1,0,0,0,0|2,0,0]=3 1749 B12R1.371 COC(=O)CN1C=CC=CC1=O Amb18805575 [0,1,0,0,0,0|1,0,0]=2 1750 B12R1.371 COC(=O)CN1C=CC=CC1=S Amb24192816 [0,1,0,0,0,0|1,0,0]=2 1751 B12R1.371 COC(=O)CN1C=CC=NC1=O Amb18788735 [0,1,0,0,0,0|2,0,0]=3 1752 B12R1.371 COC(=O)CN1C=CN=CC1=O Amb25070285 [0,1,0,0,0,0|2,0,0]=3 1753 B12R1.371 COC(=O)CN1C=NC=CC1=O Amb25721309 [0,1,0,0,0,0|2,0,0]=3 1754 B12R1.371 COC(=O)CN1N=CC=CC1=O Amb18793019 [0,1,0,0,0,0|2,0,0]=3 1755 B12R1.371 COC(=O)C[n+]1ccccc1C Amb16224766 [0,1,0,0,0,0|1,0,0]=2 1756 B12R1.371 COC(=O)C[n+]1ccccc1Cl Amb25848252 [0,1,0,0,0,0|1,0,0]=2 1757 B12R1.371 COC(=O)Cc1[n]c[n]cc1Cl Amb22496246 [0,1,0,0,0,0|2,0,0]=3 1758 B12R1.371 COC(=O)Cc1[n]cccc1Br Amb22263925 [0,1,0,0,0,0|1,0,0]=2 1759 B12R1.371 COC(=O)Cc1[n]cccc1Cl Amb22750289 [0,1,0,0,0,0|1,0,0]=2 1760 B12R1.371 COC(=O)Cc1c[n]c[n]c1N Amb24586546 [0,1,0,0,0,0|2,0,0]=3 1761 B12R1.371 COC(=O)Cc1c[n]ccc1Br Amb25248822 [0,1,0,0,0,0|1,0,0]=2 1762 B12R1.371 COC(=O)Cc1c[n]ccc1Cl Amb25333659 [0,1,0,0,0,0|1,0,0]=2 1763 B12R1.371 COC(=O)Cc1c[n]ccc1N Amb24524861 [0,1,0,0,0,0|1,0,0]=2 1764 B12R1.371 COC(=O)Cc1cc[n]cc1Br Amb22586456 [0,1,0,0,0,0|1,0,0]=2 1765 B12R1.371 COC(=O)Cc1cc[n]cc1N Amb22371407 [0,1,0,0,0,0|1,0,0]=2 1766 B12R1.371 COC(=O)Cc1ccc[n]c1Cl Amb22396231 [0,1,0,0,0,0|1,0,0]=2 1767 B12R1.371 COC(=O)Cc1ccccc1I Amb22749395 [0,1,0,0,0,0|0,0,0]=1 1768 B12R1.371 COC(=O)Cc1ccccc1N Amb20623565 [0,1,0,0,0,0|0,0,0]=1 1769 B12R1.371 COC(=O)Cn1ncccc1=O Amb13949864 [0,1,0,0,0,0|2,0,0]=3 1770 B12R1.371 COC(=O)Nc1[n]cccc1Br Amb24454429 [0,1,0,0,0,0|2,0,0]=3 1771 B12R1.371 COC(=O)Nc1[n]cccc1Cl Amb25339981 [0,1,0,0,0,0|2,0,0]=3 1772 B12R1.371 COC(=O)Nc1[n]cccc1N Amb18646705 [0,1,0,0,0,0|2,0,0]=3 1773 B12R1.371 COC(=O)Nc1c[n]ccc1Cl Amb24525628 [0,1,0,0,0,0|2,0,0]=3 1774 B12R1.371 COC(=O)Nc1c[n]ccc1N Amb24443744 [0,1,0,0,0,0|2,0,0]=3 1775 B12R1.371 COC(=O)Nc1c[n]ccc1O Amb25847626 [0,1,0,0,0,0|2,0,0]=3 1776 B12R1.371 COC(=O)Nc1cc[n]cc1Br Amb24737452 [0,1,0,0,0,0|2,0,0]=3 1777 B12R1.371 COC(=O)Nc1cc[n]cc1I Amb25160208 [0,1,0,0,0,0|2,0,0]=3 1778 B12R1.371 COC(=O)Nc1cc[n]cc1N Amb18967350 [0,1,0,0,0,0|2,0,0]=3 1779 B12R1.371 COC(=O)Nc1cc[n]cc1O Amb25829808 [0,1,0,0,0,0|2,0,0]=3 1780 B12R1.371 COC(=O)Nc1ccc[n]c1O Amb24369945 [0,1,0,0,0,0|2,0,0]=3 1781 B12R1.371 COC(=O)Nc1cccc[n+]1C Amb2237836 [0,1,0,0,0,0|2,0,0]=3 1782 B12R1.371 COC(=O)Nc1ccccc1C Amb17846660 [0,1,0,0,0,0|1,0,0]=2 1783 B12R1.371 COC(=O)Nc1cccnc1Cl Amb17737912 [0,1,0,0,0,0|2,0,0]=3 1784 B12R1.371 COC(=O)Nc1ncccc1C Amb17739509 [0,1,0,0,0,0|2,0,0]=3 1785 B12R1.371 COC(=O)Oc1ccc[n]c1N Amb24594850 [0,1,0,0,0,0|2,0,0]=3 1786 B12R1.371 COC(=O)Oc1ccccc1N Amb25337714 [0,1,0,0,0,0|1,0,0]=2 1787 B12R1.371 COC(=O)\C=C\1/C=CC=CN1C Amb24099067 [0,1,0,0,0,0|1,0,1]=3 1788 B12R1.371 COC(C)C[n+]1ccccc1C Amb25663675 [0,1,0,0,0,0|2,0,1]=4 1789 B12R1.371 COC(C)Cc1c[n]ccc1N Amb25691169 [0,1,0,0,0,0|2,0,1]=4 1790 B12R1.371 COC(C)Cc1ccccc1O Amb18646540 [0,1,0,0,0,0|1,0,1]=3 1791 B12R1.371 COC(C)Oc1ccccc1O Amb25334885 [0,1,0,0,0,0|2,0,1]=4 1792 B12R1.371 CSC(=N)Nc1ccccc1Cl Amb24382706 [0,1,0,0,0,0|2,1,0]=4 1793 B12R1.371 C\C(\CC)=C/c1ccccc1O Amb25039084 [0,1,0,0,0,0|2,0,1]=4 1794 B12R1.371 C\C(\CC)=N/c1ccccc1O Amb25714315 [0,1,0,0,0,0|3,0,0]=4 1795 B12R1.371 C\C(\Cc1ccccc1Cl)=N\N Amb25106628 [0,1,0,0,0,0|3,0,0]=4 1796 B12R1.371 C\C(\Cc1ccccc1Cl)=N\O Amb25290972 [0,1,0,0,0,0|3,0,0]=4 1797 B12R1.371 C\C(\Cc1ccccc1F)=N\O Amb25252610 [0,1,0,0,0,0|3,0,0]=4 1798 B12R1.371 C\C(\Cc1ccccc1I)=N\N Amb24525431 [0,1,0,0,0,0|3,0,0]=4 1799 B12R1.371 C\C(\Cc1ccccc1O)=C/C Amb25130619 [0,1,0,0,0,0|2,0,0]=3 1800 B12R1.371 C\C(\Cc1ccccc1O)=C\C Amb24380771 [0,1,0,0,0,0|2,0,0]=3 1801 B12R1.371 C\C(\Cc1ccccc1O)=N\O Amb25211004 [0,1,0,0,0,0|3,0,0]=4 1802 B12R1.371 Cc1[n]c[n]cc1CC(=O)OC Amb24656554 [0,1,0,0,0,0|2,0,0]=3 1803 B12R1.371 Cc1[n]cccc1CC(=O)NO Amb24448842 [0,1,0,0,0,0|3,0,0]=4 1804 B12R1.371 Cc1[n]cccc1CC(=O)OC Amb25139680 [0,1,0,0,0,0|1,0,0]=2 1805 B12R1.371 Cc1[n]cccc1CN(C)OC Amb24576789 [0,1,0,0,0,0|3,0,0]=4 1806 B12R1.371 Cc1c[n]ccc1NC(=O)NC Amb24722218 [0,1,0,0,0,0|3,0,0]=4 1807 B12R1.371 Cc1c[n]ccc1NC(=S)OC Amb25288817 [0,1,0,0,0,0|2,1,0]=4 1808 B12R1.371 Cc1cc[n]cc1NC(=O)CC Amb24619695 [0,1,0,0,0,0|3,0,0]=4 1809 B12R1.371 Cc1ccc[n]c1CC(=O)OC Amb22750241 [0,1,0,0,0,0|1,0,0]=2 1810 B12R1.371 Cc1ccc[n]c1NC(=O)SC Amb24743263 [0,1,0,0,0,0|2,1,0]=4 1811 B12R1.371 Cc1ccc[n]c1NC(=S)OC Amb24451906 [0,1,0,0,0,0|2,1,0]=4 1812 B12R1.371 Cc1cccc[n+]1CC(=O)OC Amb25683216 [0,1,0,0,0,0|1,0,0]=2 1813 B12R1.371 Cc1ccccc1CC(=N)OC Amb18798191 [0,1,0,0,0,0|1,0,0]=2 1814 B12R1.371 Cc1ccccc1CC(=O)C#C Amb25209391 [0,1,0,0,0,0|1,0,1]=3 1815 B12R1.371 Cc1ccccc1CC(=O)C=C Amb25678802 [0,1,0,0,0,0|1,0,1]=3 1816 B12R1.371 Cc1ccccc1CC(=O)CN Amb18829246 [0,1,0,0,0,0|2,0,0]=3 1817 B12R1.371 Cc1ccccc1CC(=O)CO Amb18563611 [0,1,0,0,0,0|2,0,0]=3 1818 B12R1.371 Cc1ccccc1CC(C)NC Amb24271197 [0,1,0,0,0,0|2,0,1]=4 1819 B12R1.371 Cc1ccccc1CC(N)=NN Amb18788207 [0,1,0,0,0,0|3,0,0]=4 1820 B12R1.371 Cc1ccccc1C[C@@H](N)CC Amb24410901 [0,1,0,0,0,0|2,0,1]=4 1821 B12R1.371 Cc1ccccc1C[C@H](O)CC Amb25157887 [0,1,0,0,0,0|1,0,2]=4 1822 B12R1.371 Cc1ccccc1C\C(\C)=N/N Amb24458307 [0,1,0,0,0,0|3,0,0]=4 1823 B12R1.371 Cc1ccccc1N=C(S)SC Amb21953090 [0,1,0,0,0,0|1,2,0]=4 1824 B12R1.371 Cc1ccccc1NC(=N)NC Amb18798226 [0,1,0,0,0,0|3,0,0]=4 1825 B12R1.371 Cc1ccccc1NC(=O)C#C Amb24749543 [0,1,0,0,0,0|2,0,1]=4 1826 B12R1.371 Cc1ccccc1NC(=O)CN Amb21958991 [0,1,0,0,0,0|3,0,0]=4 1827 B12R1.371 Cc1ccccc1NC(=O)CN Amb22587979 [0,1,0,0,0,0|3,0,0]=4 1828 B12R1.371 Cc1ccccc1NC(=S)OC Amb25783782 [0,1,0,0,0,0|1,1,0]=3 1829 B12R1.371 Cc1ccccc1OC(=O)CN Amb19115306 [0,1,0,0,0,0|3,0,0]=4 1830 B12R1.371 Cc1ccccc1OC(=O)OC Amb24474007 [0,1,0,0,0,0|1,0,0]=2 1831 B12R1.371 Cc1ccccc1SC(=O)CCl Amb25054637 [0,1,0,0,0,0|3,0,0]=4 1832 B12R1.371 Cc1ccccc1SC(=S)NC Amb25035196 [0,1,0,0,0,0|2,1,0]=4 1833 B12R1.371 ClCC(=O)Nc1ccccc1Br Amb1201720 [0,1,0,0,0,0|3,0,0]=4 1834 B12R1.371 ClCC(=O)Nc1ccccc1C Amb1644314 [0,1,0,0,0,0|3,0,0]=4 1835 B12R1.371 ClCC(=O)Oc1ccccc1O Amb17594841 [0,1,0,0,0,0|3,0,0]=4 1836 B12R1.371 Fc1ccccc1NC(=O)CS Amb17683551 [0,1,0,0,0,0|3,0,0]=4 1837 B12R1.371 ICC(=O)Nc1ccccc1C Amb16207229 [0,1,0,0,0,0|3,0,0]=4 1838 B12R1.371 NC(Cc1ccccc1Cl)=NN Amb19045351 [0,1,0,0,0,0|3,0,0]=4 1839 B12R1.371 NCC(=O)Cc1[n]cccc1Br Amb25705674 [0,1,0,0,0,0|3,0,0]=4 1840 B12R1.371 NCC(=O)Cc1ccccc1Br Amb25667280 [0,1,0,0,0,0|2,0,0]=3 1841 B12R1.371 NCC(=O)Cc1ccccc1Cl Amb18909368 [0,1,0,0,0,0|2,0,0]=3 1842 B12R1.371 NCC(=O)Cc1ccccc1F Amb18827239 [0,1,0,0,0,0|2,0,0]=3 1843 B12R1.371 NCC(=O)Nc1ccccc1Br Amb1105100 [0,1,0,0,0,0|3,0,0]=4 1844 B12R1.371 NCC(=O)Nc1ccccc1Br Amb2277974 [0,1,0,0,0,0|3,0,0]=4 1845 B12R1.371 NCC(=O)Nc1ccccc1Cl Amb15740955 [0,1,0,0,0,0|3,0,0]=4 1846 B12R1.371 NCC(=O)Nc1ccccc1O Amb18646493 [0,1,0,0,0,0|3,0,0]=4 1847 B12R1.371 NCC(=O)Oc1ccccc1Br Amb17344446 [0,1,0,0,0,0|3,0,0]=4 1848 B12R1.371 NCC(=O)Oc1ccccc1C Amb17334634 [0,1,0,0,0,0|3,0,0]=4 1849 B12R1.371 NCC(=O)Oc1ccccc1Cl Amb17335803 [0,1,0,0,0,0|3,0,0]=4 1850 B12R1.371 NCC(=O)Oc1ccccc1F Amb17334752 [0,1,0,0,0,0|3,0,0]=4 1851 B12R1.371 NNC(=O)CN1C=CC=CC1=O Amb18028594 [0,1,0,0,0,0|3,0,0]=4 1852 B12R1.371 NNC(=O)Cc1ccc[n]c1Cl Amb25112883 [0,1,0,0,0,0|3,0,0]=4 1853 B12R1.371 NNC(=O)Cc1ccccc1Br Amb22484618 [0,1,0,0,0,0|2,0,0]=3 1854 B12R1.371 NNC(=O)Cc1ccccc1F Amb1126168 [0,1,0,0,0,0|2,0,0]=3 1855 B12R1.371 NNC(=O)Cc1ccccc1I Amb25334643 [0,1,0,0,0,0|2,0,0]=3 1856 B12R1.371 NNC(=O)Nc1ccccc1F Amb2413750 [0,1,0,0,0,0|3,0,0]=4 1857 B12R1.371 N\C(\Cc1ccccc1F)=N\N Amb18788566 [0,1,0,0,0,0|3,0,0]=4 1858 B12R1.371 Nc1[n]cccc1CC(=O)CN Amb25836617 [0,1,0,0,0,0|3,0,0]=4 1859 B12R1.371 Nc1[n]cccc1CC(=O)NN Amb24347801 [0,1,0,0,0,0|3,0,0]=4 1860 B12R1.371 Nc1ccccc1CC(=O)NN Amb25072774 [0,1,0,0,0,0|2,0,0]=3 1861 B12R1.371 Nc1ccccc1NC(=O)CN Amb18251735 [0,1,0,0,0,0|3,0,0]=4 1862 B12R1.371 Nc1ccccc1NC(=O)CN Amb25163855 [0,1,0,0,0,0|3,0,0]=4 1863 B12R1.371 O=C(CBr)Cc1ccccc1I Amb25352153 [0,1,0,0,0,0|2,0,0]=3 1864 B12R1.371 O=C(CBr)Nc1ccccc1Br Amb19980971 [0,1,0,0,0,0|3,0,0]=4 1865 B12R1.371 O=C(CBr)Nc1ccccc1I Amb24353297 [0,1,0,0,0,0|3,0,0]=4 1866 B12R1.371 O=C(CCl)Cc1ccccc1I Amb25253621 [0,1,0,0,0,0|2,0,0]=3 1867 B12R1.371 O=C(CCl)Nc1ccccc1S Amb25149933 [0,1,0,0,0,0|3,0,0]=4 1868 B12R1.371 O=C(CCl)Oc1ccccc1Cl Amb24121334 [0,1,0,0,0,0|3,0,0]=4 1869 B12R1.371 O=C(CCl)Oc1ccccc1F Amb23442007 [0,1,0,0,0,0|3,0,0]=4 1870 B12R1.371 O=C(CF)Cc1ccccc1Cl Amb23454831 [0,1,0,0,0,0|2,0,0]=3 1871 B12R1.371 O=C(CF)Nc1ccccc1Cl Amb24532736 [0,1,0,0,0,0|3,0,0]=4 1872 B12R1.371 O=C(Cc1ccccc1Cl)CBr Amb25312032 [0,1,0,0,0,0|2,0,0]=3 1873 B12R1.371 OCC(=O)Cc1ccccc1Cl Amb18564303 [0,1,0,0,0,0|2,0,0]=3 1874 B12R1.371 OCC(=O)Cc1ccccc1F Amb18805788 [0,1,0,0,0,0|2,0,0]=3 1875 B12R1.371 OCC(=O)Nc1ccccc1Br Amb1109988 [0,1,0,0,0,0|3,0,0]=4 1876 B12R1.371 OCC(=O)Nc1ccccc1C Amb1110662 [0,1,0,0,0,0|3,0,0]=4 1877 B12R1.371 OCC(=O)Nc1ccccc1Cl Amb1111147 [0,1,0,0,0,0|3,0,0]=4 1878 B12R1.371 OCC(=O)Nc1ccccc1F Amb1109775 [0,1,0,0,0,0|3,0,0]=4 1879 B12R1.371 OCC(=O)Oc1ccccc1Cl Amb25072212 [0,1,0,0,0,0|3,0,0]=4 1880 B12R1.371 OCC(=O)Oc1ccccc1F Amb25122488 [0,1,0,0,0,0|3,0,0]=4 1881 B12R1.371 OCC(=O)Oc1ccccc1I Amb25056604 [0,1,0,0,0,0|3,0,0]=4 1882 B12R1.371 O\N=C(\Cc1ccccc1C)/N Amb1118586 [0,1,0,0,0,0|3,0,0]=4 1883 B12R1.371 O\N=C(\Cc1ccccc1Cl)/N Amb10205341 [0,1,0,0,0,0|3,0,0]=4 1884 B12R1.371 Oc1ccccc1CC(=O)CCl Amb25376294 [0,1,0,0,0,0|2,0,0]=3 1885 B12R1.371 Oc1ccccc1NC(=O)CF Amb25835152 [0,1,0,0,0,0|3,0,0]=4 1886 B12R1.371 Oc1ccccc1NC(=O)CS Amb24724665 [0,1,0,0,0,0|3,0,0]=4 1887 B12R1.371 Oc1ccccc1OC(=O)NO Amb24631630 [0,1,0,0,0,0|3,0,0]=4 1888 B12R1.371 SCC(=O)Nc1ccccc1F Amb1210638 [0,1,0,0,0,0|3,0,0]=4 1889 B10R0.74 C\C=C\C=C\C=C\C(=O)CC Amb24766965 [0,0,1,0,0,0|1,0,2]=4 1890 B12R2.18 Brc1[nH]c2c(c1C)cccc2 Amb17595638 [0,0,0,1,0,0|3,0,0]=4 1891 B12R2.18 C=C1C(=O)Nc2ccccc12 Amb17779246 [0,0,0,1,0,0|2,0,1]=4 1892 B12R2.18 C=C1Cc2ccccc2C1=O Amb18062660 [0,0,0,1,0,0|3,0,0]=4 1893 B12R2.18 C=C1Cc2ccccc2C1O Amb25045696 [0,0,0,1,0,0|3,0,0]=4 1894 B12R2.18 CC1C(=O)Cc2cc[n]cc21 Amb24456658 [0,0,0,1,0,0|2,0,0]=3 1895 B12R2.18 CC1C(=O)Cc2ccccc21 Amb20622460 [0,0,0,1,0,0|1,0,0]=2 1896 B12R2.18 CC1C(=O)N=C2C=CC=CN21 Amb24102443 [0,0,0,1,0,0|3,0,0]=4 1897 B12R2.18 CC1C(=O)Nc2ccc[n]c21 Amb24330952 [0,0,0,1,0,0|3,0,0]=4 1898 B12R2.18 CC1C(=O)Oc2ccccc21 Amb25150504 [0,0,0,1,0,0|2,0,0]=3 1899 B12R2.18 CC1C(=O)Sc2ccccc21 Amb24519014 [0,0,0,1,0,0|2,0,0]=3 1900 B12R2.18 CC1C(=S)Nc2ccccc21 Amb23571295 [0,0,0,1,0,0|2,1,0]=4 1901 B12R2.18 CC1C(N)Cc2ccccc21 Amb18124847 [0,0,0,1,0,0|2,0,1]=4 1902 B12R2.18 CC1C(O)Cc2ccccc21 Amb20622729 [0,0,0,1,0,0|1,0,2]=4 1903 B12R2.18 CC1c2ccccc2CN1N Amb25255493 [0,0,0,1,0,0|3,0,0]=4 1904 B12R2.18 CC=1C(=O)CN2C=CC=CC21 Amb25151212 [0,0,0,1,0,0|2,0,0]=3 1905 B12R2.18 CC=1C(=O)OC2=COC=CC21 Amb19133147 [0,0,0,1,0,0|3,0,0]=4 1906 B12R2.18 CC=1c2ccccc2CC1C Amb21948330 [0,0,0,1,0,0|2,0,0]=3 1907 B12R2.18 CN1C(=C)Oc2ccccc12 Amb24102381 [0,0,0,1,0,0|3,0,0]=4 1908 B12R2.18 CN1C(=C)Sc2ccccc12 Amb17842907 [0,0,0,1,0,0|3,0,0]=4 1909 B12R2.18 CN1C(=N)Sc2ccccc12 Amb19202293 [0,0,0,1,0,0|3,0,0]=4 1910 B12R2.18 CN1C(=O)Cc2[n]c[n]cc12 Amb25376365 [0,0,0,1,0,0|3,0,0]=4 1911 B12R2.18 CN1C(=O)Cc2c[n]c[n]c12 Amb24488482 [0,0,0,1,0,0|3,0,0]=4 1912 B12R2.18 CN1C(=O)Cc2cc[n]cc12 Amb22491400 [0,0,0,1,0,0|2,0,0]=3 1913 B12R2.18 CN1C(=O)Cc2ccc[n]c12 Amb24334650 [0,0,0,1,0,0|2,0,0]=3 1914 B12R2.18 CN1C(=O)Nc2[n]cccc12 Amb20661045 [0,0,0,1,0,0|3,0,0]=4 1915 B12R2.18 CN1C(=O)Nc2c[n]ccc12 Amb19148095 [0,0,0,1,0,0|3,0,0]=4 1916 B12R2.18 CN1C(=O)Nc2ccc[n]c12 Amb21963725 [0,0,0,1,0,0|3,0,0]=4 1917 B12R2.18 CN1C(=O)Nc2ccccc12 Amb18537193 [0,0,0,1,0,0|2,0,0]=3 1918 B12R2.18 CN1C(=O)Oc2ccc[n]c12 Amb18407346 [0,0,0,1,0,0|3,0,0]=4 1919 B12R2.18 CN1C(=O)Oc2ccccc12 Amb18043105 [0,0,0,1,0,0|2,0,0]=3 1920 B12R2.18 CN1C(=O)Sc2ccccc12 Amb19654015 [0,0,0,1,0,0|2,0,0]=3 1921 B12R2.18 CN1C(=S)Nc2ccccc12 Amb19815991 [0,0,0,1,0,0|2,1,0]=4 1922 B12R2.18 CN1C(=S)Oc2ccccc12 Amb19664828 [0,0,0,1,0,0|2,1,0]=4 1923 B12R2.18 CN1C(=S)Sc2ccccc12 Amb19664825 [0,0,0,1,0,0|2,1,0]=4 1924 B12R2.18 CN1C2C=CC=CN2CC1=O Amb22356023 [0,0,0,1,0,0|2,0,1]=4 1925 B12R2.18 CN1[C@H](C)Cc2ccccc12 Amb24068204 [0,0,0,1,0,0|2,0,1]=4 1926 B12R2.18 C[C@@H]1[C@@H](O)Cc2ccccc21 Amb25176418 [0,0,0,1,0,0|1,0,2]=4 1927 B12R2.18 C[C@@H]1[C@H](O)Cc2ccccc21 Amb24546023 [0,0,0,1,0,0|1,0,2]=4 1928 B12R2.18 C[C@H]1[C@@H](N)Cc2ccccc21 Amb24562844 [0,0,0,1,0,0|2,0,1]=4 1929 B12R2.18 C[n+]1c(C)oc2c1cccc2 Amb10573332 [0,0,0,1,0,0|3,0,0]=4 1930 B12R2.18 C[n+]1c(C)sc2c1cccc2 Amb10601727 [0,0,0,1,0,0|3,0,0]=4 1931 B12R2.18 C[n+]1c(N)[s]c2ccccc12 Amb19926121 [0,0,0,1,0,0|3,0,0]=4 1932 B12R2.18 C[n+]1c(N)sc2c1cccc2 Amb10552979 [0,0,0,1,0,0|3,0,0]=4 1933 B12R2.18 C[n]1c(Br)cc2ccccc12 Amb22232574 [0,0,0,1,0,0|2,0,1]=4 1934 B12R2.18 C[n]1c(I)cc2ccccc12 Amb24067548 [0,0,0,1,0,0|2,0,1]=4 1935 B12R2.18 C[n]1c(N)cc2ccccc12 Amb18644284 [0,0,0,1,0,0|2,0,1]=4 1936 B12R2.18 C[n]1c(N)cc2ccccc12 Amb19944548 [0,0,0,1,0,0|2,0,1]=4 1937 B12R2.18 C[n]1c([SeH])[n]c2ccccc12 Amb20246247 [0,0,0,1,0,0|2,1,0]=4 1938 B12R2.18 Cc1[nH]c2c(c1C)cccc2 Amb1205252 [0,0,0,1,0,0|3,0,0]=4 1939 B12R2.18 Cc1[nH]c2ccccc2[n+]1C Amb24434872 [0,0,0,1,0,0|3,0,0]=4 1940 B12R2.18 Cc1c(Br)[s]c2ccccc21 Amb22896399 [0,0,0,1,0,0|3,0,0]=4 1941 B12R2.18 Cc1c(Br)oc2ccccc21 Amb24451202 [0,0,0,1,0,0|3,0,0]=4 1942 B12R2.18 Cc1c(Cl)[nH]c2ccccc21 Amb23441609 [0,0,0,1,0,0|3,0,0]=4 1943 B12R2.18 Cc1c(Cl)[s]c2ccccc21 Amb23440525 [0,0,0,1,0,0|3,0,0]=4 1944 B12R2.18 Cc1c(F)[nH]c2ccccc21 Amb24679317 [0,0,0,1,0,0|3,0,0]=4 1945 B12R2.18 Cc1c(F)oc2ccccc21 Amb24084180 [0,0,0,1,0,0|3,0,0]=4 1946 B12R2.18 Cc1c(I)[nH]c2ccccc21 Amb24067551 [0,0,0,1,0,0|3,0,0]=4 1947 B12R2.18 Cc1c(N)[s]c2ccccc21 Amb21932910 [0,0,0,1,0,0|3,0,0]=4 1948 B12R2.18 Cc1c(N)oc2ccccc21 Amb18202306 [0,0,0,1,0,0|3,0,0]=4 1949 B12R2.18 Cc1c(O)[nH]c2ccccc21 Amb25709196 [0,0,0,1,0,0|2,0,1]=4 1950 B12R2.18 Cc1c(O)[s]c2ccccc21 Amb24574173 [0,0,0,1,0,0|2,0,1]=4 1951 B12R2.18 Cc1c2ccccc2[s]c1C Amb22057362 [0,0,0,1,0,0|3,0,0]=4 1952 B12R2.18 Cn1c(=O)[nH]c2c1cccc2 Amb1159144 [0,0,0,1,0,0|2,0,0]=3 1953 B12R2.18 Cn1c(=O)oc2c1cccc2 Amb1905664 [0,0,0,1,0,0|2,0,0]=3 1954 B12R2.18 Cn1c(C)cc2c1cccc2 Amb1934988 [0,0,0,1,0,0|2,0,1]=4 1955 B12R2.18 Cn1c(N)nc2c1cccc2 Amb10561226 [0,0,0,1,0,0|3,0,0]=4 1956 B12R2.18 Cn1c(S)nc2c1cccc2 Amb1104434 [0,0,0,1,0,0|2,1,0]=4 1957 B12R2.18 NN1C(=O)Nc2ccccc12 Amb18124952 [0,0,0,1,0,0|3,0,0]=4 1958 B12R2.18 NN1C(=O)Oc2ccccc12 Amb18644412 [0,0,0,1,0,0|3,0,0]=4 1959 B12R2.18 N[C@@H]1C(=O)Nc2ccccc21 Amb24554831 [0,0,0,1,0,0|3,0,0]=4 1960 B12R2.18 N[C@@H]1C(=O)Oc2ccccc21 Amb25324246 [0,0,0,1,0,0|3,0,0]=4 1961 B12R2.18 O=C1Cc2c(N1C)cccc2 Amb1398903 [0,0,0,1,0,0|1,0,0]=2 1962 B12R2.18 O=C1Cc2c(N1N)cccc2 Amb10560115 [0,0,0,1,0,0|2,0,0]=3 1963 B12R2.18 O=C1Cc2ccccc2C1Br Amb21987890 [0,0,0,1,0,0|2,0,0]=3 1964 B12R2.18 O=C1Cc2ccccc2C1F Amb25142685 [0,0,0,1,0,0|2,0,0]=3 1965 B12R2.18 O=C1Cc2ccccc2C1[Na] Amb24605330 [0,0,0,1,0,0|2,0,0]=3 1966 B12R2.18 O=C1Nc2c(C1Br)cccc2 Amb2228105 [0,0,0,1,0,0|3,0,0]=4 1967 B12R2.18 O=C1Nc2c(C1C)cccn2 Amb17617196 [0,0,0,1,0,0|3,0,0]=4 1968 B12R2.18 O=C1Nc2c(C1N)cccc2 Amb1052761 [0,0,0,1,0,0|3,0,0]=4 1969 B12R2.18 O=C1Nc2c(C1N)cccc2 Amb1154822 [0,0,0,1,0,0|3,0,0]=4 1970 B12R2.18 O=C1Oc2ccccc2C1Cl Amb25124107 [0,0,0,1,0,0|3,0,0]=4 1971 B12R2.18 OC1C(=O)Oc2ccccc21 Amb24102222 [0,0,0,1,0,0|3,0,0]=4 1972 B12R2.18 ON1C(=O)Cc2ccc[n]c12 Amb24082462 [0,0,0,1,0,0|3,0,0]=4 1973 B12R2.18 ON1C(=O)Cc2ccccc12 Amb17940424 [0,0,0,1,0,0|2,0,0]=3 1974 B12R2.18 O[C@H]1C(=O)Nc2ccccc21 Amb25152859 [0,0,0,1,0,0|3,0,0]=4 1975 B12R2.23 CC1NCC1c2ccccc2 Amb25842786 [0,0,0,1,0,0|2,0,1]=4 1976 B12R2.23 C[C@@H]1NC[C@H]1c2ccccc2 Amb24618159 [0,0,0,1,0,0|2,0,1]=4 1977 B12R2.23 NC1CCC1c2ccccc2 Amb19335290 [0,0,0,1,0,0|2,0,1]=4 1978 B12R2.23 NC1CCC1c2ccccc2 Amb24120632 [0,0,0,1,0,0|2,0,1]=4 1979 B12R2.23 N[C@@H]1CC[C@H]1c2ccccc2 Amb25174969 [0,0,0,1,0,0|2,0,1]=4 1980 B12R2.23 O=C1CCC1c2ccc[n]c2 Amb24472315 [0,0,0,1,0,0|2,0,0]=3 1981 B12R2.23 O=C1CCC1c2ccccc2 Amb19515483 [0,0,0,1,0,0|1,0,0]=2 1982 B12R2.23 O=C1CCN1c2ccccc2 Amb16191926 [0,0,0,1,0,0|2,0,0]=3 1983 B12R2.23 O=C1CN=C1c2ccccc2 Amb25151517 [0,0,0,1,0,0|2,0,1]=4 1984 B12R2.23 O=C1CNC1c2ccccc2 Amb24449898 [0,0,0,1,0,0|2,0,0]=3 1985 B12R2.23 O=C1COC1c2ccccc2 Amb23456091 [0,0,0,1,0,0|2,0,0]=3 1986 B12R2.23 OC1CCC1c2ccccc2 Amb19374437 [0,0,0,1,0,0|1,0,2]=4 1987 B12R2.23 O[C@@H]1CC[C@H]1c2ccccc2 Amb24620488 [0,0,0,1,0,0|1,0,2]=4 1988 B12R2.23 S=C1CCN1c2ccccc2 Amb24709242 [0,0,0,1,0,0|2,1,0]=4 1989 B12R2.24 BrC1CCc2c(C1)cccc2 Amb13952699 [0,0,0,1,0,0|2,0,1]=4 1990 B12R2.24 BrC=1CCc2ccccc2C1 Amb25726468 [0,0,0,1,0,0|2,0,1]=4 1991 B12R2.24 C=C1Cc2ccccc2CC1 Amb25151359 [0,0,0,1,0,0|2,0,0]=3 1992 B12R2.24 C=C1Cc2ccccc2OC1 Amb25087646 [0,0,0,1,0,0|3,0,0]=4 1993 B12R2.24 CC1=Nc2c(CC1)cccc2 Amb10553816 [0,0,0,1,0,0|3,0,0]=4 1994 B12R2.24 CC1Cc2ccccc2CN1 Amb22755434 [0,0,0,1,0,0|2,0,1]=4 1995 B12R2.24 CC=1Cc2ccccc2ON1 Amb25077210 [0,0,0,1,0,0|3,0,0]=4 1996 B12R2.24 CN1CCc2c(C1)cccc2 Amb2581727 [0,0,0,1,0,0|3,0,0]=4 1997 B12R2.24 CN1Cc2ccccc2CC1 Amb22001820 [0,0,0,1,0,0|3,0,0]=4 1998 B12R2.24 C[C@@H]1Cc2ccccc2CN1 Amb22751934 [0,0,0,1,0,0|2,0,1]=4 1999 B12R2.24 C[C@H]1Cc2ccccc2CN1 Amb24087372 [0,0,0,1,0,0|2,0,1]=4 2000 B12R2.24 ClC1=CCc2c(N1)cccc2 Amb15691607 [0,0,0,1,0,0|3,0,0]=4 2001 B12R2.24 ClC1CCc2ccccc2C1 Amb17672772 [0,0,0,1,0,0|2,0,1]=4 2002 B12R2.24 ClC1Cc2ccccc2CO1 Amb25152704 [0,0,0,1,0,0|1,0,1]=3 2003 B12R2.24 ClC=1NCc2ccccc2N1 Amb24728260 [0,0,0,1,0,0|3,0,0]=4 2004 B12R2.24 IC1Cc2ccccc2CO1 Amb25811321 [0,0,0,1,0,0|1,0,1]=3 2005 B12R2.24 NC1=Nc2c(CC1)cccc2 Amb2373583 [0,0,0,1,0,0|3,0,0]=4 2006 B12R2.24 NC1CCc2c(C1)cccc2 Amb13952050 [0,0,0,1,0,0|2,0,1]=4 2007 B12R2.24 NC1CCc2c(C1)cccc2 Amb2383251 [0,0,0,1,0,0|2,0,1]=4 2008 B12R2.24 NC1Cc2ccccc2CO1 Amb24365192 [0,0,0,1,0,0|1,0,1]=3 2009 B12R2.24 NC=1NCc2ccccc2N1 Amb18644339 [0,0,0,1,0,0|3,0,0]=4 2010 B12R2.24 NN1CCc2c(C1)cccc2 Amb17232046 [0,0,0,1,0,0|3,0,0]=4 2011 B12R2.24 NN1Cc2ccccc2CC1 Amb22495461 [0,0,0,1,0,0|3,0,0]=4 2012 B12R2.24 N[C@H]1Cc2ccccc2CC1 Amb25113422 [0,0,0,1,0,0|2,0,1]=4 2013 B12R2.24 O=C1C=C2C=CC=CC2=CN1 Amb19958596 [0,0,0,1,0,0|1,0,2]=4 2014 B12R2.24 O=C1C=C2C=CC=CC2=CO1 Amb25242585 [0,0,0,1,0,0|0,0,2]=3 2015 B12R2.24 O=C1C=C2C=CC=CC2=NN1 Amb21864850 [0,0,0,1,0,0|2,0,1]=4 2016 B12R2.24 O=C1C=Cc2ccccc2N1 Amb18546039 [0,0,0,1,0,0|2,0,1]=4 2017 B12R2.24 O=C1C=Cc2ccccc2O1 Amb18511466 [0,0,0,1,0,0|2,0,1]=4 2018 B12R2.24 O=C1C=Cc2ccccc2S1 Amb20663396 [0,0,0,1,0,0|2,0,1]=4 2019 B12R2.24 O=C1C=Cc2ccccc2[N-]1 Amb21940629 [0,0,0,1,0,0|2,0,1]=4 2020 B12R2.24 O=C1C=Nc2ccccc2N1 Amb18372452 [0,0,0,1,0,0|3,0,0]=4 2021 B12R2.24 O=C1CCN2C=CC=CC2=N1 Amb17749056 [0,0,0,1,0,0|3,0,0]=4 2022 B12R2.24 O=C1CCc2[n]cccc2N1 Amb25095800 [0,0,0,1,0,0|3,0,0]=4 2023 B12R2.24 O=C1CCc2c(C1)cccc2 Amb2383557 [0,0,0,1,0,0|1,0,0]=2 2024 B12R2.24 O=C1CCc2c[n]ccc2N1 Amb22899719 [0,0,0,1,0,0|3,0,0]=4 2025 B12R2.24 O=C1CCc2ccc[n]c2N1 Amb21960778 [0,0,0,1,0,0|3,0,0]=4 2026 B12R2.24 O=C1CN2C=CC=CC2=NC1 Amb25301630 [0,0,0,1,0,0|3,0,0]=4 2027 B12R2.24 O=C1CN2C=CC=CC2=NN1 Amb18537629 [0,0,0,1,0,0|3,0,0]=4 2028 B12R2.24 O=C1CNc2ccccc2O1 Amb22166855 [0,0,0,1,0,0|3,0,0]=4 2029 B12R2.24 O=C1COc2c(C1)cccc2 Amb15692703 [0,0,0,1,0,0|2,0,0]=3 2030 B12R2.24 O=C1COc2c(N1)cccc2 Amb1011836 [0,0,0,1,0,0|3,0,0]=4 2031 B12R2.24 O=C1CSc2c(N1)cccc2 Amb1007458 [0,0,0,1,0,0|3,0,0]=4 2032 B12R2.24 O=C1C[n+]2ccccc2CN1 Amb24342049 [0,0,0,1,0,0|2,0,0]=3 2033 B12R2.24 O=C1Cc2[n]c[n]cc2CC1 Amb24554237 [0,0,0,1,0,0|3,0,0]=4 2034 B12R2.24 O=C1Cc2[n]cc[n]c2CN1 Amb24414115 [0,0,0,1,0,0|3,0,0]=4 2035 B12R2.24 O=C1Cc2[n]cccc2CC1 Amb22292032 [0,0,0,1,0,0|2,0,0]=3 2036 B12R2.24 O=C1Cc2c[n]c[n]c2CC1 Amb22494044 [0,0,0,1,0,0|3,0,0]=4 2037 B12R2.24 O=C1Cc2c[n]ccc2CC1 Amb24093783 [0,0,0,1,0,0|2,0,0]=3 2038 B12R2.24 O=C1Cc2cc[n]cc2CN1 Amb25760054 [0,0,0,1,0,0|2,0,0]=3 2039 B12R2.24 O=C1Cc2ccc[n]c2CN1 Amb24513882 [0,0,0,1,0,0|2,0,0]=3 2040 B12R2.24 O=C1Cc2ccc[n]c2CO1 Amb22494099 [0,0,0,1,0,0|1,0,0]=2 2041 B12R2.24 O=C1Cc2ccccc2CO1 Amb17750259 [0,0,0,1,0,0|0,0,0]=1 2042 B12R2.24 O=C1Cc2ccccc2N=C1 Amb24078566 [0,0,0,1,0,0|2,0,0]=3 2043 B12R2.24 O=C1Cc2ccccc2NC1 Amb18202302 [0,0,0,1,0,0|2,0,0]=3 2044 B12R2.24 O=C1Cc2ccccc2NN1 Amb24583135 [0,0,0,1,0,0|2,0,0]=3 2045 B12R2.24 O=C1Cc2ccccc2SC1 Amb22231635 [0,0,0,1,0,0|2,0,0]=3 2046 B12R2.24 O=C1N=Cc2ccccc2O1 Amb22054765 [0,0,0,1,0,0|2,0,1]=4 2047 B12R2.24 O=C1NCC2=CC=COC2=N1 Amb24085483 [0,0,0,1,0,0|3,0,0]=4 2048 B12R2.24 O=C1NCc2[n]cccc2N1 Amb24085488 [0,0,0,1,0,0|3,0,0]=4 2049 B12R2.24 O=C1NCc2c(N1)cccc2 Amb10603974 [0,0,0,1,0,0|2,0,0]=3 2050 B12R2.24 O=C1NCc2ccccc2S1 Amb24713217 [0,0,0,1,0,0|2,0,0]=3 2051 B12R2.24 O=C1Nc2[n]cccc2CO1 Amb24634652 [0,0,0,1,0,0|2,0,0]=3 2052 B12R2.24 O=C1Nc2ccccc2C=N1 Amb20653982 [0,0,0,1,0,0|2,0,1]=4 2053 B12R2.24 O=C1Nc2ccccc2C=N1 Amb22752711 [0,0,0,1,0,0|2,0,1]=4 2054 B12R2.24 O=C1Nc2ccccc2CO1 Amb19516356 [0,0,0,1,0,0|1,0,0]=2 2055 B12R2.24 O=C1Nc2ccccc2CS1 Amb24509578 [0,0,0,1,0,0|1,1,0]=3 2056 B12R2.24 O=C1OCc2ccccc2O1 Amb24536007 [0,0,0,1,0,0|1,0,0]=2 2057 B12R2.24 O=S1Cc2[n]cc[n]c2CO1 Amb25151425 [0,0,0,1,0,0|3,0,0]=4 2058 B12R2.24 O=c1[nH]nc2c(c1)cccc2 Amb16204922 [0,0,0,1,0,0|2,0,1]=4 2059 B12R2.24 O=c1ccc2c(o1)cccc2 Amb1802468 [0,0,0,1,0,0|2,0,1]=4 2060 B12R2.24 O=c1cnc2c([nH]1)cccc2 Amb1352017 [0,0,0,1,0,0|3,0,0]=4 2061 B12R2.24 O=c1ncc2c([nH]1)cccc2 Amb2569659 [0,0,0,1,0,0|2,0,1]=4 2062 B12R2.24 OC1OCc2c(C1)cccc2 Amb17593730 [0,0,0,1,0,0|0,0,2]=3 2063 B12R2.24 ON1Cc2ccccc2CC1 Amb24533074 [0,0,0,1,0,0|2,0,1]=4 2064 B12R2.24 O[C@@H]1Cc2ccccc2CC1 Amb25149682 [0,0,0,1,0,0|1,0,2]=4 2065 B12R2.24 O[C@H]1Cc2ccccc2CC1 Amb25043599 [0,0,0,1,0,0|1,0,2]=4 2066 B12R2.24 S=C1CCc2ccccc2N1 Amb25700408 [0,0,0,1,0,0|2,1,0]=4 2067 B12R2.24 S=C1CCc2ccccc2O1 Amb24104591 [0,0,0,1,0,0|2,1,0]=4 2068 B12R2.24 S=C1Cc2ccccc2CN1 Amb24538124 [0,0,0,1,0,0|1,1,0]=3 2069 B12R2.24 S=C1NCc2c(S1)cccc2 Amb10562262 [0,0,0,1,0,0|2,1,0]=4 2070 B12R2.24 S=C1Nc2ccccc2CS1 Amb19221474 [0,0,0,1,0,0|1,2,0]=4 2071 B12R2.24 SC1CCc2ccccc2C1 Amb17672773 [0,0,0,1,0,0|1,1,1]=4 2072 B12R2.27 CNC1CC1c2ccccc2 Amb18957298 [0,0,0,1,0,0|2,0,1]=4 2073 B12R2.27 CNC1CC1c2ccccc2 Amb20630184 [0,0,0,1,0,0|2,0,1]=4 2074 B12R2.27 COC1OC1c2ccccc2 Amb24613179 [0,0,0,1,0,0|0,0,2]=3 2075 B12R2.27 CSC1CC1c2ccccc2 Amb25086341 [0,0,0,1,0,0|1,1,1]=4 2076 B12R2.32 CCN1Cc2ccccc2C1 Amb21870754 [0,0,0,1,0,0|3,0,0]=4 2077 B12R2.32 CCc1cc2c([nH]1)cccc2 Amb10553855 [0,0,0,1,0,0|2,0,1]=4 2078 B12R2.32 CCc1cc2c(s1)cccc2 Amb10568584 [0,0,0,1,0,0|1,1,1]=4 2079 B12R2.32 CCc1nc2c(s1)cccc2 Amb10573484 [0,0,0,1,0,0|2,1,0]=4 2080 B12R2.32 CNC1Cc2ccccc2C1 Amb21955693 [0,0,0,1,0,0|2,0,1]=4 2081 B12R2.32 CNc1[nH]c2ccccc2[n]1 Amb19516238 [0,0,0,1,0,0|3,0,0]=4 2082 B12R2.32 CNc1cc2ccccc2[nH]1 Amb18831442 [0,0,0,1,0,0|2,0,1]=4 2083 B12R2.32 CNc1nc2c([nH]1)cccc2 Amb1145755 [0,0,0,1,0,0|3,0,0]=4 2084 B12R2.32 CNc1nc2c(o1)cccc2 Amb1162733 [0,0,0,1,0,0|2,0,1]=4 2085 B12R2.32 CNc1nc2c(s1)cccc2 Amb219907 [0,0,0,1,0,0|2,1,0]=4 2086 B12R2.32 COC1Cc2ccccc2O1 Amb24084536 [0,0,0,1,0,0|0,0,2]=3 2087 B12R2.32 COC1Nc2ccccc2S1 Amb24084534 [0,0,0,1,0,0|1,1,1]=4 2088 B12R2.32 COC1Oc2ccccc2O1 Amb24753207 [0,0,0,1,0,0|1,0,2]=4 2089 B12R2.32 COC1Sc2ccccc2S1 Amb24449932 [0,0,0,1,0,0|1,1,1]=4 2090 B12R2.32 COP1Oc2ccccc2O1 Amb24484500 [0,0,0,1,0,0|2,0,1]=4 2091 B12R2.32 COc1[nH]c2[n]cccc2[n]1 Amb25859542 [0,0,0,1,0,0|3,0,0]=4 2092 B12R2.32 COc1[nH]c2cc[n]cc2[n]1 Amb24585814 [0,0,0,1,0,0|3,0,0]=4 2093 B12R2.32 COc1[n]c2[n]cccc2[s]1 Amb23403195 [0,0,0,1,0,0|2,1,0]=4 2094 B12R2.32 COc1[n]c2ccc[n]c2[s]1 Amb21857087 [0,0,0,1,0,0|2,1,0]=4 2095 B12R2.32 COc1cc2c([nH]1)cccc2 Amb15690762 [0,0,0,1,0,0|1,0,1]=3 2096 B12R2.32 COc1cc2ccc[n]c2[nH]1 Amb25774284 [0,0,0,1,0,0|2,0,1]=4 2097 B12R2.32 COc1cc2cccc[n]2[n]1 Amb25726440 [0,0,0,1,0,0|2,0,1]=4 2098 B12R2.32 COc1cc2cccc[n]2c1 Amb24697003 [0,0,0,1,0,0|2,0,1]=4 2099 B12R2.32 COc1cc2ccccc2[s]1 Amb25130500 [0,0,0,1,0,0|0,1,1]=3 2100 B12R2.32 CSC1Cc2ccccc2C1 Amb25712718 [0,0,0,1,0,0|1,1,1]=4 2101 B12R2.32 CSC=1Cc2ccccc2N1 Amb24474025 [0,0,0,1,0,0|1,1,0]=3 2102 B12R2.32 CSc1[nH+]c2ccccc2s1 Amb17701533 [0,0,0,1,0,0|1,2,0]=4 2103 B12R2.32 CSc1[nH]c2ccccc2[n]1 Amb18363958 [0,0,0,1,0,0|2,1,0]=4 2104 B12R2.32 CSc1[nH]c2ccccc2[n]1 Amb22343423 [0,0,0,1,0,0|2,1,0]=4 2105 B12R2.32 CSc1cc2ccccc2[nH]1 Amb25678622 [0,0,0,1,0,0|1,1,1]=4 2106 B12R2.32 CSc1cc2ccccc2o1 Amb24101348 [0,0,0,1,0,0|0,1,2]=4 2107 B12R2.32 C[Se]c1[nH]c2ccccc2[n]1 Amb22345831 [0,0,0,1,0,0|2,1,0]=4 2108 B12R2.32 C\C=C/1\Nc2ccccc2S1 Amb25351957 [0,0,0,1,0,0|2,1,0]=4 2109 B12R2.32 ClCC=1Cc2ccccc2C1 Amb24359917 [0,0,0,1,0,0|3,0,0]=4 2110 B12R2.32 N#CC=1Cc2ccccc2C1 Amb18643732 [0,0,0,1,0,0|3,0,0]=4 2111 B12R2.32 NCC=1Cc2ccccc2C1 Amb25178878 [0,0,0,1,0,0|3,0,0]=4 2112 B12R2.32 NN=C1Cc2ccccc2C1 Amb25279861 [0,0,0,1,0,0|3,0,0]=4 2113 B12R2.32 NNC=1Cc2ccccc2N1 Amb18644335 [0,0,0,1,0,0|3,0,0]=4 2114 B12R2.32 NOc1[n]c2ccccc2[s]1 Amb24101178 [0,0,0,1,0,0|2,1,0]=4 2115 B12R2.32 NOc1cc2ccccc2o1 Amb24621929 [0,0,0,1,0,0|1,0,2]=4 2116 B12R2.32 O=CC=1Cc2ccccc2C1 Amb18644150 [0,0,0,1,0,0|3,0,0]=4 2117 B12R2.32 O=CC=1Cc2ccccc2N1 Amb24078943 [0,0,0,1,0,0|3,0,0]=4 2118 B12R2.32 OCC=1Cc2ccccc2C1 Amb22494117 [0,0,0,1,0,0|3,0,0]=4 2119 B12R2.32 O\N=C/1\Cc2ccccc2O1 Amb24727728 [0,0,0,1,0,0|2,0,1]=4 2120 B12R2.32 [N-]=[N+]=C1Cc2ccccc2N1 Amb24651394 [0,0,0,1,0,0|3,0,0]=4 2121 B12R2.37 CC1=C(C1=O)c2ccccc2 Amb1914070 [0,0,0,1,0,0|1,0,1]=3 2122 B12R2.37 CC1C(O)C1c2ccccc2 Amb24457875 [0,0,0,1,0,0|1,0,2]=4 2123 B12R2.37 C[C@@H]1C(c2ccccc2)[N@@]1C Amb23513697 [0,0,0,1,0,0|2,0,1]=4 2124 B12R2.37 C[C@@H]1[C@H](Cl)[C@@H]1c2ccccc2 Amb25321015 [0,0,0,1,0,0|2,0,1]=4 2125 B12R2.37 C[C@@H]1[C@H](Cl)[C@H]1c2ccccc2 Amb24511894 [0,0,0,1,0,0|2,0,1]=4 2126 B12R2.37 C[C@H]1C(Cl)[C@@H]1c2ccccc2 Amb25173083 [0,0,0,1,0,0|2,0,1]=4 2127 B12R2.37 C[C@H]1[C@H](Cl)[C@@H]1c2ccccc2 Amb25320879 [0,0,0,1,0,0|2,0,1]=4 2128 B12R2.37 Cc1c(-c2ccccc2)c1=O Amb17917365 [0,0,0,1,0,0|1,0,1]=3 2129 B12R2.37 NC=1C(=O)C1c2ccccc2 Amb24509252 [0,0,0,1,0,0|2,0,1]=4 2130 B12R2.37 O=C1C(Cl)=C1c2ccccc2 Amb25759566 [0,0,0,1,0,0|2,0,1]=4 2131 B12R2.37 OC=1C(=O)C1c2ccccc2 Amb24631580 [0,0,0,1,0,0|2,0,1]=4 2132 B12R2.94 NC1(Cc2ccccc2)CC1 Amb22587208 [0,0,0,1,0,0|2,0,1]=4 2133 B12R2.94 OC1(Cc2ccccc2)CC1 Amb19374431 [0,0,0,1,0,0|1,0,2]=4 2134 B12R2.2058 C(C1CCN1)c2ccccc2 Amb20623701 [0,0,0,1,0,0|2,0,1]=4 2135 B12R2.3511 COC(=O)C1c2ccccc21 Amb25270277 [0,0,0,1,0,0|0,0,0]=1 2136 B10R1.15 BrCC(=O)c1ccccc1 Amb1102084 [0,0,0,0,1,0|2,0,0]=3 2137 B10R1.15 BrCC(=O)c1ccccn1 Amb1980867 [0,0,0,0,1,0|3,0,0]=4 2138 B10R1.15 BrCC(=O)c1cccnc1 Amb1981330 [0,0,0,0,1,0|3,0,0]=4 2139 B10R1.15 BrCC(=O)c1ccncc1 Amb1981329 [0,0,0,0,1,0|3,0,0]=4 2140 B10R1.15 C#CC(=O)c1ccccc1 Amb1088846 [0,0,0,0,1,0|1,0,1]=3 2141 B10R1.15 C/C=C(\C)c1ccccc1 Amb17940650 [0,0,0,0,1,0|2,0,0]=3 2142 B10R1.15 C=C([Zn]Br)c1ccccc1 Amb22000417 [0,0,0,0,1,0|3,0,0]=4 2143 B10R1.15 C=CC(=O)c1cc[n]cc1 Amb24482055 [0,0,0,0,1,0|2,0,1]=4 2144 B10R1.15 C=CC(=O)c1ccc[n]c1 Amb25776729 [0,0,0,0,1,0|2,0,1]=4 2145 B10R1.15 C=CC(=O)c1ccccc1 Amb18062256 [0,0,0,0,1,0|1,0,1]=3 2146 B10R1.15 C=CS(=O)c1ccccc1 Amb15692858 [0,0,0,0,1,0|2,0,1]=4 2147 B10R1.15 C=C[S@@](=O)c1ccccc1 Amb22747463 [0,0,0,0,1,0|2,0,1]=4 2148 B10R1.15 CC(ON)c1ccccc1 Amb22491086 [0,0,0,0,1,0|2,0,1]=4 2149 B10R1.15 CC=C(F)c1ccccc1 Amb22008093 [0,0,0,0,1,0|2,0,0]=3 2150 B10R1.15 CCB(N)c1ccccc1 Amb25269618 [0,0,0,0,1,0|3,0,0]=4 2151 B10R1.15 CCB(O)c1ccccc1 Amb25174287 [0,0,0,0,1,0|2,0,1]=4 2152 B10R1.15 CCC(=C)c1cccc[n]1 Amb24467663 [0,0,0,0,1,0|3,0,0]=4 2153 B10R1.15 CCC(=C)c1ccccc1 Amb22234837 [0,0,0,0,1,0|2,0,0]=3 2154 B10R1.15 CCC(=N)c1cc[n]cc1 Amb25303409 [0,0,0,0,1,0|3,0,0]=4 2155 B10R1.15 CCC(=O)c1[n]ccc[n]1 Amb22236265 [0,0,0,0,1,0|3,0,0]=4 2156 B10R1.15 CCC(=O)c1c[n]c[n]c1 Amb24082134 [0,0,0,0,1,0|3,0,0]=4 2157 B10R1.15 CCC(=O)c1c[n]cc[n]1 Amb22235242 [0,0,0,0,1,0|3,0,0]=4 2158 B10R1.15 CCC(=O)c1cc[n][n]c1 Amb25143455 [0,0,0,0,1,0|3,0,0]=4 2159 B10R1.15 CCC(=O)c1cc[n]c[n]1 Amb25737542 [0,0,0,0,1,0|3,0,0]=4 2160 B10R1.15 CCC(=O)c1ccc[n][n]1 Amb24676867 [0,0,0,0,1,0|3,0,0]=4 2161 B10R1.15 CCC(=O)c1ccncc1 Amb10576400 [0,0,0,0,1,0|2,0,0]=3 2162 B10R1.15 CCC(=S)c1ccc[n]c1 Amb25837178 [0,0,0,0,1,0|2,1,0]=4 2163 B10R1.15 CCC(N)c1ccccc1 Amb19959910 [0,0,0,0,1,0|2,0,1]=4 2164 B10R1.15 CCC(c1ccccc1)N Amb1108026 [0,0,0,0,1,0|2,0,1]=4 2165 B10R1.15 CCN(O)c1ccccc1 Amb25223262 [0,0,0,0,1,0|2,0,1]=4 2166 B10R1.15 CCS(=O)c1ccccc1 Amb22234834 [0,0,0,0,1,0|2,0,0]=3 2167 B10R1.15 CCS(=O)c1ccccc1 Amb22500370 [0,0,0,0,1,0|2,0,0]=3 2168 B10R1.15 CC[C@@H](N)c1ccccc1 Amb22265426 [0,0,0,0,1,0|2,0,1]=4 2169 B10R1.15 CC[C@H](Cl)c1ccccc1 Amb24429104 [0,0,0,0,1,0|2,0,1]=4 2170 B10R1.15 CC[C@H](N)c1ccccc1 Amb22265559 [0,0,0,0,1,0|2,0,1]=4 2171 B10R1.15 CC[S@@](=O)c1ccccc1 Amb22747460 [0,0,0,0,1,0|2,0,0]=3 2172 B10R1.15 CNC(=N)c1cc[n]cc1 Amb24476946 [0,0,0,0,1,0|3,0,0]=4 2173 B10R1.15 CNC(=N)c1ccccc1 Amb23447117 [0,0,0,0,1,0|2,0,0]=3 2174 B10R1.15 CNC(=N)c1ccccn1 Amb11014510 [0,0,0,0,1,0|3,0,0]=4 2175 B10R1.15 CNC(=N)c1ccncc1 Amb11014516 [0,0,0,0,1,0|3,0,0]=4 2176 B10R1.15 CNC(=O)C=1CC=CNC1 Amb24478973 [0,0,0,0,1,0|2,0,1]=4 2177 B10R1.15 CNC(=O)c1c[n]c[n]c1 Amb25114110 [0,0,0,0,1,0|3,0,0]=4 2178 B10R1.15 CNC(=O)c1c[n]cc[n]1 Amb22500337 [0,0,0,0,1,0|3,0,0]=4 2179 B10R1.15 CNC(=O)c1ccccc1 Amb1793916 [0,0,0,0,1,0|1,0,0]=2 2180 B10R1.15 CNC(=O)c1ccncc1 Amb1772729 [0,0,0,0,1,0|2,0,0]=3 2181 B10R1.15 CNC(=O)c1ccncc1 Amb1782568 [0,0,0,0,1,0|2,0,0]=3 2182 B10R1.15 CNC(=O)c1ccncc1 Amb1787524 [0,0,0,0,1,0|2,0,0]=3 2183 B10R1.15 CNC(=S)c1cccc[n]1 Amb24451125 [0,0,0,0,1,0|2,1,0]=4 2184 B10R1.15 CNC(=S)c1ccccc1 Amb10552988 [0,0,0,0,1,0|1,1,0]=3 2185 B10R1.15 CNC(c1ccccc1)C Amb1215689 [0,0,0,0,1,0|2,0,1]=4 2186 B10R1.15 CNS(=O)c1ccccc1 Amb24606698 [0,0,0,0,1,0|2,0,0]=3 2187 B10R1.15 CN[C@@H](C)c1ccccc1 Amb17740009 [0,0,0,0,1,0|2,0,1]=4 2188 B10R1.15 CN[C@@H](C)c1ccccc1 Amb22899444 [0,0,0,0,1,0|2,0,1]=4 2189 B10R1.15 CN[C@@H](c1ccccc1)C Amb10844610 [0,0,0,0,1,0|2,0,1]=4 2190 B10R1.15 COC(=C)c1ccccc1 Amb10558859 [0,0,0,0,1,0|1,0,0]=2 2191 B10R1.15 COC(=N)c1[n]ccc[n]1 Amb24061344 [0,0,0,0,1,0|3,0,0]=4 2192 B10R1.15 COC(=N)c1c[n]c[n]c1 Amb24063073 [0,0,0,0,1,0|3,0,0]=4 2193 B10R1.15 COC(=N)c1c[n]cc[n]1 Amb21955137 [0,0,0,0,1,0|3,0,0]=4 2194 B10R1.15 COC(=N)c1cc[n][n]c1 Amb24696437 [0,0,0,0,1,0|3,0,0]=4 2195 B10R1.15 COC(=N)c1cc[n]c[n]1 Amb24595683 [0,0,0,0,1,0|3,0,0]=4 2196 B10R1.15 COC(=N)c1cc[n]cc1 Amb21963597 [0,0,0,0,1,0|2,0,0]=3 2197 B10R1.15 COC(=N)c1ccccn1 Amb10072424 [0,0,0,0,1,0|2,0,0]=3 2198 B10R1.15 COC(=N)c1ccccn1 Amb10552783 [0,0,0,0,1,0|2,0,0]=3 2199 B10R1.15 COC(=N)c1ccccn1 Amb10553348 [0,0,0,0,1,0|2,0,0]=3 2200 B10R1.15 COC(=N)c1cnccn1 Amb10071951 [0,0,0,0,1,0|3,0,0]=4 2201 B10R1.15 COC(=O)C1=COCC=C1 Amb24100793 [0,0,0,0,1,0|1,0,1]=3 2202 B10R1.15 COC(=O)C1C=CCC=C1 Amb22365029 [0,0,0,0,1,0|0,0,2]=3 2203 B10R1.15 COC(=O)C=1C=CCNC1 Amb25105274 [0,0,0,0,1,0|1,0,1]=3 2204 B10R1.15 COC(=O)C=1CC=CCC1 Amb22365036 [0,0,0,0,1,0|0,0,2]=3 2205 B10R1.15 COC(=O)C=1CC=NNC1 Amb24099509 [0,0,0,0,1,0|2,0,1]=4 2206 B10R1.15 COC(=O)N1CC=CC=N1 Amb24060232 [0,0,0,0,1,0|2,0,1]=4 2207 B10R1.15 COC(=O)[n+]1ccccc1 Amb24649947 [0,0,0,0,1,0|1,0,0]=2 2208 B10R1.15 COC(=O)c1[n][n]cc[n]1 Amb25327432 [0,0,0,0,1,0|3,0,0]=4 2209 B10R1.15 COC(=O)c1c[n][n][n]c1 Amb21963299 [0,0,0,0,1,0|3,0,0]=4 2210 B10R1.15 COC(=O)c1cc[n][n][n]1 Amb25212107 [0,0,0,0,1,0|3,0,0]=4 2211 B10R1.15 COC(=O)c1ccc[n][n]1 Amb21960450 [0,0,0,0,1,0|2,0,0]=3 2212 B10R1.15 COC(=O)c1ccc[n]c1 Amb22741138 [0,0,0,0,1,0|1,0,0]=2 2213 B10R1.15 COC(=O)c1cccnc1 Amb1212078 [0,0,0,0,1,0|1,0,0]=2 2214 B10R1.15 COC(=O)c1ccnnc1 Amb17935713 [0,0,0,0,1,0|2,0,0]=3 2215 B10R1.15 COC(=O)c1cnccn1 Amb2455964 [0,0,0,0,1,0|2,0,0]=3 2216 B10R1.15 COC(=S)c1ccccc1 Amb10569749 [0,0,0,0,1,0|0,1,0]=2 2217 B10R1.15 COC(=[NH2+])c1ccccc1 Amb10241351 [0,0,0,0,1,0|1,0,0]=2 2218 B10R1.15 COC(C)c1cc[n]cc1 Amb24102684 [0,0,0,0,1,0|2,0,1]=4 2219 B10R1.15 COC(C)c1ccccc1 Amb23568513 [0,0,0,0,1,0|1,0,1]=3 2220 B10R1.15 COC(Cl)c1ccccc1 Amb17940179 [0,0,0,0,1,0|1,0,1]=3 2221 B10R1.15 COC(O)c1c[n]ccc1 Amb25213606 [0,0,0,0,1,0|1,0,2]=4 2222 B10R1.15 COC(O)c1cccc[n]1 Amb25236210 [0,0,0,0,1,0|1,0,2]=4 2223 B10R1.15 COC(O)c1ccccc1 Amb25225981 [0,0,0,0,1,0|0,0,2]=3 2224 B10R1.15 CO[13C](=O)c1ccccc1 Amb22363354 [0,0,0,0,1,0|0,0,0]=1 2225 B10R1.15 CO[C@@H](Cl)c1ccccc1 Amb25108131 [0,0,0,0,1,0|1,0,1]=3 2226 B10R1.15 CPC(O)c1ccccc1 Amb25144461 [0,0,0,0,1,0|1,0,2]=4 2227 B10R1.15 CSC(=N)c1cc[n]cc1 Amb21955384 [0,0,0,0,1,0|2,1,0]=4 2228 B10R1.15 CSC(=N)c1cc[n]cc1 Amb25288573 [0,0,0,0,1,0|2,1,0]=4 2229 B10R1.15 CSC(=N)c1ccc[n]c1 Amb21955383 [0,0,0,0,1,0|2,1,0]=4 2230 B10R1.15 CSC(=N)c1ccc[n]c1 Amb24563938 [0,0,0,0,1,0|2,1,0]=4 2231 B10R1.15 CSC(=N)c1cccc[n]1 Amb21955629 [0,0,0,0,1,0|2,1,0]=4 2232 B10R1.15 CSC(=N)c1cccc[n]1 Amb24711862 [0,0,0,0,1,0|2,1,0]=4 2233 B10R1.15 CSC(=N)c1ccccc1 Amb22488568 [0,0,0,0,1,0|1,1,0]=3 2234 B10R1.15 CSC(=N)c1ccccc1 Amb24542868 [0,0,0,0,1,0|1,1,0]=3 2235 B10R1.15 CSC(=O)c1c[n]cc[n]1 Amb24678657 [0,0,0,0,1,0|2,1,0]=4 2236 B10R1.15 CSC(=O)c1ccccn1 Amb1487227 [0,0,0,0,1,0|1,1,0]=3 2237 B10R1.15 CSC(=S)c1ccccc1 Amb24395059 [0,0,0,0,1,0|0,2,0]=3 2238 B10R1.15 C[C@@H](ON)c1ccccc1 Amb25850037 [0,0,0,0,1,0|2,0,1]=4 2239 B10R1.15 C\C(=C/Br)\c1ccccc1 Amb25066105 [0,0,0,0,1,0|3,0,0]=4 2240 B10R1.15 C\C(=C/C)\c1c[n]ccc1 Amb24085629 [0,0,0,0,1,0|3,0,0]=4 2241 B10R1.15 C\C(=C/C)\c1cc[n]cc1 Amb24103190 [0,0,0,0,1,0|3,0,0]=4 2242 B10R1.15 C\C(=C\C)\c1cc[n]cc1 Amb24619216 [0,0,0,0,1,0|3,0,0]=4 2243 B10R1.15 C\C(=C\C)\c1cccc[n]1 Amb24580985 [0,0,0,0,1,0|3,0,0]=4 2244 B10R1.15 C\C(=C\N)\c1ccccc1 Amb24674165 [0,0,0,0,1,0|3,0,0]=4 2245 B10R1.15 C\C(=N\C)\c1c[n]ccc1 Amb25230944 [0,0,0,0,1,0|3,0,0]=4 2246 B10R1.15 C\C(=N\C)\c1cccc[n]1 Amb24433259 [0,0,0,0,1,0|3,0,0]=4 2247 B10R1.15 C\C=C(\N)/c1cccc[n]1 Amb25777355 [0,0,0,0,1,0|3,0,0]=4 2248 B10R1.15 C\N=C(/N)\c1c[n]ccc1 Amb21970335 [0,0,0,0,1,0|3,0,0]=4 2249 B10R1.15 C\N=C(\Cl)/c1ccccc1 Amb25835717 [0,0,0,0,1,0|2,0,0]=3 2250 B10R1.15 Cl\C(=C\Cl)\c1ccccc1 Amb25849275 [0,0,0,0,1,0|3,0,0]=4 2251 B10R1.15 FCC(=O)c1ccccc1 Amb10603600 [0,0,0,0,1,0|2,0,0]=3 2252 B10R1.15 F\C(=C/Cl)\c1ccccc1 Amb24589902 [0,0,0,0,1,0|3,0,0]=4 2253 B10R1.15 F\C(=C\F)\c1ccccc1 Amb25762778 [0,0,0,0,1,0|3,0,0]=4 2254 B10R1.15 N#CC(=C)c1ccccc1 Amb17231856 [0,0,0,0,1,0|3,0,0]=4 2255 B10R1.15 N#CC(=O)c1ccc[n]c1 Amb24725178 [0,0,0,0,1,0|3,0,0]=4 2256 B10R1.15 N#CC(=O)c1cccc[n]1 Amb25336318 [0,0,0,0,1,0|3,0,0]=4 2257 B10R1.15 N=C(OO)c1ccc[n]c1 Amb24062391 [0,0,0,0,1,0|3,0,0]=4 2258 B10R1.15 N=NC(=O)c1cc[n]cc1 Amb24102954 [0,0,0,0,1,0|3,0,0]=4 2259 B10R1.15 NC(=NN)c1ccccc1 Amb22488579 [0,0,0,0,1,0|3,0,0]=4 2260 B10R1.15 NC(=S=O)c1ccccc1 Amb24406743 [0,0,0,0,1,0|2,1,0]=4 2261 B10R1.15 NCC(=C)c1ccccc1 Amb10609068 [0,0,0,0,1,0|3,0,0]=4 2262 B10R1.15 NCC(=O)c1cc[n]cc1 Amb18832471 [0,0,0,0,1,0|3,0,0]=4 2263 B10R1.15 NCC(=O)c1cc[n]cc1 Amb22002046 [0,0,0,0,1,0|3,0,0]=4 2264 B10R1.15 NCC(=O)c1ccc[n]c1 Amb22277079 [0,0,0,0,1,0|3,0,0]=4 2265 B10R1.15 NCC(=O)c1ccc[n]c1 Amb22754018 [0,0,0,0,1,0|3,0,0]=4 2266 B10R1.15 NCC(=O)c1cccc[n]1 Amb18832469 [0,0,0,0,1,0|3,0,0]=4 2267 B10R1.15 NCC(=O)c1ccccc1 Amb1073498 [0,0,0,0,1,0|2,0,0]=3 2268 B10R1.15 NCC(=O)c1ccccn1 Amb10601921 [0,0,0,0,1,0|3,0,0]=4 2269 B10R1.15 NCC(=O)c1cccnc1 Amb17607867 [0,0,0,0,1,0|3,0,0]=4 2270 B10R1.15 NNC(=N)c1ccccc1 Amb22234855 [0,0,0,0,1,0|3,0,0]=4 2271 B10R1.15 NNC(=N)c1ccccc1 Amb22481319 [0,0,0,0,1,0|3,0,0]=4 2272 B10R1.15 NNC(=N)c1ccccc1 Amb22756451 [0,0,0,0,1,0|3,0,0]=4 2273 B10R1.15 NNC(=O)c1ccccc1 Amb1208583 [0,0,0,0,1,0|2,0,0]=3 2274 B10R1.15 NNC(=O)c1ccccn1 Amb1208395 [0,0,0,0,1,0|3,0,0]=4 2275 B10R1.15 NNC(=O)c1cccnc1 Amb1786962 [0,0,0,0,1,0|3,0,0]=4 2276 B10R1.15 NNC(=S)c1ccccc1 Amb23513674 [0,0,0,0,1,0|2,1,0]=4 2277 B10R1.15 NOC(=O)c1ccccc1 Amb22054026 [0,0,0,0,1,0|1,0,0]=2 2278 B10R1.15 NOC(c1ccccc1)C Amb17089185 [0,0,0,0,1,0|2,0,1]=4 2279 B10R1.15 N\C(=C\N)\c1ccccc1 Amb25147590 [0,0,0,0,1,0|3,0,0]=4 2280 B10R1.15 N\C(=C\O)\c1ccccc1 Amb25675946 [0,0,0,0,1,0|3,0,0]=4 2281 B10R1.15 N\C(=N/Br)\c1ccccc1 Amb25046590 [0,0,0,0,1,0|3,0,0]=4 2282 B10R1.15 N\C(=N/N)\c1ccccc1 Amb20407822 [0,0,0,0,1,0|3,0,0]=4 2283 B10R1.15 N\C(=N\Cl)\c1ccccc1 Amb24571718 [0,0,0,0,1,0|3,0,0]=4 2284 B10R1.15 N\C(=N\I)\c1ccccc1 Amb24599616 [0,0,0,0,1,0|3,0,0]=4 2285 B10R1.15 N\N=C(\c1ccccc1)/N Amb10608779 [0,0,0,0,1,0|3,0,0]=4 2286 B10R1.15 O/C=C(\O)c1ccccc1 Amb17943089 [0,0,0,0,1,0|2,0,1]=4 2287 B10R1.15 O/N=C(/O)c1ccccc1 Amb17843421 [0,0,0,0,1,0|2,0,1]=4 2288 B10R1.15 O=C(C=O)c1c[n]ccc1 Amb18642978 [0,0,0,0,1,0|3,0,0]=4 2289 B10R1.15 O=C(C=O)c1cccc[n]1 Amb25066902 [0,0,0,0,1,0|3,0,0]=4 2290 B10R1.15 O=C(CCl)c1cc[n]cc1 Amb22371842 [0,0,0,0,1,0|3,0,0]=4 2291 B10R1.15 O=C(CCl)c1ccc[n]c1 Amb22371841 [0,0,0,0,1,0|3,0,0]=4 2292 B10R1.15 O=C(CCl)c1cccc[n]1 Amb22497248 [0,0,0,0,1,0|3,0,0]=4 2293 B10R1.15 O=C(CF)c1ccc[n]c1 Amb24084131 [0,0,0,0,1,0|3,0,0]=4 2294 B10R1.15 O=C(CF)c1cccc[n]1 Amb24084124 [0,0,0,0,1,0|3,0,0]=4 2295 B10R1.15 O=C(CI)c1ccccc1 Amb23579972 [0,0,0,0,1,0|2,0,0]=3 2296 B10R1.15 O=C(C[K])c1cccc[n]1 Amb25224773 [0,0,0,0,1,0|3,0,0]=4 2297 B10R1.15 O=C(N=O)c1ccccc1 Amb24096802 [0,0,0,0,1,0|2,0,0]=3 2298 B10R1.15 O=C(NCl)c1ccccc1 Amb25277317 [0,0,0,0,1,0|2,0,0]=3 2299 B10R1.15 O=CC(=C)c1ccccc1 Amb16233227 [0,0,0,0,1,0|3,0,0]=4 2300 B10R1.15 O=P(CCl)c1ccccc1 Amb25053604 [0,0,0,0,1,0|3,0,0]=4 2301 B10R1.15 O=P(O[Na])c1ccccc1 Amb22360738 [0,0,0,0,1,0|2,0,0]=3 2302 B10R1.15 O=S(CF)c1ccccc1 Amb22723398 [0,0,0,0,1,0|3,0,0]=4 2303 B10R1.15 OCC(=O)c1cc[n]cc1 Amb18063686 [0,0,0,0,1,0|3,0,0]=4 2304 B10R1.15 OCC(=O)c1ccc[n]c1 Amb18063681 [0,0,0,0,1,0|3,0,0]=4 2305 B10R1.15 OCC(=O)c1cccc[n]1 Amb18063640 [0,0,0,0,1,0|3,0,0]=4 2306 B10R1.15 ONC(=N)c1ccccc1 Amb17231893 [0,0,0,0,1,0|3,0,0]=4 2307 B10R1.15 ONC(=O)c1ccccc1 Amb1645521 [0,0,0,0,1,0|2,0,0]=3 2308 B10R1.15 OOC(=O)c1cc[n]cc1 Amb24066209 [0,0,0,0,1,0|2,0,0]=3 2309 B10R1.15 OOC(=O)c1ccc[n]c1 Amb24094187 [0,0,0,0,1,0|2,0,0]=3 2310 B10R1.15 OOC(=O)c1ccccc1 Amb17672281 [0,0,0,0,1,0|1,0,0]=2 2311 B10R1.15 O\C(=C/Cl)\c1ccccc1 Amb24068872 [0,0,0,0,1,0|2,0,1]=4 2312 B10R1.15 O\C(=C/F)\c1ccccc1 Amb24068873 [0,0,0,0,1,0|2,0,1]=4 2313 B10R1.15 O\C(=C\F)\c1ccccc1 Amb25094625 [0,0,0,0,1,0|2,0,1]=4 2314 B10R1.15 O\C=C(\Cl)/c1ccccc1 Amb25332181 [0,0,0,0,1,0|3,0,0]=4 2315 B10R1.15 O\N=C(/c1ccccc1)\N Amb2226909 [0,0,0,0,1,0|3,0,0]=4 2316 B10R1.15 O\N=C(\c1ccccc1)/C Amb2387477 [0,0,0,0,1,0|3,0,0]=4 2317 B10R1.15 O\N=C(\c1ccccc1)/Cl Amb10563288 [0,0,0,0,1,0|3,0,0]=4 2318 B10R1.15 O\N=C(\c1ccccc1)/N Amb1149046 [0,0,0,0,1,0|3,0,0]=4 2319 B10R1.15 SCC(=O)c1ccccc1 Amb16192503 [0,0,0,0,1,0|2,0,0]=3 2320 B10R1.15 [2H]\C(=C\[2H])\c1ccccc1 Amb22353430 [0,0,0,0,1,0|3,0,0]=4 2321 B10R1.15 [Li]OS(=O)c1ccccc1 Amb22359261 [0,0,0,0,1,0|2,0,0]=3 2322 B10R1.15 [O-]NC(=O)c1ccccc1 Amb18800075 [0,0,0,0,1,0|2,0,0]=3 2323 B10R1.15 [O-]NC(=O)c1ccccc1 Amb22527267 [0,0,0,0,1,0|2,0,0]=3 2324 B10R1.15 [O-][NH2+]C(=O)c1ccc[n]c1 Amb22170062 [0,0,0,0,1,0|3,0,0]=4 2325 B10R1.27 C#CC(=O)Cc1cc[s]c1 Amb25065037 [0,0,0,0,1,0|2,0,1]=4 2326 B10R1.27 C#CC(=O)Cc1ccc[s]1 Amb25314927 [0,0,0,0,1,0|2,0,1]=4 2327 B10R1.27 C=CC(=O)Cc1cc[s]c1 Amb24745076 [0,0,0,0,1,0|2,0,1]=4 2328 B10R1.27 CCC(=C)C[n]1cccc1 Amb24701436 [0,0,0,0,1,0|3,0,0]=4 2329 B10R1.27 CCC(=O)C[n]1c[n]cc1 Amb24368285 [0,0,0,0,1,0|3,0,0]=4 2330 B10R1.27 CCC(=O)C[n]1ccc[n]1 Amb25742278 [0,0,0,0,1,0|3,0,0]=4 2331 B10R1.27 CCC(=O)Cc1[n]cc[s]1 Amb24477960 [0,0,0,0,1,0|3,0,0]=4 2332 B10R1.27 CCC(=O)Cc1c[s]cc1 Amb18791601 [0,0,0,0,1,0|2,0,0]=3 2333 B10R1.27 CCC(=O)Cc1ccc[s]1 Amb18041935 [0,0,0,0,1,0|2,0,0]=3 2334 B10R1.27 CCC(=O)Cc1ccco1 Amb1102322 [0,0,0,0,1,0|2,0,0]=3 2335 B10R1.27 CCC(=O)N[n]1cccc1 Amb24646179 [0,0,0,0,1,0|3,0,0]=4 2336 B10R1.27 CCC(=O)Nc1cc[s]c1 Amb25749066 [0,0,0,0,1,0|3,0,0]=4 2337 B10R1.27 CCC(=O)Nc1ccco1 Amb17689209 [0,0,0,0,1,0|3,0,0]=4 2338 B10R1.27 CNC(=O)C[n]1ccc[n]1 Amb25698107 [0,0,0,0,1,0|3,0,0]=4 2339 B10R1.27 CNC(=O)Cc1ccc[nH]1 Amb25836782 [0,0,0,0,1,0|2,0,0]=3 2340 B10R1.27 CNC(=O)Cc1ccoc1 Amb25355859 [0,0,0,0,1,0|2,0,0]=3 2341 B10R1.27 CNC(=O)Nc1ccc[s]1 Amb24334492 [0,0,0,0,1,0|3,0,0]=4 2342 B10R1.27 CNC(=O)Nc1ccco1 Amb25823033 [0,0,0,0,1,0|3,0,0]=4 2343 B10R1.27 COC(=N)Cc1ccc[s]1 Amb18799604 [0,0,0,0,1,0|2,0,0]=3 2344 B10R1.27 COC(=O)CC=1CCCC1 Amb24643741 [0,0,0,0,1,0|0,0,3]=4 2345 B10R1.27 COC(=O)CN1CC=CC1 Amb25368528 [0,0,0,0,1,0|1,0,2]=4 2346 B10R1.27 COC(=O)C[n]1c[n][n]c1 Amb24408106 [0,0,0,0,1,0|3,0,0]=4 2347 B10R1.27 COC(=O)Cc1[nH]cc[n]1 Amb19944574 [0,0,0,0,1,0|2,0,0]=3 2348 B10R1.27 COC(=O)Cc1[n][n]co1 Amb22886633 [0,0,0,0,1,0|3,0,0]=4 2349 B10R1.27 COC(=O)Cc1[n]cc[s]1 Amb18787677 [0,0,0,0,1,0|2,0,0]=3 2350 B10R1.27 COC(=O)Cc1c[nH][n][n]1 Amb22371937 [0,0,0,0,1,0|3,0,0]=4 2351 B10R1.27 COC(=O)Cc1c[nH][n]c1 Amb22752842 [0,0,0,0,1,0|2,0,0]=3 2352 B10R1.27 COC(=O)Cc1c[nH]c[n]1 Amb22263050 [0,0,0,0,1,0|2,0,0]=3 2353 B10R1.27 COC(=O)Cc1c[n][s]c1 Amb25069545 [0,0,0,0,1,0|2,0,0]=3 2354 B10R1.27 COC(=O)Cc1c[n]c[s]1 Amb23440683 [0,0,0,0,1,0|2,0,0]=3 2355 B10R1.27 COC(=O)Cc1c[n]co1 Amb25728316 [0,0,0,0,1,0|2,0,0]=3 2356 B10R1.27 COC(=O)Cc1cc[nH]c1 Amb24391178 [0,0,0,0,1,0|1,0,0]=2 2357 B10R1.27 COC(=O)Cc1cc[n][nH]1 Amb19304348 [0,0,0,0,1,0|2,0,0]=3 2358 B10R1.27 COC(=O)Cc1cc[n][s]1 Amb24670886 [0,0,0,0,1,0|2,0,0]=3 2359 B10R1.27 COC(=O)Cc1cc[n]o1 Amb24423354 [0,0,0,0,1,0|2,0,0]=3 2360 B10R1.27 COC(=O)Cc1ccc[nH]1 Amb25147302 [0,0,0,0,1,0|1,0,0]=2 2361 B10R1.27 COC(=O)Cc1ccco1 Amb23455987 [0,0,0,0,1,0|1,0,0]=2 2362 B10R1.27 COC(=O)Cc1cco[n]1 Amb23440842 [0,0,0,0,1,0|2,0,0]=3 2363 B10R1.27 COC(=O)Cc1coc[n]1 Amb23440855 [0,0,0,0,1,0|2,0,0]=3 2364 B10R1.27 COC(=O)Cn1cncn1 Amb1088889 [0,0,0,0,1,0|3,0,0]=4 2365 B10R1.27 COC(=O)Nc1c[nH]c[n]1 Amb25213060 [0,0,0,0,1,0|3,0,0]=4 2366 B10R1.27 COC(=O)Nc1cc[nH][n]1 Amb24740170 [0,0,0,0,1,0|3,0,0]=4 2367 B10R1.27 COC(=O)Nc1cc[n][s]1 Amb25104974 [0,0,0,0,1,0|3,0,0]=4 2368 B10R1.27 COC(=O)Nc1ccc[s]1 Amb24418444 [0,0,0,0,1,0|2,0,0]=3 2369 B10R1.27 COC(=O)\C=C/1\CC=CO1 Amb24401463 [0,0,0,0,1,0|1,0,2]=4 2370 B10R1.27 CSC(=O)Cc1ccc[s]1 Amb25364375 [0,0,0,0,1,0|1,1,0]=3 2371 B10R1.27 NCC(=O)Cc1c[s]cc1 Amb18251481 [0,0,0,0,1,0|3,0,0]=4 2372 B10R1.27 NCC(=O)Cc1ccc[s]1 Amb18908487 [0,0,0,0,1,0|3,0,0]=4 2373 B10R1.27 NCC(=O)Cc1ccco1 Amb18251183 [0,0,0,0,1,0|3,0,0]=4 2374 B10R1.27 NNC(=O)Cc1ccc[nH]1 Amb25092731 [0,0,0,0,1,0|3,0,0]=4 2375 B10R1.27 NNC(=O)Cc1ccco1 Amb25143818 [0,0,0,0,1,0|3,0,0]=4 2376 B10R1.27 NNC(=O)Cc1cccs1 Amb1153785 [0,0,0,0,1,0|3,0,0]=4 2377 B10R1.27 O=C(Cc1ccc[s]1)CBr Amb24076613 [0,0,0,0,1,0|3,0,0]=4 2378 B10R1.27 OCC(=O)Cc1c[s]cc1 Amb25096464 [0,0,0,0,1,0|3,0,0]=4 2379 B10R1.27 OCC(=O)Cc1ccc[s]1 Amb24636460 [0,0,0,0,1,0|3,0,0]=4 2380 B10R1.27 ONC(=O)Cc1ccco1 Amb25050997 [0,0,0,0,1,0|3,0,0]=4 2381 B12R1.27 BrCC(=O)NCc1ccccc1 Amb2221074 [0,0,0,0,0,1|2,0,0]=3 2382 B12R1.27 BrCC(=O)NCc1ccccn1 Amb15701346 [0,0,0,0,0,1|3,0,0]=4 2383 B12R1.27 BrCC(=O)NCc1cccnc1 Amb17332390 [0,0,0,0,0,1|3,0,0]=4 2384 B12R1.27 BrCC(=O)NCc1ccncc1 Amb17328296 [0,0,0,0,0,1|3,0,0]=4 2385 B12R1.27 BrCC(=O)\C=C\c1ccccc1 Amb17596167 [0,0,0,0,0,1|2,0,1]=4 2386 B12R1.27 C#CC(=O)C#Cc1ccccc1 Amb24690594 [0,0,0,0,0,1|1,0,2]=4 2387 B12R1.27 C#CC(=O)CCc1cc[n]cc1 Amb24684499 [0,0,0,0,0,1|2,0,1]=4 2388 B12R1.27 C#CC(=O)CCc1ccc[n]c1 Amb25271085 [0,0,0,0,0,1|2,0,1]=4 2389 B12R1.27 C#CC(=O)CCc1ccccc1 Amb24483845 [0,0,0,0,0,1|1,0,1]=3 2390 B12R1.27 C#CC(=O)CNc1ccccc1 Amb24359731 [0,0,0,0,0,1|1,0,1]=3 2391 B12R1.27 C#CC(=O)COc1ccccc1 Amb24483847 [0,0,0,0,0,1|1,0,1]=3 2392 B12R1.27 C#CC(=O)NCc1cc[n]cc1 Amb24462862 [0,0,0,0,0,1|2,0,1]=4 2393 B12R1.27 C#CC(=O)NCc1ccccc1 Amb10572437 [0,0,0,0,0,1|1,0,1]=3 2394 B12R1.27 C#CC(=O)OCc1ccccc1 Amb24057136 [0,0,0,0,0,1|1,0,1]=3 2395 B12R1.27 C#CC(=O)\C=C\c1ccccc1 Amb25706970 [0,0,0,0,0,1|1,0,2]=4 2396 B12R1.27 C=C(CNc1ccccc1)C#N Amb18645075 [0,0,0,0,0,1|3,0,0]=4 2397 B12R1.27 C=C(CO)CNc1ccccc1 Amb24537817 [0,0,0,0,0,1|3,0,0]=4 2398 B12R1.27 C=C(COc1ccccc1)C#N Amb25739080 [0,0,0,0,0,1|3,0,0]=4 2399 B12R1.27 C=CC(=O)CCc1ccccc1 Amb10562280 [0,0,0,0,0,1|1,0,1]=3 2400 B12R1.27 C=CC(=O)NCc1ccccc1 Amb1196142 [0,0,0,0,0,1|1,0,1]=3 2401 B12R1.27 C=CC(=O)OCc1ccccc1 Amb10807780 [0,0,0,0,0,1|1,0,1]=3 2402 B12R1.27 CCC(=C)CNc1cccc[n]1 Amb24677972 [0,0,0,0,0,1|3,0,0]=4 2403 B12R1.27 CCC(=C)CNc1ccccc1 Amb25093473 [0,0,0,0,0,1|2,0,0]=3 2404 B12R1.27 CCC(=N)NCc1cc[n]cc1 Amb25848020 [0,0,0,0,0,1|3,0,0]=4 2405 B12R1.27 CCC(=N)NCc1cccc[n]1 Amb25807072 [0,0,0,0,0,1|3,0,0]=4 2406 B12R1.27 CCC(=N)NCc1ccccc1 Amb24388885 [0,0,0,0,0,1|2,0,0]=3 2407 B12R1.27 CCC(=O)C#Cc1c[n]ccc1 Amb24532730 [0,0,0,0,0,1|2,0,1]=4 2408 B12R1.27 CCC(=O)C#Cc1ccccc1 Amb10562235 [0,0,0,0,0,1|1,0,1]=3 2409 B12R1.27 CCC(=O)NCc1cc[n]c[n]1 Amb24693514 [0,0,0,0,0,1|3,0,0]=4 2410 B12R1.27 CCC(=O)NCc1ccc[n][n]1 Amb25303777 [0,0,0,0,0,1|3,0,0]=4 2411 B12R1.27 CCC(=O)NCc1ccccn1 Amb17736593 [0,0,0,0,0,1|2,0,0]=3 2412 B12R1.27 CCC(=O)NCc1ccncc1 Amb17798077 [0,0,0,0,0,1|2,0,0]=3 2413 B12R1.27 CCC(=O)NNc1c[n]ccc1 Amb25057552 [0,0,0,0,0,1|3,0,0]=4 2414 B12R1.27 CCC(=O)O[Hg]c1ccccc1 Amb22359615 [0,0,0,0,0,1|2,0,0]=3 2415 B12R1.27 CCC(=O)\C=C/c1ccccc1 Amb25271028 [0,0,0,0,0,1|1,0,1]=3 2416 B12R1.27 CCC(=O)\C=C\c1ccc[n]c1 Amb25358914 [0,0,0,0,0,1|2,0,1]=4 2417 B12R1.27 CCC(=O)\C=C\c1cccc[n]1 Amb24487185 [0,0,0,0,0,1|2,0,1]=4 2418 B12R1.27 CCC(=O)\C=C\c1ccccc1 Amb10565332 [0,0,0,0,0,1|1,0,1]=3 2419 B12R1.27 CCC(=O)\N=N\c1ccccc1 Amb24644165 [0,0,0,0,0,1|2,0,0]=3 2420 B12R1.27 CCC(CCc1ccccc1)O Amb17138574 [0,0,0,0,0,1|1,0,2]=4 2421 B12R1.27 CCC(CNc1ccccc1)O Amb13952005 [0,0,0,0,0,1|1,0,2]=4 2422 B12R1.27 CCC(CSc1ccccc1)N Amb17485970 [0,0,0,0,0,1|2,0,1]=4 2423 B12R1.27 CCC(N)CNc1ccccc1 Amb19009674 [0,0,0,0,0,1|2,0,1]=4 2424 B12R1.27 CCC(N)COc1ccccc1 Amb19029691 [0,0,0,0,0,1|2,0,1]=4 2425 B12R1.27 CCC(O)OCc1ccccc1 Amb25793622 [0,0,0,0,0,1|1,0,2]=4 2426 B12R1.27 CCS(=O)NCc1ccccc1 Amb25359778 [0,0,0,0,0,1|2,0,0]=3 2427 B12R1.27 CC[C@H](C)CNc1ccccc1 Amb25843960 [0,0,0,0,0,1|2,0,1]=4 2428 B12R1.27 CN=C(N)NCc1c[n]ccc1 Amb20631270 [0,0,0,0,0,1|3,0,0]=4 2429 B12R1.27 CNC(=N)COc1ccccc1 Amb25336063 [0,0,0,0,0,1|2,0,0]=3 2430 B12R1.27 CNC(=N)CSc1ccccc1 Amb24485624 [0,0,0,0,0,1|2,0,0]=3 2431 B12R1.27 CNC(=N)NCc1cc[n]cc1 Amb18798338 [0,0,0,0,0,1|3,0,0]=4 2432 B12R1.27 CNC(=N)NCc1ccc[n]c1 Amb18798337 [0,0,0,0,0,1|3,0,0]=4 2433 B12R1.27 CNC(=N)NCc1cccc[n]1 Amb18800824 [0,0,0,0,0,1|3,0,0]=4 2434 B12R1.27 CNC(=N)NCc1ccccc1 Amb18798221 [0,0,0,0,0,1|2,0,0]=3 2435 B12R1.27 CNC(=N)NNc1ccccc1 Amb25227942 [0,0,0,0,0,1|3,0,0]=4 2436 B12R1.27 CNC(=N)SCc1ccccn1 Amb16229672 [0,0,0,0,0,1|3,0,0]=4 2437 B12R1.27 CNC(=O)C#Cc1ccccc1 Amb2106613 [0,0,0,0,0,1|1,0,1]=3 2438 B12R1.27 CNC(=O)CCc1c[n]c[n]c1 Amb24388414 [0,0,0,0,0,1|3,0,0]=4 2439 B12R1.27 CNC(=O)CNc1cc[n]c[n]1 Amb18290771 [0,0,0,0,0,1|3,0,0]=4 2440 B12R1.27 CNC(=O)CNc1ccc[n][n]1 Amb18298699 [0,0,0,0,0,1|3,0,0]=4 2441 B12R1.27 CNC(=O)COc1ccc[n]c1 Amb24622499 [0,0,0,0,0,1|2,0,0]=3 2442 B12R1.27 CNC(=O)CSc1[n]ccc[n]1 Amb24466010 [0,0,0,0,0,1|3,0,0]=4 2443 B12R1.27 CNC(=O)CSc1c[n]cc[n]1 Amb25681063 [0,0,0,0,0,1|3,0,0]=4 2444 B12R1.27 CNC(=O)CSc1cc[n]c[n]1 Amb24430677 [0,0,0,0,0,1|3,0,0]=4 2445 B12R1.27 CNC(=O)CSc1ccccn1 Amb13953848 [0,0,0,0,0,1|2,0,0]=3 2446 B12R1.27 CNC(=O)NCc1c[n]cc[n]1 Amb25690867 [0,0,0,0,0,1|3,0,0]=4 2447 B12R1.27 CNC(=O)NCc1cc[n]c[n]1 Amb24415772 [0,0,0,0,0,1|3,0,0]=4 2448 B12R1.27 CNC(=O)NCc1ccccc1 Amb2132763 [0,0,0,0,0,1|1,0,0]=2 2449 B12R1.27 CNC(=O)NCc1ccccn1 Amb2132790 [0,0,0,0,0,1|2,0,0]=3 2450 B12R1.27 CNC(=O)NCc1cccnc1 Amb2132774 [0,0,0,0,0,1|2,0,0]=3 2451 B12R1.27 CNC(=O)NCc1ccncc1 Amb2132791 [0,0,0,0,0,1|2,0,0]=3 2452 B12R1.27 CNC(=O)NNc1ccccc1 Amb25751263 [0,0,0,0,0,1|2,0,0]=3 2453 B12R1.27 CNC(=O)OCc1ccc[n]c1 Amb24532586 [0,0,0,0,0,1|2,0,0]=3 2454 B12R1.27 CNC(=O)SCc1cccc[n]1 Amb25054647 [0,0,0,0,0,1|2,0,0]=3 2455 B12R1.27 CNC(=O)\C=C\c1cccc[n]1 Amb24056147 [0,0,0,0,0,1|2,0,1]=4 2456 B12R1.27 CNC(=O)\N=C\c1ccccc1 Amb24497304 [0,0,0,0,0,1|1,0,1]=3 2457 B12R1.27 CNC(=O)\N=N\c1ccccc1 Amb25313077 [0,0,0,0,0,1|2,0,0]=3 2458 B12R1.27 CNC(=S)\N=N\c1ccccc1 Amb24664353 [0,0,0,0,0,1|2,1,0]=4 2459 B12R1.27 CNC(C)CNc1ccccc1 Amb18312626 [0,0,0,0,0,1|2,0,1]=4 2460 B12R1.27 CNC(CCc1ccccc1)C Amb1138722 [0,0,0,0,0,1|2,0,1]=4 2461 B12R1.27 COC(=N)CCc1cc[n]cc1 Amb18563635 [0,0,0,0,0,1|2,0,0]=3 2462 B12R1.27 COC(=N)CCc1ccc[n]c1 Amb18563630 [0,0,0,0,0,1|2,0,0]=3 2463 B12R1.27 COC(=N)CCc1cccc[n]1 Amb18563625 [0,0,0,0,0,1|2,0,0]=3 2464 B12R1.27 COC(=N)CNc1ccccc1 Amb24597022 [0,0,0,0,0,1|1,0,0]=2 2465 B12R1.27 COC(=N)COc1ccccc1 Amb18798404 [0,0,0,0,0,1|1,0,0]=2 2466 B12R1.27 COC(=O)/C=C/c1cccnc1 Amb17844385 [0,0,0,0,0,1|1,0,1]=3 2467 B12R1.27 COC(=O)C#Cc1c[n]cc[n]1 Amb24394719 [0,0,0,0,0,1|2,0,1]=4 2468 B12R1.27 COC(=O)C#Cc1cc[n][n]c1 Amb24736910 [0,0,0,0,0,1|2,0,1]=4 2469 B12R1.27 COC(=O)C#Cc1ccccn1 Amb1039304 [0,0,0,0,0,1|1,0,1]=3 2470 B12R1.27 COC(=O)C=Cc1c[n]c[n]c1 Amb24093840 [0,0,0,0,0,1|2,0,1]=4 2471 B12R1.27 COC(=O)C=Cc1cc[n]cc1 Amb20668041 [0,0,0,0,0,1|1,0,1]=3 2472 B12R1.27 COC(=O)C=Cc1cc[n]cc1 Amb24074160 [0,0,0,0,0,1|1,0,1]=3 2473 B12R1.27 COC(=O)CCc1c[n]c[n]c1 Amb21922892 [0,0,0,0,0,1|2,0,0]=3 2474 B12R1.27 COC(=O)CCc1cc[n][n]c1 Amb23454523 [0,0,0,0,0,1|2,0,0]=3 2475 B12R1.27 COC(=O)CCc1ccncc1 Amb10604945 [0,0,0,0,0,1|1,0,0]=2 2476 B12R1.27 COC(=O)CNc1c[n]c[n]c1 Amb18270088 [0,0,0,0,0,1|2,0,0]=3 2477 B12R1.27 COC(=O)CNc1cc[n]c[n]1 Amb18788537 [0,0,0,0,0,1|2,0,0]=3 2478 B12R1.27 COC(=O)CNc1ccc[n][n]1 Amb19023174 [0,0,0,0,0,1|2,0,0]=3 2479 B12R1.27 COC(=O)CNc1ccc[n]c1 Amb18270093 [0,0,0,0,0,1|1,0,0]=2 2480 B12R1.27 COC(=O)COc1cccc[n]1 Amb24095859 [0,0,0,0,0,1|1,0,0]=2 2481 B12R1.27 COC(=O)CSc1cccc[n]1 Amb22280333 [0,0,0,0,0,1|1,0,0]=2 2482 B12R1.27 COC(=O)NCc1cc[n]c[n]1 Amb25321776 [0,0,0,0,0,1|2,0,0]=3 2483 B12R1.27 COC(=O)NCc1ccccn1 Amb17736865 [0,0,0,0,0,1|1,0,0]=2 2484 B12R1.27 COC(=O)NCc1cccnc1 Amb17790231 [0,0,0,0,0,1|1,0,0]=2 2485 B12R1.27 COC(=O)NNc1[n]ccc[n]1 Amb25059265 [0,0,0,0,0,1|3,0,0]=4 2486 B12R1.27 COC(=O)NNc1c[n]cc[n]1 Amb25297240 [0,0,0,0,0,1|3,0,0]=4 2487 B12R1.27 COC(=O)OCc1ccccc1 Amb25034726 [0,0,0,0,0,1|0,0,0]=1 2488 B12R1.27 COC(=O)\C=C\c1[n]ccc[n]1 Amb25337205 [0,0,0,0,0,1|2,0,1]=4 2489 B12R1.27 COC(=O)\C=C\c1c[n]cc[n]1 Amb22524637 [0,0,0,0,0,1|2,0,1]=4 2490 B12R1.27 COC(=O)\C=C\c1cccc[n]1 Amb25036096 [0,0,0,0,0,1|1,0,1]=3 2491 B12R1.27 COC(=O)\C=C\c1ccncc1 Amb10604946 [0,0,0,0,0,1|1,0,1]=3 2492 B12R1.27 COC(=O)\N=N\c1ccccc1 Amb25836861 [0,0,0,0,0,1|1,0,0]=2 2493 B12R1.27 COC(C)CNc1c[n]ccc1 Amb25359695 [0,0,0,0,0,1|2,0,1]=4 2494 B12R1.27 COC(C)CNc1cccc[n]1 Amb25689750 [0,0,0,0,0,1|2,0,1]=4 2495 B12R1.27 COC(C)CNc1ccccc1 Amb19025483 [0,0,0,0,0,1|1,0,1]=3 2496 B12R1.27 CSC(=N)NCc1ccccc1 Amb25760156 [0,0,0,0,0,1|1,1,0]=3 2497 B12R1.27 CSC(=O)NCc1ccccc1 Amb24495681 [0,0,0,0,0,1|0,1,0]=2 2498 B12R1.27 CSC(=S)NCc1cccnc1 Amb2445152 [0,0,0,0,0,1|1,2,0]=4 2499 B12R1.27 CSC(C)CNc1ccccc1 Amb18312645 [0,0,0,0,0,1|1,1,1]=4 2500 B12R1.27 CSC([S-])=NNc1ccccc1 Amb22446044 [0,0,0,0,0,1|1,2,0]=4 2501 B12R1.27 CSC([S-])=NNc1ccccc1 Amb22446069 [0,0,0,0,0,1|1,2,0]=4 2502 B12R1.27 C\C(\C=O)=C/Cc1ccccc1 Amb18645371 [0,0,0,0,0,1|3,0,0]=4 2503 B12R1.27 C\C(\C=O)=C\Cc1ccccc1 Amb24418390 [0,0,0,0,0,1|3,0,0]=4 2504 B12R1.27 C\C(\CCc1ccccc1)=N\O Amb24638706 [0,0,0,0,0,1|3,0,0]=4 2505 B12R1.27 C\C(\CCl)=C\Cc1ccccc1 Amb25279568 [0,0,0,0,0,1|3,0,0]=4 2506 B12R1.27 C\C(\CN)=C\Cc1ccccc1 Amb24438874 [0,0,0,0,0,1|3,0,0]=4 2507 B12R1.27 C\C(\CNc1ccccc1)=C\C Amb24636864 [0,0,0,0,0,1|2,0,0]=3 2508 B12R1.27 C\C(\COc1ccccc1)=C\Cl Amb25241242 [0,0,0,0,0,1|3,0,0]=4 2509 B12R1.27 C\C(\NCc1ccccc1)=N\O Amb25083251 [0,0,0,0,0,1|3,0,0]=4 2510 B12R1.27 C\N=C(\SCc1ccccc1)/N Amb11238902 [0,0,0,0,0,1|2,0,0]=3 2511 B12R1.27 ClCC(=O)CCc1ccccc1 Amb17139043 [0,0,0,0,0,1|2,0,0]=3 2512 B12R1.27 ClCC(=O)COc1ccccc1 Amb17139095 [0,0,0,0,0,1|2,0,0]=3 2513 B12R1.27 ClCC(=O)NCc1ccccn1 Amb1651007 [0,0,0,0,0,1|3,0,0]=4 2514 B12R1.27 ClCC(=O)\C=C\c1ccccc1 Amb17594640 [0,0,0,0,0,1|2,0,1]=4 2515 B12R1.27 Cl\C(\CCl)=C/Cc1ccccc1 Amb25803609 [0,0,0,0,0,1|3,0,0]=4 2516 B12R1.27 Cl\C(\CCl)=N/Cc1ccccc1 Amb24540801 [0,0,0,0,0,1|3,0,0]=4 2517 B12R1.27 Cl\C(\CSc1ccccc1)=C\Cl Amb24496037 [0,0,0,0,0,1|3,0,0]=4 2518 B12R1.27 N#CC(=O)C#Cc1ccccc1 Amb24736166 [0,0,0,0,0,1|2,0,1]=4 2519 B12R1.27 N#CC(=O)CCc1ccccc1 Amb25143496 [0,0,0,0,0,1|2,0,0]=3 2520 B12R1.27 N#CC(=O)\C=C\c1ccccc1 Amb10069227 [0,0,0,0,0,1|2,0,1]=4 2521 B12R1.27 N=C(CF)NCc1ccccc1 Amb24392158 [0,0,0,0,0,1|3,0,0]=4 2522 B12R1.27 N=C(CS)NCc1ccccc1 Amb24664256 [0,0,0,0,0,1|3,0,0]=4 2523 B12R1.27 NC(COc1ccccc1)=NN Amb18788366 [0,0,0,0,0,1|3,0,0]=4 2524 B12R1.27 NC(NCc1ccccc1)=NO Amb18800915 [0,0,0,0,0,1|3,0,0]=4 2525 B12R1.27 NCC(=O)CCc1ccccc1 Amb18563587 [0,0,0,0,0,1|2,0,0]=3 2526 B12R1.27 NCC(=O)NCc1c[n]ccc1 Amb21959050 [0,0,0,0,0,1|3,0,0]=4 2527 B12R1.27 NCC(=O)NCc1c[n]ccc1 Amb21987915 [0,0,0,0,0,1|3,0,0]=4 2528 B12R1.27 NCC(=O)NCc1cccc[n]1 Amb21959064 [0,0,0,0,0,1|3,0,0]=4 2529 B12R1.27 NCC(=O)NCc1ccncc1 Amb13951584 [0,0,0,0,0,1|3,0,0]=4 2530 B12R1.27 NCC(=O)NNc1ccccc1 Amb18646327 [0,0,0,0,0,1|3,0,0]=4 2531 B12R1.27 NCC(=O)OCc1ccccc1 Amb1207685 [0,0,0,0,0,1|2,0,0]=3 2532 B12R1.27 NCC(=O)OCc1ccccc1 Amb1808695 [0,0,0,0,0,1|2,0,0]=3 2533 B12R1.27 NCC(=O)OCc1ccccc1 Amb2228429 [0,0,0,0,0,1|2,0,0]=3 2534 B12R1.27 NCC(=O)\C=C\c1ccccc1 Amb18908593 [0,0,0,0,0,1|2,0,1]=4 2535 B12R1.27 NC\C(\F)=C\Cc1ccccc1 Amb24743578 [0,0,0,0,0,1|3,0,0]=4 2536 B12R1.27 NN=C([S-])SCc1ccccc1 Amb22446067 [0,0,0,0,0,1|2,1,0]=4 2537 B12R1.27 NNC(=O)C#Cc1ccccc1 Amb25701130 [0,0,0,0,0,1|2,0,1]=4 2538 B12R1.27 NNC(=O)CCc1cccc[n]1 Amb25299317 [0,0,0,0,0,1|3,0,0]=4 2539 B12R1.27 NNC(=O)CCc1ccccc1 Amb1130599 [0,0,0,0,0,1|2,0,0]=3 2540 B12R1.27 NNC(=O)CCc1ccncc1 Amb10553044 [0,0,0,0,0,1|3,0,0]=4 2541 B12R1.27 NNC(=O)CNc1cccc[n]1 Amb25187500 [0,0,0,0,0,1|3,0,0]=4 2542 B12R1.27 NNC(=O)CNc1ccccc1 Amb1104534 [0,0,0,0,0,1|2,0,0]=3 2543 B12R1.27 NNC(=O)CSc1ccccn1 Amb1060961 [0,0,0,0,0,1|3,0,0]=4 2544 B12R1.27 NNC(=O)SCc1ccccc1 Amb24423487 [0,0,0,0,0,1|2,0,0]=3 2545 B12R1.27 NNC(=O)\C=C\c1ccccc1 Amb25838381 [0,0,0,0,0,1|2,0,1]=4 2546 B12R1.27 NNC(=S)NCc1ccccc1 Amb1636204 [0,0,0,0,0,1|2,1,0]=4 2547 B12R1.27 N\C(\CCc1ccccc1)=N\N Amb18788201 [0,0,0,0,0,1|3,0,0]=4 2548 B12R1.27 N\C(\CCc1ccccc1)=N\O Amb22053006 [0,0,0,0,0,1|3,0,0]=4 2549 B12R1.27 N\C(\CNc1ccccc1)=N\O Amb24614329 [0,0,0,0,0,1|3,0,0]=4 2550 B12R1.27 O=C(C=O)OCc1ccccc1 Amb18645967 [0,0,0,0,0,1|2,0,0]=3 2551 B12R1.27 O=C(CBr)CCc1ccccc1 Amb20171375 [0,0,0,0,0,1|2,0,0]=3 2552 B12R1.27 O=C(CBr)COc1ccccc1 Amb20668077 [0,0,0,0,0,1|2,0,0]=3 2553 B12R1.27 O=C(CBr)NCc1cccc[n]1 Amb22587297 [0,0,0,0,0,1|3,0,0]=4 2554 B12R1.27 O=C(CCl)NCc1ccc[n]c1 Amb19373274 [0,0,0,0,0,1|3,0,0]=4 2555 B12R1.27 O=C(CCl)NNc1ccccc1 Amb22411427 [0,0,0,0,0,1|3,0,0]=4 2556 B12R1.27 O=C(CF)C#Cc1ccccc1 Amb25373340 [0,0,0,0,0,1|2,0,1]=4 2557 B12R1.27 O=C(CF)\C=C\c1ccccc1 Amb24572849 [0,0,0,0,0,1|2,0,1]=4 2558 B12R1.27 O=C(CI)NCc1ccccc1 Amb24084424 [0,0,0,0,0,1|2,0,0]=3 2559 B12R1.27 O=C(CI)OCc1ccccc1 Amb25144488 [0,0,0,0,0,1|2,0,0]=3 2560 B12R1.27 O=C(CS)NCc1cc[n]cc1 Amb24483850 [0,0,0,0,0,1|3,0,0]=4 2561 B12R1.27 O=C(CS)NCc1cccc[n]1 Amb25669641 [0,0,0,0,0,1|3,0,0]=4 2562 B12R1.27 O=C(NCl)NCc1ccccc1 Amb22735087 [0,0,0,0,0,1|2,0,0]=3 2563 B12R1.27 O=C(NCl)OCc1ccccc1 Amb21948731 [0,0,0,0,0,1|2,0,0]=3 2564 B12R1.27 O=C(\C=C\c1ccccc1)C=O Amb18126247 [0,0,0,0,0,1|2,0,1]=4 2565 B12R1.27 O=C\C(\F)=C/Cc1ccccc1 Amb24540284 [0,0,0,0,0,1|3,0,0]=4 2566 B12R1.27 OCC(=O)C#Cc1ccccc1 Amb25094460 [0,0,0,0,0,1|2,0,1]=4 2567 B12R1.27 OCC(=O)CCc1cc[n]cc1 Amb18563675 [0,0,0,0,0,1|3,0,0]=4 2568 B12R1.27 OCC(=O)CCc1ccc[n]c1 Amb18563674 [0,0,0,0,0,1|3,0,0]=4 2569 B12R1.27 OCC(=O)CCc1cccc[n]1 Amb18563673 [0,0,0,0,0,1|3,0,0]=4 2570 B12R1.27 OCC(=O)CCc1ccccc1 Amb18563609 [0,0,0,0,0,1|2,0,0]=3 2571 B12R1.27 OCC(=O)COc1ccccc1 Amb18563713 [0,0,0,0,0,1|2,0,0]=3 2572 B12R1.27 OCC(=O)NCc1ccccc1 Amb1111331 [0,0,0,0,0,1|2,0,0]=3 2573 B12R1.27 OCC(=O)NCc1ccccn1 Amb17334667 [0,0,0,0,0,1|3,0,0]=4 2574 B12R1.27 OCC(=O)NCc1cccnc1 Amb17334668 [0,0,0,0,0,1|3,0,0]=4 2575 B12R1.27 OCC(=O)NCc1ccncc1 Amb17334669 [0,0,0,0,0,1|3,0,0]=4 2576 B12R1.27 OCC(=O)\C=C\c1ccccc1 Amb25142729 [0,0,0,0,0,1|2,0,1]=4 2577 B12R1.27 OC\C(=C/Cc1ccccc1)\C Amb17594048 [0,0,0,0,0,1|3,0,0]=4 2578 B12R1.27 OC\C(\F)=C\Cc1ccccc1 Amb24661184 [0,0,0,0,0,1|3,0,0]=4 2579 B12R1.27 ONC(=O)CCc1cc[n]cc1 Amb24577197 [0,0,0,0,0,1|3,0,0]=4 2580 B12R1.27 ONC(=O)CCc1ccc[n]c1 Amb24413046 [0,0,0,0,0,1|3,0,0]=4 2581 B12R1.27 ONC(=O)CCc1cccc[n]1 Amb24703542 [0,0,0,0,0,1|3,0,0]=4 2582 B12R1.27 ONC(=O)OCc1ccccc1 Amb2445312 [0,0,0,0,0,1|2,0,0]=3 2583 B12R1.27 ONC(=S)NCc1ccccc1 Amb25823184 [0,0,0,0,0,1|2,1,0]=4 2584 B12R1.27 O\N=C(\CCc1ccccc1)/N Amb1115853 [0,0,0,0,0,1|3,0,0]=4 2585 B12R1.27 O\N=C(\COc1ccccc1)/N Amb1154723 [0,0,0,0,0,1|3,0,0]=4 2586 B12R1.27 [NH4]OP(=O)OCc1ccccc1 Amb22346178 [0,0,0,0,0,1|2,0,0]=3 2587 B12R1.1748 C=CC(=O)CC1C=CC=CC=C1 Amb25270988 [0,0,0,0,0,1|1,0,2]=4 2588 B12R1.1748 CCC(=O)CC1C=CC=CC=C1 Amb25730082 [0,0,0,0,0,1|1,0,1]=3 2589 B9R0.4 CC(=O)CS(=O)\C=C/C=C Amb24737497 [1,0,1,0,0,0|2,0,0]=4 2590 B9R0.4 CC(=O)NC(=O)\C=C\C=C Amb24682157 [1,0,1,0,0,0|2,0,0]=4 2591 B9R0.4 CC(=O)OC(=C)\C=C\C=O Amb24584495 [1,0,1,0,0,0|2,0,0]=4 2592 B9R0.4 C\C(=C\C(O)=O)\C=CC=C Amb25316740 [1,0,1,0,0,0|0,0,2]=4 2593 B9R0.4 C\C(=C\C(O)=O)\C=C\C=C Amb24746708 [1,0,1,0,0,0|0,0,2]=4 2594 B9R0.18 C\C=C\CC(=O)\C=C\C=C Amb24435526 [1,0,1,0,0,0|2,0,0]=4 2595 B9R0.34 COC(=O)CC(=O)CC=C Amb24456670 [1,0,1,0,0,0|1,0,1]=4 2596 B9R0.34 C\C(\CC(=O)OC)=C/C=O Amb24513732 [1,0,1,0,0,0|1,0,1]=4 2597 B9R0.46 CCC(=O)\C=C\C=C\C=O Amb24633418 [1,0,1,0,0,0|2,0,0]=4 2598 B9R0.46 CC\C=C/C=C/C(=O)OC Amb10067166 [1,0,1,0,0,0|0,0,2]=4 2599 B9R0.46 CC\C=C\C=CC(=O)OC Amb24606658 [1,0,1,0,0,0|0,0,2]=4 2600 B9R0.46 COC(=O)CC\C=C/C=O Amb24536495 [1,0,1,0,0,0|1,0,1]=4 2601 B9R0.46 COC(=O)CC\C=C\C=C Amb10605293 [1,0,1,0,0,0|0,0,1]=3 2602 B9R0.46 COC(=O)CC\C=C\C=O Amb18643849 [1,0,1,0,0,0|1,0,1]=4 2603 B9R0.46 COC(=O)CN\C=C\C=O Amb24566966 [1,0,1,0,0,0|2,0,0]=4 2604 B9R0.46 COC(=O)N\C=C/CC=C Amb24396233 [1,0,1,0,0,0|1,0,1]=4 2605 B9R0.46 COC(=O)\C=C/C=C/C=O Amb24663130 [1,0,1,0,0,0|1,0,0]=3 2606 B9R0.46 COC(=O)\C=C\C=C/C=O Amb25137299 [1,0,1,0,0,0|1,0,0]=3 2607 B9R0.46 COC(=O)\C=C\C=CC=O Amb25223129 [1,0,1,0,0,0|1,0,0]=3 2608 B9R0.46 COC(=O)\C=C\C=CCBr Amb25350207 [1,0,1,0,0,0|1,0,1]=4 2609 B9R0.46 COC(=O)\C=C\C=C\C=O Amb18643494 [1,0,1,0,0,0|1,0,0]=3 2610 B9R0.46 COC(=O)\C=C\NCC=C Amb24479656 [1,0,1,0,0,0|1,0,1]=4 2611 B9R0.46 C\C=C\C\C=C\C(=O)OC Amb22346863 [1,0,1,0,0,0|0,0,2]=4 2612 B9R0.14 C=CCC(CC(O)=O)C=C Amb18643594 [1,0,1,0,0,0|0,0,2]=4 2613 B9R0.2 C=CCC\C=C\CC(O)=O Amb18643551 [1,0,1,0,0,0|0,0,2]=4 2614 B9R0.2 C=CC\C=C\CCC(O)=O Amb18643540 [1,0,1,0,0,0|0,0,2]=4 2615 B9R0.2 C=C\C=C\CCCC(O)=O Amb25085778 [1,0,1,0,0,0|0,0,2]=4 2616 B9R0.2 CC(=O)CCC\C=C\C=C Amb25713959 [1,0,1,0,0,0|0,0,2]=4 2617 B9R0.2 CC(=O)CC\C=C\CC=C Amb25245400 [1,0,1,0,0,0|0,0,2]=4 2618 B9R0.2 CC(=O)N\C=C\C=CC=O Amb24629598 [1,0,1,0,0,0|2,0,0]=4 2619 B9R0.2 CC(=O)O\C=C\C=C\C=O Amb25311232 [1,0,1,0,0,0|2,0,0]=4 2620 B9R0.2 CC=CC=CC=CC(C)=O Amb25238403 [1,0,1,0,0,0|0,0,2]=4 2621 B9R0.2 CC=CC=CC=CC(O)=O Amb24561626 [1,0,1,0,0,0|0,0,2]=4 2622 B9R0.2 CC\C=C\C=C\CC(O)=O Amb18643575 [1,0,1,0,0,0|0,0,2]=4 2623 B9R0.2 CO\C=C\C=C\CC(O)=O Amb25213919 [1,0,1,0,0,0|1,0,1]=4 2624 B9R0.2 C\C=C\C=C\C=C/C(C)=O Amb25822807 [1,0,1,0,0,0|0,0,2]=4 2625 B9R0.2 C\C=C\C=C\C=C\C(C)=O Amb25185305 [1,0,1,0,0,0|0,0,2]=4 2626 B9R0.2 C\C=C\C=C\CCC(C)=O Amb24478389 [1,0,1,0,0,0|0,0,2]=4 2627 B9R0.2 C\C=C\C=C\CCC(O)=O Amb18643576 [1,0,1,0,0,0|0,0,2]=4 2628 B9R0.2 C\C=C\CC=CCC(O)=O Amb25076809 [1,0,1,0,0,0|0,0,2]=4 2629 B9R0.2 N#CC=C\C=C\CC(O)=O Amb24480438 [1,0,1,0,0,0|1,0,1]=4 2630 B9R0.2 OC(=O)C=CC=CC=CBr Amb25240084 [1,0,1,0,0,0|1,0,1]=4 2631 B9R0.2 OC(=O)\C=C\C=C\C=C\Br Amb25733431 [1,0,1,0,0,0|1,0,1]=4 2632 B9R1.8 BOCc1cccc[n]1 Amb24406683 [2,0,0,0,0,0|2,0,0]=4 2633 B9R1.8 Br[Mg]Cc1ccccc1 Amb20240676 [2,0,0,0,0,0|2,0,0]=4 2634 B9R1.8 Br[Zn]Cc1ccccc1 Amb22000396 [2,0,0,0,0,0|2,0,0]=4 2635 B9R1.8 Br\C=C/c1ccccc1 Amb24117456 [2,0,0,0,0,0|1,0,1]=4 2636 B9R1.8 C=CC[n+]1ccccc1 Amb10554482 [2,0,0,0,0,0|1,0,1]=4 2637 B9R1.8 C=CC[n+]1ccccc1 Amb10573243 [2,0,0,0,0,0|1,0,1]=4 2638 B9R1.8 C=CCc1c[n]ccc1 Amb24477831 [2,0,0,0,0,0|1,0,1]=4 2639 B9R1.8 C=CNc1ccccc1 Amb24476658 [2,0,0,0,0,0|1,0,1]=4 2640 B9R1.8 C=COc1ccccc1 Amb10564213 [2,0,0,0,0,0|1,0,1]=4 2641 B9R1.8 CCC[n+]1ccccc1 Amb24325390 [2,0,0,0,0,0|1,0,1]=4 2642 B9R1.8 CCCc1ccccc1 Amb2447143 [2,0,0,0,0,0|0,0,1]=3 2643 B9R1.8 CCNc1ccccc1 Amb22731692 [2,0,0,0,0,0|1,0,1]=4 2644 B9R1.8 CNCc1ccccn1 Amb10068750 [2,0,0,0,0,0|2,0,0]=4 2645 B9R1.8 CNCc1ccccn1 Amb10576408 [2,0,0,0,0,0|2,0,0]=4 2646 B9R1.8 CNCc1cccnc1 Amb10066918 [2,0,0,0,0,0|2,0,0]=4 2647 B9R1.8 CNCc1cccnc1 Amb10576409 [2,0,0,0,0,0|2,0,0]=4 2648 B9R1.8 CNCc1cccnc1 Amb1648828 [2,0,0,0,0,0|2,0,0]=4 2649 B9R1.8 CNCc1ccncc1 Amb10068773 [2,0,0,0,0,0|2,0,0]=4 2650 B9R1.8 CNCc1ccncc1 Amb10576211 [2,0,0,0,0,0|2,0,0]=4 2651 B9R1.8 CNCc1ccncc1 Amb1115812 [2,0,0,0,0,0|2,0,0]=4 2652 B9R1.8 CNNc1ccccc1 Amb20242875 [2,0,0,0,0,0|2,0,0]=4 2653 B9R1.8 CNSc1ccccc1 Amb25811332 [2,0,0,0,0,0|2,0,0]=4 2654 B9R1.8 COC[n+]1ccccc1 Amb25309455 [2,0,0,0,0,0|1,0,0]=3 2655 B9R1.8 COCc1c[n]cc[n]1 Amb24656513 [2,0,0,0,0,0|2,0,0]=4 2656 B9R1.8 COCc1c[n]ccc1 Amb24106446 [2,0,0,0,0,0|1,0,0]=3 2657 B9R1.8 COCc1cc[n]cc1 Amb24075931 [2,0,0,0,0,0|1,0,0]=3 2658 B9R1.8 COCc1ccc[n][n]1 Amb25178748 [2,0,0,0,0,0|2,0,0]=4 2659 B9R1.8 CONc1c[n]ccc1 Amb25347084 [2,0,0,0,0,0|2,0,0]=4 2660 B9R1.8 COPc1ccccc1 Amb22729661 [2,0,0,0,0,0|1,0,0]=3 2661 B9R1.8 CSCc1c[n]ccc1 Amb24523080 [2,0,0,0,0,0|1,1,0]=4 2662 B9R1.8 C[NH2+]Cc1ccccc1 Amb20648430 [2,0,0,0,0,0|1,0,0]=3 2663 B9R1.8 C\C=C/c1c[n]ccc1 Amb25147168 [2,0,0,0,0,0|1,0,1]=4 2664 B9R1.8 C\C=C/c1cc[n]cc1 Amb25064785 [2,0,0,0,0,0|1,0,1]=4 2665 B9R1.8 C\C=C\[n+]1ccccc1 Amb22485619 [2,0,0,0,0,0|1,0,1]=4 2666 B9R1.8 C\C=C\c1c[n]ccc1 Amb25290985 [2,0,0,0,0,0|1,0,1]=4 2667 B9R1.8 C\C=N\c1cccc[n]1 Amb24533295 [2,0,0,0,0,0|2,0,0]=4 2668 B9R1.8 C\N=C/c1cccc[n]1 Amb25337459 [2,0,0,0,0,0|2,0,0]=4 2669 B9R1.8 C\N=C\c1c[n]ccc1 Amb21962079 [2,0,0,0,0,0|2,0,0]=4 2670 B9R1.8 C\N=C\c1cc[n]cc1 Amb22330508 [2,0,0,0,0,0|2,0,0]=4 2671 B9R1.8 C\N=C\c1cccc[n]1 Amb24553183 [2,0,0,0,0,0|2,0,0]=4 2672 B9R1.8 ClC=Pc1ccccc1 Amb24480023 [2,0,0,0,0,0|2,0,0]=4 2673 B9R1.8 Cl[Hg]Cc1ccccc1 Amb22360147 [2,0,0,0,0,0|2,0,0]=4 2674 B9R1.8 Cl\C=C\c1ccccc1 Amb10572872 [2,0,0,0,0,0|1,0,1]=4 2675 B9R1.8 Cl\C=N\c1ccccc1 Amb24710175 [2,0,0,0,0,0|2,0,0]=4 2676 B9R1.8 F\C=C\c1ccccc1 Amb22641699 [2,0,0,0,0,0|1,0,1]=4 2677 B9R1.8 I[Hg]Cc1ccccc1 Amb22347189 [2,0,0,0,0,0|2,0,0]=4 2678 B9R1.8 I\C=C\c1ccccc1 Amb24646418 [2,0,0,0,0,0|1,0,1]=4 2679 B9R1.8 N#C[13CH2]c1ccccc1 Amb22337751 [2,0,0,0,0,0|1,0,1]=4 2680 B9R1.8 N#[13C]Cc1ccccc1 Amb22363279 [2,0,0,0,0,0|1,0,1]=4 2681 B9R1.8 N#[13C][13CH2]c1ccccc1 Amb22367491 [2,0,0,0,0,0|1,0,1]=4 2682 B9R1.8 NCCc1ccccc1 Amb17772283 [2,0,0,0,0,0|1,0,1]=4 2683 B9R1.8 NCCc1ccccc1 Amb17843439 [2,0,0,0,0,0|1,0,1]=4 2684 B9R1.8 NCCc1ccccc1 Amb22360716 [2,0,0,0,0,0|1,0,1]=4 2685 B9R1.8 NCCc1ccccc1 Amb24325112 [2,0,0,0,0,0|1,0,1]=4 2686 B9R1.8 NCCc1ccccc1 Amb24325408 [2,0,0,0,0,0|1,0,1]=4 2687 B9R1.8 NC[13CH2]c1ccccc1 Amb22367506 [2,0,0,0,0,0|1,0,1]=4 2688 B9R1.8 NNCc1ccccc1 Amb1105200 [2,0,0,0,0,0|2,0,0]=4 2689 B9R1.8 NNCc1ccccc1 Amb16231890 [2,0,0,0,0,0|2,0,0]=4 2690 B9R1.8 NNCc1ccccc1 Amb22492438 [2,0,0,0,0,0|2,0,0]=4 2691 B9R1.8 NOCc1c[n]ccc1 Amb22059440 [2,0,0,0,0,0|2,0,0]=4 2692 B9R1.8 NOCc1c[n]ccc1 Amb24074265 [2,0,0,0,0,0|2,0,0]=4 2693 B9R1.8 NOCc1cc[n]cc1 Amb22397036 [2,0,0,0,0,0|2,0,0]=4 2694 B9R1.8 NOCc1cccc[n]1 Amb18642195 [2,0,0,0,0,0|2,0,0]=4 2695 B9R1.8 NOCc1ccccc1 Amb1154307 [2,0,0,0,0,0|1,0,0]=3 2696 B9R1.8 NOCc1ccccc1 Amb16204809 [2,0,0,0,0,0|1,0,0]=3 2697 B9R1.8 NOCc1ccccc1 Amb22489499 [2,0,0,0,0,0|1,0,0]=3 2698 B9R1.8 N[13CH2][13CH2]c1ccccc1 Amb22367507 [2,0,0,0,0,0|1,0,1]=4 2699 B9R1.8 N\C=N\c1ccccc1 Amb10552787 [2,0,0,0,0,0|2,0,0]=4 2700 B9R1.8 N\N=C\c1ccccc1 Amb2539422 [2,0,0,0,0,0|2,0,0]=4 2701 B9R1.8 O=C=Cc1ccccc1 Amb25348365 [2,0,0,0,0,0|0,0,2]=4 2702 B9R1.8 O=C=Nc1ccccc1 Amb22336344 [2,0,0,0,0,0|1,0,1]=4 2703 B9R1.8 O=CCc1[n]ccc[n]1 Amb24061341 [2,0,0,0,0,0|2,0,0]=4 2704 B9R1.8 O=CCc1c[n]c[n]c1 Amb24634482 [2,0,0,0,0,0|2,0,0]=4 2705 B9R1.8 O=CCc1c[n]cc[n]1 Amb25124492 [2,0,0,0,0,0|2,0,0]=4 2706 B9R1.8 O=CCc1cc[n]c[n]1 Amb24099612 [2,0,0,0,0,0|2,0,0]=4 2707 B9R1.8 O=CCc1ccc[n][n]1 Amb24682971 [2,0,0,0,0,0|2,0,0]=4 2708 B9R1.8 O=CCc1ccccn1 Amb17089528 [2,0,0,0,0,0|1,0,0]=3 2709 B9R1.8 O=CCc1ccncc1 Amb17089529 [2,0,0,0,0,0|1,0,0]=3 2710 B9R1.8 O=COc1c[n]ccc1 Amb25299157 [2,0,0,0,0,0|2,0,0]=4 2711 B9R1.8 O=COc1ccccc1 Amb22002710 [2,0,0,0,0,0|1,0,0]=3 2712 B9R1.8 O=C\C=C/1\C=CC=CN1 Amb24068319 [2,0,0,0,0,0|1,0,1]=4 2713 B9R1.8 OCC[n+]1ccccc1 Amb22364462 [2,0,0,0,0,0|1,0,1]=4 2714 B9R1.8 OCCc1cc[n]cc1 Amb24325389 [2,0,0,0,0,0|1,0,1]=4 2715 B9R1.8 OCOc1ccccc1 Amb25847006 [2,0,0,0,0,0|1,0,1]=4 2716 B9R1.8 ONCc1c[n]ccc1 Amb25147084 [2,0,0,0,0,0|2,0,0]=4 2717 B9R1.8 ONCc1cc[n]cc1 Amb25851052 [2,0,0,0,0,0|2,0,0]=4 2718 B9R1.8 ONCc1ccccc1 Amb22001943 [2,0,0,0,0,0|1,0,0]=3 2719 B9R1.8 O\N=C\c1ccccc1 Amb2223191 [2,0,0,0,0,0|1,0,1]=4 2720 B9R1.8 S=C=Cc1ccccc1 Amb24084687 [2,0,0,0,0,0|2,0,0]=4 2721 B9R1.8 S=CNc1ccccc1 Amb25788857 [2,0,0,0,0,0|1,1,0]=4 2722 B9R1.8 [2H]\C=C/c1ccccc1 Amb22338396 [2,0,0,0,0,0|1,0,1]=4 2723 B9R1.8 [2H]\C=C\c1ccccc1 Amb22351848 [2,0,0,0,0,0|1,0,1]=4 2724 B9R1.8 [C-]#[N+]Cc1ccccc1 Amb2234859 [2,0,0,0,0,0|1,0,1]=4 2725 B9R1.8 [CH2-]\C=C\c1ccccc1 Amb22748801 [2,0,0,0,0,0|0,0,2]=4 2726 B9R1.8 [N-]=[N+]=Cc1ccccc1 Amb15692850 [2,0,0,0,0,0|2,0,0]=4 2727 B9R1.8 [NH3+]CCc1ccccc1 Amb17843435 [2,0,0,0,0,0|1,0,1]=4 2728 B11R0.4 CCOC(=O)C\C=C\C=C\C=C Amb17618812 [0,1,1,0,0,0|0,0,0]=2 2729 B11R1.1 CC=CCc1ccc(O)cc1 Amb24094301 [1,1,0,0,0,0|1,0,0]=3 2730 B11R1.1 CCCCc1ccc(F)cc1 Amb22730516 [1,1,0,0,0,0|1,0,1]=4 2731 B11R1.1 CCNCc1ccc(I)cc1 Amb25050868 [1,1,0,0,0,0|2,0,0]=4 2732 B11R1.1 CCNCc1ccc(cc1)O Amb13952053 [1,1,0,0,0,0|2,0,0]=4 2733 B11R1.1 CCOCc1ccc(Br)cc1 Amb19415022 [1,1,0,0,0,0|2,0,0]=4 2734 B11R1.1 CCOCc1ccc(O)cc1 Amb18125402 [1,1,0,0,0,0|2,0,0]=4 2735 B11R1.1 CCOCc1ccc(cc1)N Amb1125782 [1,1,0,0,0,0|2,0,0]=4 2736 B11R1.1 CCSCc1ccc(Br)cc1 Amb25684606 [1,1,0,0,0,0|2,0,0]=4 2737 B11R1.1 CCSCc1ccc(Cl)cc1 Amb24402210 [1,1,0,0,0,0|2,0,0]=4 2738 B11R1.1 CCSCc1ccc(F)cc1 Amb24486978 [1,1,0,0,0,0|2,0,0]=4 2739 B11R1.1 CCSCc1ccc(O)cc1 Amb18126551 [1,1,0,0,0,0|2,0,0]=4 2740 B11R1.1 CC\C=C/c1ccc(F)cc1 Amb24725207 [1,1,0,0,0,0|1,0,1]=4 2741 B11R1.1 CC\C=C\c1ccc(O)cc1 Amb24655008 [1,1,0,0,0,0|1,0,1]=4 2742 B11R1.1 CNCCc1ccc(N)cc1 Amb18290354 [1,1,0,0,0,0|1,0,1]=4 2743 B11R1.1 CNCCc1ccc(cc1)O Amb15690577 [1,1,0,0,0,0|1,0,1]=4 2744 B11R1.1 COCCN1C=CC(=O)C=C1 Amb24460542 [1,1,0,0,0,0|1,0,1]=4 2745 B11R1.1 COCCc1ccc(Cl)cc1 Amb24118075 [1,1,0,0,0,0|0,0,1]=3 2746 B11R1.1 COCCc1ccc(I)cc1 Amb25360538 [1,1,0,0,0,0|0,0,1]=3 2747 B11R1.1 COCCc1ccc(cc1)N Amb1139224 [1,1,0,0,0,0|0,0,1]=3 2748 B11R1.1 COCNc1ccc(F)cc1 Amb24070274 [1,1,0,0,0,0|1,0,1]=4 2749 B11R1.1 COCOc1ccc(Br)cc1 Amb22001005 [1,1,0,0,0,0|1,0,1]=4 2750 B11R1.1 COCOc1ccc(F)cc1 Amb22546791 [1,1,0,0,0,0|1,0,1]=4 2751 B11R1.1 COCOc1ccc(N)cc1 Amb24092674 [1,1,0,0,0,0|1,0,1]=4 2752 B11R1.1 COCOc1ccc(O)cc1 Amb25268752 [1,1,0,0,0,0|1,0,1]=4 2753 B11R1.1 COCSc1ccc(Br)cc1 Amb24473100 [1,1,0,0,0,0|1,0,1]=4 2754 B11R1.1 COCSc1ccc(Cl)cc1 Amb24393521 [1,1,0,0,0,0|1,0,1]=4 2755 B11R1.1 COCSc1ccc(N)cc1 Amb25714979 [1,1,0,0,0,0|1,0,1]=4 2756 B11R1.1 CONCc1ccc(Br)c[n]1 Amb25150275 [1,1,0,0,0,0|2,0,0]=4 2757 B11R1.1 CONCc1ccc(Br)cc1 Amb25151171 [1,1,0,0,0,0|1,0,0]=3 2758 B11R1.1 CONCc1ccc(Cl)[n]c1 Amb24719275 [1,1,0,0,0,0|2,0,0]=4 2759 B11R1.1 CONCc1ccc(O)c[n]1 Amb25294834 [1,1,0,0,0,0|2,0,0]=4 2760 B11R1.1 CONCc1ccc(O)cc1 Amb24383951 [1,1,0,0,0,0|1,0,0]=3 2761 B11R1.1 CO\C=C\c1ccc(Br)cc1 Amb21962688 [1,1,0,0,0,0|0,0,1]=3 2762 B11R1.1 CO\C=C\c1ccc(O)cc1 Amb25231662 [1,1,0,0,0,0|0,0,1]=3 2763 B11R1.1 CO\C=N\c1ccc(Cl)cc1 Amb21936899 [1,1,0,0,0,0|1,0,0]=3 2764 B11R1.1 CO\C=N\c1ccc(F)cc1 Amb21936897 [1,1,0,0,0,0|1,0,0]=3 2765 B11R1.1 CO\N=C\c1ccc(Cl)cc1 Amb24673208 [1,1,0,0,0,0|1,0,1]=4 2766 B11R1.1 CO\N=C\c1ccc(F)cc1 Amb24528867 [1,1,0,0,0,0|1,0,1]=4 2767 B11R1.1 CO\N=C\c1ccc(O)cc1 Amb25370742 [1,1,0,0,0,0|1,0,1]=4 2768 B11R1.1 CSCCc1ccc(N)cc1 Amb18971649 [1,1,0,0,0,0|0,1,1]=4 2769 B11R1.1 C\C=C/Oc1ccc(N)cc1 Amb24103180 [1,1,0,0,0,0|2,0,0]=4 2770 B11R1.1 C\C=C\C[n+]1ccc(C)cc1 Amb25381025 [1,1,0,0,0,0|2,0,0]=4 2771 B11R1.1 C\C=C\Cc1ccc(N)cc1 Amb22751067 [1,1,0,0,0,0|1,0,0]=3 2772 B11R1.1 C\C=C\Cc1ccc(O)cc1 Amb18124917 [1,1,0,0,0,0|1,0,0]=3 2773 B11R1.1 C\C=C\Nc1ccc(F)cc1 Amb24070275 [1,1,0,0,0,0|2,0,0]=4 2774 B11R1.1 C\N=C\Nc1ccc(Cl)cc1 Amb25294306 [1,1,0,0,0,0|2,0,0]=4 2775 B11R1.1 Cc1ccc(CCCC)cc1 Amb22002059 [1,1,0,0,0,0|1,0,1]=4 2776 B11R1.1 Cc1ccc(CSCC)cc1 Amb24536616 [1,1,0,0,0,0|2,0,0]=4 2777 B11R1.1 Cc1ccc(C\C=C\Br)cc1 Amb25720563 [1,1,0,0,0,0|2,0,0]=4 2778 B11R1.1 Cc1ccc(c[n]1)\C=C\OC Amb25201672 [1,1,0,0,0,0|1,0,1]=4 2779 B11R1.1 Cc1ccc(cc1)NCOC Amb25301269 [1,1,0,0,0,0|1,0,1]=4 2780 B11R1.1 Cc1ccc(cc1)OCOC Amb20241783 [1,1,0,0,0,0|1,0,1]=4 2781 B11R1.1 Cc1ccc(cc1)SCOC Amb25032720 [1,1,0,0,0,0|1,0,1]=4 2782 B11R1.1 Cc1ccc(cc1)\N=C\OC Amb21936895 [1,1,0,0,0,0|1,0,0]=3 2783 B11R1.1 NOCCc1ccc(F)cc1 Amb22896631 [1,1,0,0,0,0|1,0,1]=4 2784 B11R1.1 NOCCc1ccc(O)cc1 Amb25053130 [1,1,0,0,0,0|1,0,1]=4 2785 B11R1.1 Oc1ccc(C\C=C\Cl)cc1 Amb25724911 [1,1,0,0,0,0|2,0,0]=4 2786 B11R1.1 Oc1ccc(C\C=N\O)cc1 Amb25705671 [1,1,0,0,0,0|2,0,0]=4 2787 B11R1.16 C=C=CC(O)c1ccccc1 Amb25198813 [1,1,0,0,0,0|1,0,1]=4 2788 B11R1.16 C=C=C[C@@H](O)c1ccccc1 Amb25045780 [1,1,0,0,0,0|1,0,1]=4 2789 B11R1.16 CC#CC(N)c1ccccc1 Amb25113894 [1,1,0,0,0,0|1,0,1]=4 2790 B11R1.16 CC#CC(O)c1ccccc1 Amb25148346 [1,1,0,0,0,0|1,0,1]=4 2791 B11R1.16 CC#C[C@@H](O)c1ccccc1 Amb25188578 [1,1,0,0,0,0|1,0,1]=4 2792 B11R1.16 CC(=CCC)c1ccccc1 Amb22228912 [1,1,0,0,0,0|1,0,1]=4 2793 B11R1.16 CC(\C=C\Cl)c1ccccc1 Amb24710339 [1,1,0,0,0,0|2,0,0]=4 2794 B11R1.16 CC(\C=N\N)c1ccccc1 Amb24412748 [1,1,0,0,0,0|2,0,0]=4 2795 B11R1.16 CC=CC(O)c1ccccc1 Amb22228005 [1,1,0,0,0,0|1,0,0]=3 2796 B11R1.16 CCCC(c1ccccc1)[NH3+] Amb10560246 [1,1,0,0,0,0|1,0,1]=4 2797 B11R1.16 CCC[C@@H](N)c1ccccc1 Amb22388605 [1,1,0,0,0,0|1,0,1]=4 2798 B11R1.16 CCC[C@@H](O)c1ccccc1 Amb22338826 [1,1,0,0,0,0|1,0,1]=4 2799 B11R1.16 CCC[C@H](N)c1ccccc1 Amb20241164 [1,1,0,0,0,0|1,0,1]=4 2800 B11R1.16 CCC[C@H](N)c1ccccc1 Amb23385315 [1,1,0,0,0,0|1,0,1]=4 2801 B11R1.16 CCC[C@H](O)c1ccccc1 Amb22338698 [1,1,0,0,0,0|1,0,1]=4 2802 B11R1.16 CCC[C@H](c1ccccc1)N Amb16233791 [1,1,0,0,0,0|1,0,1]=4 2803 B11R1.16 CCNC(c1ccccc1)C Amb1771733 [1,1,0,0,0,0|2,0,0]=4 2804 B11R1.16 CCN[C@H](C)c1ccccc1 Amb24363134 [1,1,0,0,0,0|2,0,0]=4 2805 B11R1.16 CCOC(C)c1ccccc1 Amb17940188 [1,1,0,0,0,0|2,0,0]=4 2806 B11R1.16 CCOC(Cl)c1ccccc1 Amb24419639 [1,1,0,0,0,0|2,0,0]=4 2807 B11R1.16 CCSC(Cl)c1ccccc1 Amb25109977 [1,1,0,0,0,0|2,0,0]=4 2808 B11R1.16 CNCC(Br)c1ccccc1 Amb25224394 [1,1,0,0,0,0|1,0,1]=4 2809 B11R1.16 CNCC(F)c1ccccc1 Amb24710254 [1,1,0,0,0,0|1,0,1]=4 2810 B11R1.16 CNCC(N)c1ccccc1 Amb18290185 [1,1,0,0,0,0|1,0,1]=4 2811 B11R1.16 CNCC(S)c1ccccc1 Amb25685409 [1,1,0,0,0,0|1,0,1]=4 2812 B11R1.16 CNCC(c1ccccc1)C Amb17619365 [1,1,0,0,0,0|1,0,1]=4 2813 B11R1.16 CNCC(c1ccccc1)N Amb13883001 [1,1,0,0,0,0|1,0,1]=4 2814 B11R1.16 CNC[C@@H](N)c1ccccc1 Amb24487965 [1,1,0,0,0,0|1,0,1]=4 2815 B11R1.16 CNC[C@H](C)c1ccccc1 Amb24399611 [1,1,0,0,0,0|1,0,1]=4 2816 B11R1.16 CNC[C@H](N)c1ccccc1 Amb25040662 [1,1,0,0,0,0|1,0,1]=4 2817 B11R1.16 CNC[C@H](O)c1ccccc1 Amb25674653 [1,1,0,0,0,0|1,0,1]=4 2818 B11R1.16 CNNC(Br)c1ccccc1 Amb24643804 [1,1,0,0,0,0|2,0,0]=4 2819 B11R1.16 COCC(Br)c1cccc[n]1 Amb24469291 [1,1,0,0,0,0|1,0,1]=4 2820 B11R1.16 COCC(C)c1ccccc1 Amb24079980 [1,1,0,0,0,0|0,0,1]=3 2821 B11R1.16 COCC(Cl)c1ccccc1 Amb24509304 [1,1,0,0,0,0|0,0,1]=3 2822 B11R1.16 COCC(N)c1c[n]ccc1 Amb18292631 [1,1,0,0,0,0|1,0,1]=4 2823 B11R1.16 COCC(O)c1c[n]ccc1 Amb18179473 [1,1,0,0,0,0|1,0,1]=4 2824 B11R1.16 COCC(O)c1ccccc1 Amb18791504 [1,1,0,0,0,0|0,0,1]=3 2825 B11R1.16 COCC(S)c1ccccc1 Amb25698414 [1,1,0,0,0,0|0,0,1]=3 2826 B11R1.16 COCC(c1ccccc1)N Amb1134749 [1,1,0,0,0,0|0,0,1]=3 2827 B11R1.16 COCC(c1ccccc1)N Amb13952604 [1,1,0,0,0,0|0,0,1]=3 2828 B11R1.16 COCC(c1ccccn1)N Amb10607922 [1,1,0,0,0,0|1,0,1]=4 2829 B11R1.16 COCC(c1ccccn1)N Amb13949181 [1,1,0,0,0,0|1,0,1]=4 2830 B11R1.16 COC[C@@H](N)c1c[n]ccc1 Amb24351094 [1,1,0,0,0,0|1,0,1]=4 2831 B11R1.16 COC[C@@H](N)c1cc[n]cc1 Amb24428710 [1,1,0,0,0,0|1,0,1]=4 2832 B11R1.16 COC[C@@H](N)c1cccc[n]1 Amb25104762 [1,1,0,0,0,0|1,0,1]=4 2833 B11R1.16 COC[C@@H](O)c1ccccc1 Amb22746575 [1,1,0,0,0,0|0,0,1]=3 2834 B11R1.16 COC[C@H](N)c1c[n]ccc1 Amb24533043 [1,1,0,0,0,0|1,0,1]=4 2835 B11R1.16 COC[C@H](N)c1ccccc1 Amb22737495 [1,1,0,0,0,0|0,0,1]=3 2836 B11R1.16 COC[C@H](c1ccccc1)N Amb17061641 [1,1,0,0,0,0|0,0,1]=3 2837 B11R1.16 CONC(=O)c1ccccc1 Amb16969913 [1,1,0,0,0,0|1,0,1]=4 2838 B11R1.16 CONC(C)c1cccc[n]1 Amb25793754 [1,1,0,0,0,0|2,0,0]=4 2839 B11R1.16 CONC(C)c1ccccc1 Amb22896960 [1,1,0,0,0,0|1,0,0]=3 2840 B11R1.16 CO\N=C(/N)\c1ccccc1 Amb18224270 [1,1,0,0,0,0|1,0,1]=4 2841 B11R1.16 CO\N=C(\c1ccccc1)/C Amb10572535 [1,1,0,0,0,0|1,0,1]=4 2842 B11R1.16 CSCC(C)c1ccccc1 Amb25143821 [1,1,0,0,0,0|0,1,1]=4 2843 B11R1.16 CSCC(N)c1ccccc1 Amb18300065 [1,1,0,0,0,0|0,1,1]=4 2844 B11R1.16 CSCC(O)c1ccccc1 Amb18793198 [1,1,0,0,0,0|0,1,1]=4 2845 B11R1.16 CSC[C@@H](N)c1ccccc1 Amb25368447 [1,1,0,0,0,0|0,1,1]=4 2846 B11R1.16 C\C(=C/CC)\c1ccccc1 Amb25151168 [1,1,0,0,0,0|1,0,1]=4 2847 B11R1.16 C\C(=N\OC)\c1ccccc1 Amb25189562 [1,1,0,0,0,0|1,0,1]=4 2848 B11R1.16 C\C=C/C(O)c1c[n]ccc1 Amb25241944 [1,1,0,0,0,0|2,0,0]=4 2849 B11R1.16 C\C=C\C(=O)c1ccccc1 Amb10574126 [1,1,0,0,0,0|1,0,1]=4 2850 B11R1.16 C\C=C\C(C)c1cc[n]cc1 Amb24571960 [1,1,0,0,0,0|2,0,0]=4 2851 B11R1.16 C\C=C\C(N)c1ccccc1 Amb18124850 [1,1,0,0,0,0|1,0,0]=3 2852 B11R1.16 C\C=C\C(O)c1cccc[n]1 Amb24431006 [1,1,0,0,0,0|2,0,0]=4 2853 B11R1.16 C\C=C\[C@@H](O)c1ccccc1 Amb25760539 [1,1,0,0,0,0|1,0,0]=3 2854 B11R1.16 C\C=C\[C@H](O)c1ccccc1 Amb25190477 [1,1,0,0,0,0|1,0,0]=3 2855 B11R1.16 Cl\C=C\C(Cl)c1ccccc1 Amb24634048 [1,1,0,0,0,0|2,0,0]=4 2856 B11R1.16 NOCC(c1ccccc1)O Amb17334342 [1,1,0,0,0,0|1,0,1]=4 2857 B11R1.16 NOC[C@@H](O)c1ccccc1 Amb25152160 [1,1,0,0,0,0|1,0,1]=4 2858 B11R1.16 O\N=C\C(O)c1ccccc1 Amb25149681 [1,1,0,0,0,0|2,0,0]=4 2859 B11R1.17 CC=CCc1ccccc1O Amb24089583 [1,1,0,0,0,0|1,0,0]=3 2860 B11R1.17 CCCCc1ccccc1Br Amb15690808 [1,1,0,0,0,0|1,0,1]=4 2861 B11R1.17 CCCCc1ccccc1F Amb24426932 [1,1,0,0,0,0|1,0,1]=4 2862 B11R1.17 CCCCc1ccccc1O Amb25744605 [1,1,0,0,0,0|1,0,1]=4 2863 B11R1.17 CCNCc1ccccc1I Amb21861742 [1,1,0,0,0,0|2,0,0]=4 2864 B11R1.17 CCOCc1ccccc1Br Amb22227882 [1,1,0,0,0,0|2,0,0]=4 2865 B11R1.17 CCOCc1ccccc1O Amb10560038 [1,1,0,0,0,0|2,0,0]=4 2866 B11R1.17 CCSCc1ccccc1Br Amb22228180 [1,1,0,0,0,0|2,0,0]=4 2867 B11R1.17 CCSCc1ccccc1Cl Amb25676288 [1,1,0,0,0,0|2,0,0]=4 2868 B11R1.17 CCSCc1ccccc1O Amb18126550 [1,1,0,0,0,0|2,0,0]=4 2869 B11R1.17 CC\C=C/c1ccccc1O Amb25713551 [1,1,0,0,0,0|1,0,1]=4 2870 B11R1.17 CC\C=C\c1ccccc1N Amb22751020 [1,1,0,0,0,0|1,0,1]=4 2871 B11R1.17 CC\C=C\c1ccccc1O Amb18124914 [1,1,0,0,0,0|1,0,1]=4 2872 B11R1.17 CC\C=N\c1ccccc1N Amb24060501 [1,1,0,0,0,0|2,0,0]=4 2873 B11R1.17 CC\C=N\c1ccccc1O Amb24486452 [1,1,0,0,0,0|2,0,0]=4 2874 B11R1.17 CNCCc1ccccc1Br Amb18299468 [1,1,0,0,0,0|1,0,1]=4 2875 B11R1.17 CNCCc1ccccc1N Amb24106838 [1,1,0,0,0,0|1,0,1]=4 2876 B11R1.17 CNCCc1ccccc1O Amb18560895 [1,1,0,0,0,0|1,0,1]=4 2877 B11R1.17 COCC[n+]1ccccc1Br Amb25072030 [1,1,0,0,0,0|1,0,1]=4 2878 B11R1.17 COCC[n+]1ccccc1C Amb24685943 [1,1,0,0,0,0|1,0,1]=4 2879 B11R1.17 COCCc1c[n]ccc1N Amb25209393 [1,1,0,0,0,0|1,0,1]=4 2880 B11R1.17 COCCc1cccc[n+]1[O-] Amb10573566 [1,1,0,0,0,0|1,0,1]=4 2881 B11R1.17 COCCc1ccccc1Cl Amb24518157 [1,1,0,0,0,0|0,0,1]=3 2882 B11R1.17 COCCc1ccccc1I Amb24483388 [1,1,0,0,0,0|0,0,1]=3 2883 B11R1.17 COCCc1ccccc1N Amb18992153 [1,1,0,0,0,0|0,0,1]=3 2884 B11R1.17 COCCc1ccccc1O Amb22055702 [1,1,0,0,0,0|0,0,1]=3 2885 B11R1.17 COCCn1ccccc1=O Amb10707822 [1,1,0,0,0,0|1,0,1]=4 2886 B11R1.17 COCNc1ccccc1F Amb24084241 [1,1,0,0,0,0|1,0,1]=4 2887 B11R1.17 COCOc1ccccc1Br Amb21912438 [1,1,0,0,0,0|1,0,1]=4 2888 B11R1.17 COCOc1ccccc1C Amb10559613 [1,1,0,0,0,0|1,0,1]=4 2889 B11R1.17 COCOc1ccccc1Cl Amb25840223 [1,1,0,0,0,0|1,0,1]=4 2890 B11R1.17 COCOc1ccccc1F Amb22546792 [1,1,0,0,0,0|1,0,1]=4 2891 B11R1.17 COCOc1ccccc1I Amb22284514 [1,1,0,0,0,0|1,0,1]=4 2892 B11R1.17 COCOc1ccccc1N Amb23599107 [1,1,0,0,0,0|1,0,1]=4 2893 B11R1.17 COCOc1ccccc1O Amb24486480 [1,1,0,0,0,0|1,0,1]=4 2894 B11R1.17 COCSc1ccccc1N Amb17305638 [1,1,0,0,0,0|1,0,1]=4 2895 B11R1.17 CONCc1[n]cccc1Br Amb25117557 [1,1,0,0,0,0|2,0,0]=4 2896 B11R1.17 CONCc1cc[n]cc1Cl Amb25845709 [1,1,0,0,0,0|2,0,0]=4 2897 B11R1.17 CONCc1ccccc1F Amb24725975 [1,1,0,0,0,0|1,0,0]=3 2898 B11R1.17 CONCc1ccccc1O Amb24432475 [1,1,0,0,0,0|1,0,0]=3 2899 B11R1.17 CO\C=C/c1ccccc1O Amb24485852 [1,1,0,0,0,0|0,0,1]=3 2900 B11R1.17 CO\C=C\c1c[n]ccc1Br Amb24756801 [1,1,0,0,0,0|1,0,1]=4 2901 B11R1.17 CO\C=C\c1ccccc1Cl Amb25802000 [1,1,0,0,0,0|0,0,1]=3 2902 B11R1.17 CO\C=C\c1ccccc1O Amb25715988 [1,1,0,0,0,0|0,0,1]=3 2903 B11R1.17 CO\N=C/c1ccccc1F Amb24068859 [1,1,0,0,0,0|1,0,1]=4 2904 B11R1.17 CO\N=C/c1ccccc1N Amb24106779 [1,1,0,0,0,0|1,0,1]=4 2905 B11R1.17 CO\N=C\c1ccccc1Cl Amb24430655 [1,1,0,0,0,0|1,0,1]=4 2906 B11R1.17 CO\N=C\c1ccccc1F Amb25098221 [1,1,0,0,0,0|1,0,1]=4 2907 B11R1.17 CO\N=C\c1ccccc1N Amb24605335 [1,1,0,0,0,0|1,0,1]=4 2908 B11R1.17 CO\N=C\c1ccccc1O Amb25740232 [1,1,0,0,0,0|1,0,1]=4 2909 B11R1.17 CSCCc1ccccc1Cl Amb25222784 [1,1,0,0,0,0|0,1,1]=4 2910 B11R1.17 CSCCc1ccccc1N Amb18299122 [1,1,0,0,0,0|0,1,1]=4 2911 B11R1.17 CS\C=C/c1ccccc1N Amb18646409 [1,1,0,0,0,0|0,1,1]=4 2912 B11R1.17 CS\C=C\c1ccccc1O Amb18646619 [1,1,0,0,0,0|0,1,1]=4 2913 B11R1.17 C\C=C/Cc1ccccc1O Amb25345359 [1,1,0,0,0,0|1,0,0]=3 2914 B11R1.17 C\C=C\CC1=CC=CNC1=O Amb24411454 [1,1,0,0,0,0|2,0,0]=4 2915 B11R1.17 C\C=C\C[n+]1ccccc1F Amb24343539 [1,1,0,0,0,0|2,0,0]=4 2916 B11R1.17 C\C=C\Cc1ccccc1N Amb18644343 [1,1,0,0,0,0|1,0,0]=3 2917 B11R1.17 C\C=C\Oc1ccccc1O Amb25143344 [1,1,0,0,0,0|2,0,0]=4 2918 B11R1.17 C\N=C\Cc1ccccc1O Amb25844316 [1,1,0,0,0,0|1,0,0]=3 2919 B11R1.17 Cc1c[n]ccc1CCOC Amb24577461 [1,1,0,0,0,0|1,0,1]=4 2920 B11R1.17 Cc1c[n]ccc1CNOC Amb25262602 [1,1,0,0,0,0|2,0,0]=4 2921 B11R1.17 Cc1ccc[n]c1C\C=C/C Amb24101994 [1,1,0,0,0,0|2,0,0]=4 2922 B11R1.17 Cc1ccccc1CCCC Amb25825024 [1,1,0,0,0,0|1,0,1]=4 2923 B11R1.17 Cc1ccccc1CCNC Amb19959980 [1,1,0,0,0,0|1,0,1]=4 2924 B11R1.17 Cc1ccccc1CSCC Amb24690023 [1,1,0,0,0,0|2,0,0]=4 2925 B11R1.17 Cc1ccccc1C\C=C\Cl Amb25109327 [1,1,0,0,0,0|2,0,0]=4 2926 B11R1.17 Cc1ccccc1NCOC Amb25690923 [1,1,0,0,0,0|1,0,1]=4 2927 B11R1.17 Cc1ccccc1\N=C\NC Amb25312744 [1,1,0,0,0,0|2,0,0]=4 2928 B11R1.17 NOCCc1ccccc1Br Amb18657908 [1,1,0,0,0,0|1,0,1]=4 2929 B11R1.17 NOCCc1ccccc1Cl Amb18647570 [1,1,0,0,0,0|1,0,1]=4 2930 B11R1.17 NOCCc1ccccc1F Amb22896629 [1,1,0,0,0,0|1,0,1]=4 2931 B11R1.17 O\N=C/Cc1ccccc1F Amb24100286 [1,1,0,0,0,0|2,0,0]=4 2932 B11R1.17 O\N=C\Cc1ccccc1F Amb25206635 [1,1,0,0,0,0|2,0,0]=4 2933 B11R1.17 Oc1ccccc1C\C=C/Cl Amb24578313 [1,1,0,0,0,0|2,0,0]=4 2934 B11R1.17 Oc1ccccc1C\C=C\Cl Amb18647090 [1,1,0,0,0,0|2,0,0]=4 2935 B11R1.24 CCCCc1cccc(Br)c1 Amb19944057 [1,1,0,0,0,0|1,0,1]=4 2936 B11R1.24 CCCCc1cccc(I)c1 Amb19944046 [1,1,0,0,0,0|1,0,1]=4 2937 B11R1.24 CCCCc1cccc(S)c1 Amb24415059 [1,1,0,0,0,0|1,0,1]=4 2938 B11R1.24 CCCCc1cccc(c1)N Amb17593719 [1,1,0,0,0,0|1,0,1]=4 2939 B11R1.24 CCNCc1cc(I)ccc1 Amb24066806 [1,1,0,0,0,0|2,0,0]=4 2940 B11R1.24 CCNCc1cc(I)ccc1 Amb24066807 [1,1,0,0,0,0|2,0,0]=4 2941 B11R1.24 CCNCc1cc(N)ccc1 Amb18290000 [1,1,0,0,0,0|2,0,0]=4 2942 B11R1.24 CCNCc1cc(S)ccc1 Amb25705598 [1,1,0,0,0,0|2,0,0]=4 2943 B11R1.24 CCNCc1cccc(c1)Br Amb13949217 [1,1,0,0,0,0|2,0,0]=4 2944 B11R1.24 CCOCc1cc(Br)ccc1 Amb23512545 [1,1,0,0,0,0|2,0,0]=4 2945 B11R1.24 CCOCc1cc(Cl)ccc1 Amb24486866 [1,1,0,0,0,0|2,0,0]=4 2946 B11R1.24 CCOCc1cc(O)ccc1 Amb23443319 [1,1,0,0,0,0|2,0,0]=4 2947 B11R1.24 CCSCc1cc(Br)ccc1 Amb24476579 [1,1,0,0,0,0|2,0,0]=4 2948 B11R1.24 CCSCc1cc(O)ccc1 Amb18126555 [1,1,0,0,0,0|2,0,0]=4 2949 B11R1.24 CC\C=C\c1cccc(Br)c1 Amb25132907 [1,1,0,0,0,0|1,0,1]=4 2950 B11R1.24 CC\C=C\c1cccc(c1)O Amb16231489 [1,1,0,0,0,0|1,0,1]=4 2951 B11R1.24 CNCCc1cccc(I)c1 Amb25187651 [1,1,0,0,0,0|1,0,1]=4 2952 B11R1.24 CNCCc1cccc(N)c1 Amb18550411 [1,1,0,0,0,0|1,0,1]=4 2953 B11R1.24 CNCCc1cccc(O)c1 Amb18560894 [1,1,0,0,0,0|1,0,1]=4 2954 B11R1.24 CNCCc1cccc(c1)Br Amb16230486 [1,1,0,0,0,0|1,0,1]=4 2955 B11R1.24 CNCCc1cccc(c1)C Amb16230487 [1,1,0,0,0,0|1,0,1]=4 2956 B11R1.24 CNNCc1cccc(Cl)c1 Amb22469834 [1,1,0,0,0,0|2,0,0]=4 2957 B11R1.24 COCCC1=CC=CC(=O)N1 Amb24485973 [1,1,0,0,0,0|1,0,1]=4 2958 B11R1.24 COCC[n+]1cc(C)ccc1 Amb25127531 [1,1,0,0,0,0|1,0,1]=4 2959 B11R1.24 COCC[n+]1cc(O)ccc1 Amb25822049 [1,1,0,0,0,0|1,0,1]=4 2960 B11R1.24 COCCc1c[n]cc(N)c1 Amb23570649 [1,1,0,0,0,0|1,0,1]=4 2961 B11R1.24 COCCc1cc(Br)cc[n]1 Amb25735992 [1,1,0,0,0,0|1,0,1]=4 2962 B11R1.24 COCCc1cccc(Br)[n]1 Amb25194969 [1,1,0,0,0,0|1,0,1]=4 2963 B11R1.24 COCCc1cccc(N)c1 Amb24373231 [1,1,0,0,0,0|0,0,1]=3 2964 B11R1.24 COCCc1cccc(O)c1 Amb22055706 [1,1,0,0,0,0|0,0,1]=3 2965 B11R1.24 COCCc1nccc(c1)C Amb10573767 [1,1,0,0,0,0|1,0,1]=4 2966 B11R1.24 COCNc1cccc(F)c1 Amb24102182 [1,1,0,0,0,0|1,0,1]=4 2967 B11R1.24 COCOc1cc(Br)ccc1 Amb25810590 [1,1,0,0,0,0|1,0,1]=4 2968 B11R1.24 COCOc1cc(Cl)ccc1 Amb24551706 [1,1,0,0,0,0|1,0,1]=4 2969 B11R1.24 COCOc1cc(F)ccc1 Amb21858121 [1,1,0,0,0,0|1,0,1]=4 2970 B11R1.24 COCOc1cc(N)ccc1 Amb25096531 [1,1,0,0,0,0|1,0,1]=4 2971 B11R1.24 COCSc1cccc(Cl)c1 Amb24706398 [1,1,0,0,0,0|1,0,1]=4 2972 B11R1.24 COCSc1cccc(N)c1 Amb24532948 [1,1,0,0,0,0|1,0,1]=4 2973 B11R1.24 CONCc1c[n]cc(Br)c1 Amb25771235 [1,1,0,0,0,0|2,0,0]=4 2974 B11R1.24 CONCc1c[n]cc(F)c1 Amb25678431 [1,1,0,0,0,0|2,0,0]=4 2975 B11R1.24 CONCc1cc(O)cc[n]1 Amb24721560 [1,1,0,0,0,0|2,0,0]=4 2976 B11R1.24 CONCc1cc[n]c(Cl)c1 Amb24430811 [1,1,0,0,0,0|2,0,0]=4 2977 B11R1.24 CONCc1cc[n]c(N)c1 Amb25345638 [1,1,0,0,0,0|2,0,0]=4 2978 B11R1.24 CONCc1cccc(I)c1 Amb25719180 [1,1,0,0,0,0|1,0,0]=3 2979 B11R1.24 CO\C=C/c1cccc(F)c1 Amb25837369 [1,1,0,0,0,0|0,0,1]=3 2980 B11R1.24 CO\C=C\c1cccc(O)c1 Amb25373359 [1,1,0,0,0,0|0,0,1]=3 2981 B11R1.24 CO\N=C/c1cccc(F)c1 Amb24068856 [1,1,0,0,0,0|1,0,1]=4 2982 B11R1.24 CO\N=C\c1cccc(N)c1 Amb24105789 [1,1,0,0,0,0|1,0,1]=4 2983 B11R1.24 CO\N=C\c1cccc(O)c1 Amb25262276 [1,1,0,0,0,0|1,0,1]=4 2984 B11R1.24 CSCCc1cccc(N)c1 Amb25364016 [1,1,0,0,0,0|0,1,1]=4 2985 B11R1.24 C\C=C\C[n+]1cc(O)ccc1 Amb25777709 [1,1,0,0,0,0|2,0,0]=4 2986 B11R1.24 Cc1c[n]cc(CNOC)c1 Amb25148070 [1,1,0,0,0,0|2,0,0]=4 2987 B11R1.24 Cc1c[n]cc(C\C=C\C)c1 Amb24062207 [1,1,0,0,0,0|2,0,0]=4 2988 B11R1.24 Cc1cc(CCON)ccc1 Amb25704227 [1,1,0,0,0,0|1,0,1]=4 2989 B11R1.24 Cc1cc[n]c(CNOC)c1 Amb25796210 [1,1,0,0,0,0|2,0,0]=4 2990 B11R1.24 Cc1cccc(CCCC)c1 Amb22730119 [1,1,0,0,0,0|1,0,1]=4 2991 B11R1.24 Cc1cccc(CNOC)c1 Amb25362893 [1,1,0,0,0,0|1,0,0]=3 2992 B11R1.24 Cc1cccc(CSCC)c1 Amb25838308 [1,1,0,0,0,0|2,0,0]=4 2993 B11R1.24 Cc1cccc(c1)SCOC Amb25235859 [1,1,0,0,0,0|1,0,1]=4 2994 B11R1.24 NOCCc1cccc(Cl)c1 Amb25152729 [1,1,0,0,0,0|1,0,1]=4 2995 B11R1.24 NOCCc1cccc(F)c1 Amb22896630 [1,1,0,0,0,0|1,0,1]=4 2996 B11R1.28 BrCCNCc1ccccc1 Amb18131678 [1,1,0,0,0,0|2,0,0]=4 2997 B11R1.28 BrCC\C=C\c1ccccc1 Amb17140564 [1,1,0,0,0,0|1,0,1]=4 2998 B11R1.28 BrC\C=C\Cc1ccccc1 Amb25039914 [1,1,0,0,0,0|1,0,0]=3 2999 B11R1.28 Br\C=C/CNc1ccccc1 Amb25063133 [1,1,0,0,0,0|2,0,0]=4 3000 B11R1.28 C/C=C/C=C/c1ccccc1 Amb17939507 [1,1,0,0,0,0|1,0,1]=4 3001 B11R1.28 C/C=C/CCc1ccccc1 Amb17940149 [1,1,0,0,0,0|1,0,0]=3 3002 B11R1.28 CC#CCNc1ccccc1 Amb21953777 [1,1,0,0,0,0|1,0,1]=4 3003 B11R1.28 CC#CCOc1ccccc1 Amb25119404 [1,1,0,0,0,0|1,0,1]=4 3004 B11R1.28 CC=CCCc1cccc[n]1 Amb24100575 [1,1,0,0,0,0|2,0,0]=4 3005 B11R1.28 CC=CCCc1ccccc1 Amb24062987 [1,1,0,0,0,0|1,0,0]=3 3006 B11R1.28 CCCNCc1ccccc1 Amb1105937 [1,1,0,0,0,0|1,0,1]=4 3007 B11R1.28 CCC\C=N\c1ccccc1 Amb16231172 [1,1,0,0,0,0|2,0,0]=4 3008 B11R1.28 CCNCCc1ccccc1 Amb2119468 [1,1,0,0,0,0|1,0,1]=4 3009 B11R1.28 CCOCC[n+]1ccccc1 Amb24762647 [1,1,0,0,0,0|1,0,1]=4 3010 B11R1.28 CCOCNc1ccccc1 Amb25856976 [1,1,0,0,0,0|1,0,1]=4 3011 B11R1.28 CCOCSc1ccccc1 Amb24762591 [1,1,0,0,0,0|1,0,1]=4 3012 B11R1.28 CCONCc1ccccc1 Amb25151184 [1,1,0,0,0,0|1,0,0]=3 3013 B11R1.28 CCO\C=N\c1cccc[n]1 Amb24517123 [1,1,0,0,0,0|2,0,0]=4 3014 B11R1.28 CCO\N=C\c1ccccc1 Amb25712631 [1,1,0,0,0,0|1,0,1]=4 3015 B11R1.28 CCSCSc1ccccc1 Amb25380606 [1,1,0,0,0,0|2,0,0]=4 3016 B11R1.28 CC\C=C/Cc1cc[n]cc1 Amb24103208 [1,1,0,0,0,0|2,0,0]=4 3017 B11R1.28 CC\N=C\Nc1ccccc1 Amb24384245 [1,1,0,0,0,0|2,0,0]=4 3018 B11R1.28 CNCCCc1ccccc1 Amb21954280 [1,1,0,0,0,0|1,0,1]=4 3019 B11R1.28 CNCCOc1ccccc1 Amb1105525 [1,1,0,0,0,0|1,0,1]=4 3020 B11R1.28 CNCCSc1ccccc1 Amb10608735 [1,1,0,0,0,0|1,0,1]=4 3021 B11R1.28 CNCCSc1ccccc1 Amb17622507 [1,1,0,0,0,0|1,0,1]=4 3022 B11R1.28 CNC\C=C\c1ccccc1 Amb2114273 [1,1,0,0,0,0|1,0,1]=4 3023 B11R1.28 COCC#Cc1ccccc1 Amb25308232 [1,1,0,0,0,0|0,0,2]=4 3024 B11R1.28 COCCCc1c[n]ccc1 Amb25382996 [1,1,0,0,0,0|1,0,1]=4 3025 B11R1.28 COCCCc1cccc[n]1 Amb25383067 [1,1,0,0,0,0|1,0,1]=4 3026 B11R1.28 COCCNc1c[n]ccc1 Amb18268638 [1,1,0,0,0,0|1,0,1]=4 3027 B11R1.28 COCCOc1c[n]ccc1 Amb25383068 [1,1,0,0,0,0|1,0,1]=4 3028 B11R1.28 COCCOc1cc[n]cc1 Amb25383069 [1,1,0,0,0,0|1,0,1]=4 3029 B11R1.28 COCCOc1cccc[n]1 Amb24070160 [1,1,0,0,0,0|1,0,1]=4 3030 B11R1.28 COCCSc1ccccn1 Amb17760116 [1,1,0,0,0,0|1,0,1]=4 3031 B11R1.28 COCNCc1ccccc1 Amb25053350 [1,1,0,0,0,0|0,0,1]=3 3032 B11R1.28 COC\C=C\c1cccc[n]1 Amb24101883 [1,1,0,0,0,0|1,0,1]=4 3033 B11R1.28 CONCCc1cccc[n]1 Amb24763045 [1,1,0,0,0,0|1,0,1]=4 3034 B11R1.28 CONCCc1ccccc1 Amb22897018 [1,1,0,0,0,0|0,0,1]=3 3035 B11R1.28 CONCOc1ccccc1 Amb24096695 [1,1,0,0,0,0|1,0,0]=3 3036 B11R1.28 CO\C=C/Oc1ccccc1 Amb24069136 [1,1,0,0,0,0|0,0,1]=3 3037 B11R1.28 CO\C=C\Oc1ccccc1 Amb24069134 [1,1,0,0,0,0|0,0,1]=3 3038 B11R1.28 CSCCCc1ccccc1 Amb25383748 [1,1,0,0,0,0|0,1,1]=4 3039 B11R1.28 CSCCNc1ccccc1 Amb17307504 [1,1,0,0,0,0|0,1,1]=4 3040 B11R1.28 CSCSCc1ccccc1 Amb25380610 [1,1,0,0,0,0|0,1,1]=4 3041 B11R1.28 C\C=C\CCc1cc[n]cc1 Amb25830692 [1,1,0,0,0,0|2,0,0]=4 3042 B11R1.28 C\C=C\CNc1c[n]ccc1 Amb25228933 [1,1,0,0,0,0|2,0,0]=4 3043 B11R1.28 C\C=C\COc1c[n]ccc1 Amb25151771 [1,1,0,0,0,0|2,0,0]=4 3044 B11R1.28 C\C=C\COc1cccc[n]1 Amb24101955 [1,1,0,0,0,0|2,0,0]=4 3045 B11R1.28 C\C=N\OCc1ccccc1 Amb24334870 [1,1,0,0,0,0|2,0,0]=4 3046 B11R1.28 ClCC#CCc1ccccc1 Amb24453719 [1,1,0,0,0,0|1,0,1]=4 3047 B11R1.28 ClCC\C=C\c1ccccc1 Amb17232628 [1,1,0,0,0,0|1,0,1]=4 3048 B11R1.28 ClCO\N=C\c1ccccc1 Amb25838175 [1,1,0,0,0,0|1,0,1]=4 3049 B11R1.28 ClC\C=C\Cc1ccccc1 Amb24462747 [1,1,0,0,0,0|1,0,0]=3 3050 B11R1.28 ClC\C=C\Oc1ccccc1 Amb24548862 [1,1,0,0,0,0|2,0,0]=4 3051 B11R1.28 Cl\C=C/CNc1ccccc1 Amb25241241 [1,1,0,0,0,0|2,0,0]=4 3052 B11R1.28 Cl\C=C\CNc1ccccc1 Amb25148081 [1,1,0,0,0,0|2,0,0]=4 3053 B11R1.28 FCCNCc1ccccc1 Amb24611358 [1,1,0,0,0,0|2,0,0]=4 3054 B11R1.28 ICCCCc1ccccc1 Amb25380384 [1,1,0,0,0,0|1,0,1]=4 3055 B11R1.28 ICCNCc1ccccc1 Amb25188796 [1,1,0,0,0,0|2,0,0]=4 3056 B11R1.28 ICCOCc1ccccc1 Amb16191915 [1,1,0,0,0,0|2,0,0]=4 3057 B11R1.28 NCC#CCc1ccccc1 Amb25104593 [1,1,0,0,0,0|1,0,1]=4 3058 B11R1.28 NCCCCc1ccccc1 Amb1227740 [1,1,0,0,0,0|1,0,1]=4 3059 B11R1.28 NCCCCc1ccccc1 Amb19929939 [1,1,0,0,0,0|1,0,1]=4 3060 B11R1.28 NCCOCc1ccccc1 Amb1081962 [1,1,0,0,0,0|2,0,0]=4 3061 B11R1.28 NCCOCc1ccccc1 Amb2137059 [1,1,0,0,0,0|2,0,0]=4 3062 B11R1.28 NCC\C=C\c1ccccc1 Amb17138419 [1,1,0,0,0,0|1,0,1]=4 3063 B11R1.28 NCNCCc1ccccc1 Amb25385258 [1,1,0,0,0,0|1,0,1]=4 3064 B11R1.28 NC\C=C\Cc1ccccc1 Amb24351087 [1,1,0,0,0,0|1,0,0]=3 3065 B11R1.28 NOCCCc1ccccc1 Amb22231356 [1,1,0,0,0,0|1,0,1]=4 3066 B11R1.28 NOCCNc1ccccc1 Amb24486573 [1,1,0,0,0,0|1,0,1]=4 3067 B11R1.28 NOCCOc1ccccc1 Amb17088287 [1,1,0,0,0,0|1,0,1]=4 3068 B11R1.28 NOCCOc1ccccc1 Amb19894640 [1,1,0,0,0,0|1,0,1]=4 3069 B11R1.28 NOCOCc1ccccc1 Amb10606697 [1,1,0,0,0,0|1,0,1]=4 3070 B11R1.28 NOC\C=C\c1ccccc1 Amb18124997 [1,1,0,0,0,0|1,0,1]=4 3071 B11R1.28 O=C\C=C\Cc1ccccc1 Amb18124787 [1,1,0,0,0,0|1,0,1]=4 3072 B11R1.28 OCCNCc1ccccc1 Amb1835287 [1,1,0,0,0,0|2,0,0]=4 3073 B11R1.28 OCC\C=C\c1ccccc1 Amb24756581 [1,1,0,0,0,0|1,0,1]=4 3074 B11R1.28 OC\C=C\Cc1ccccc1 Amb25074433 [1,1,0,0,0,0|1,0,0]=3 3075 B11R1.28 OC\C=C\Nc1ccccc1 Amb25228349 [1,1,0,0,0,0|2,0,0]=4 3076 B11R1.28 OC\C=C\Oc1ccccc1 Amb25283274 [1,1,0,0,0,0|2,0,0]=4 3077 B11R1.28 O\N=C\CNc1ccccc1 Amb25211715 [1,1,0,0,0,0|2,0,0]=4 3078 B11R1.28 SCCCCc1ccccc1 Amb17400224 [1,1,0,0,0,0|1,0,1]=4 3079 B11R1.28 SCC\C=C\c1ccccc1 Amb24390438 [1,1,0,0,0,0|1,0,1]=4 3080 B11R1.28 [NH3+]CCCCc1ccccc1 Amb22733934 [1,1,0,0,0,0|1,0,1]=4 3081 B11R1.28 [NH3+]OCCOc1ccccc1 Amb2420800 [1,1,0,0,0,0|1,0,1]=4 3082 B11R1.91 CC(=C)OCc1ccccc1 Amb22731238 [1,1,0,0,0,0|2,0,0]=4 3083 B11R1.91 CC(=C)\C=C\c1ccccc1 Amb22546632 [1,1,0,0,0,0|1,0,1]=4 3084 B11R1.91 CC(=N)NCc1ccccc1 Amb24477667 [1,1,0,0,0,0|2,0,0]=4 3085 B11R1.91 CC(=N)SCc1ccccc1 Amb17609340 [1,1,0,0,0,0|2,0,0]=4 3086 B11R1.91 CC(=NCc1ccccc1)C Amb10568469 [1,1,0,0,0,0|2,0,0]=4 3087 B11R1.91 CC(=O)NCc1ccccc1 Amb1214455 [1,1,0,0,0,0|2,0,0]=4 3088 B11R1.91 CC(=O)\C=C/c1ccccc1 Amb24380759 [1,1,0,0,0,0|1,0,1]=4 3089 B11R1.91 CC(=O)\C=C\c1ccccc1 Amb1658842 [1,1,0,0,0,0|1,0,1]=4 3090 B11R1.91 CC(=O)\C=N\c1ccccc1 Amb25230668 [1,1,0,0,0,0|2,0,0]=4 3091 B11R1.91 CC(=S)NCc1ccccc1 Amb1797002 [1,1,0,0,0,0|2,0,0]=4 3092 B11R1.91 CC(=S)OCc1ccccc1 Amb22168133 [1,1,0,0,0,0|2,0,0]=4 3093 B11R1.91 CC(C)=CNc1ccccc1 Amb24715634 [1,1,0,0,0,0|2,0,0]=4 3094 B11R1.91 CC(C)\C=C/c1ccccc1 Amb22546593 [1,1,0,0,0,0|1,0,1]=4 3095 B11R1.91 CC(N)C=Cc1ccccc1 Amb23536549 [1,1,0,0,0,0|1,0,1]=4 3096 B11R1.91 CC(N)\C=C\c1ccccc1 Amb18124854 [1,1,0,0,0,0|1,0,1]=4 3097 B11R1.91 CC(N)\C=C\c1ccccc1 Amb21961471 [1,1,0,0,0,0|1,0,1]=4 3098 B11R1.91 CC(NCc1ccccc1)C Amb2118435 [1,1,0,0,0,0|2,0,0]=4 3099 B11R1.91 CC(O)OCc1ccccc1 Amb25070837 [1,1,0,0,0,0|2,0,0]=4 3100 B11R1.91 CC(\C=C\c1ccccc1)O Amb17593695 [1,1,0,0,0,0|1,0,1]=4 3101 B11R1.91 CN(C)CCc1ccccc1 Amb22350299 [1,1,0,0,0,0|1,0,1]=4 3102 B11R1.91 CN(C)OCc1ccccc1 Amb24735469 [1,1,0,0,0,0|2,0,0]=4 3103 B11R1.91 CN(C)\C=C\c1ccccc1 Amb25056753 [1,1,0,0,0,0|1,0,1]=4 3104 B11R1.91 CN(C)\C=N\c1ccccc1 Amb22357796 [1,1,0,0,0,0|2,0,0]=4 3105 B11R1.91 CN(N)CCc1ccccc1 Amb18064284 [1,1,0,0,0,0|1,0,1]=4 3106 B11R1.91 C[C@@H](N)\C=C\c1ccccc1 Amb24359903 [1,1,0,0,0,0|1,0,1]=4 3107 B11R1.91 C[C@@H](O)CCc1ccccc1 Amb22049565 [1,1,0,0,0,0|1,0,1]=4 3108 B11R1.91 C[C@H](N)\C=C\c1ccccc1 Amb25809484 [1,1,0,0,0,0|1,0,1]=4 3109 B11R1.91 C[C@H](O)CCc1ccccc1 Amb19929325 [1,1,0,0,0,0|1,0,1]=4 3110 B11R1.91 C[NH+](\C=N\c1ccccc1)C Amb16205285 [1,1,0,0,0,0|2,0,0]=4 3111 B11R1.91 C[SiH](C)CCc1ccccc1 Amb22338692 [1,1,0,0,0,0|1,0,1]=4 3112 B11R1.91 C\C(=C\C[n+]1ccccc1)\Cl Amb2228412 [1,1,0,0,0,0|2,0,0]=4 3113 B11R1.91 C\C(\N)=C\Oc1ccccc1 Amb24674154 [1,1,0,0,0,0|2,0,0]=4 3114 B11R1.20 CC(=C)CN1C=CC(=O)C=C1 Amb25076881 [1,1,0,0,0,0|2,0,0]=4 3115 B11R1.20 CC(=Cc1ccc(cc1)O)C Amb1333686 [1,1,0,0,0,0|1,0,1]=4 3116 B11R1.20 CC(=N)Nc1ccc(Cl)cc1 Amb24477671 [1,1,0,0,0,0|2,0,0]=4 3117 B11R1.20 CC(=O)CN1C=CC(=O)C=C1 Amb18787428 [1,1,0,0,0,0|1,0,0]=3 3118 B11R1.20 CC(=O)C[n+]1ccc(cc1)C Amb10573522 [1,1,0,0,0,0|1,0,0]=3 3119 B11R1.20 CC(=O)Cc1ccc(Cl)c[n]1 Amb23437495 [1,1,0,0,0,0|1,0,0]=3 3120 B11R1.20 CC(=O)Cc1ccc(F)[n]c1 Amb25733918 [1,1,0,0,0,0|1,0,0]=3 3121 B11R1.20 CC(=O)Cc1ccc(N)[n]c1 Amb18201937 [1,1,0,0,0,0|1,0,0]=3 3122 B11R1.20 CC(=O)Cc1ccc(cn1)C Amb10607335 [1,1,0,0,0,0|1,0,0]=3 3123 B11R1.20 CC(=O)Cc1ccc(nc1)Cl Amb10976126 [1,1,0,0,0,0|1,0,0]=3 3124 B11R1.20 CC(=O)NC1C=CC(=O)C=C1 Amb25695875 [1,1,0,0,0,0|1,0,1]=4 3125 B11R1.20 CC(=O)N[13c]1[13cH][13cH][13c]([13cH][13cH]1)Cl Amb17610795 [1,1,0,0,0,0|1,0,0]=3 3126 B11R1.20 CC(=O)Nc1cc[n+](cc1)[O-] Amb10552789 [1,1,0,0,0,0|2,0,0]=4 3127 B11R1.20 CC(=O)Nc1ccc(Cl)[n]c1 Amb24121741 [1,1,0,0,0,0|2,0,0]=4 3128 B11R1.20 CC(=O)Nc1ccc(F)[n]c1 Amb24486081 [1,1,0,0,0,0|2,0,0]=4 3129 B11R1.20 CC(=O)Nc1ccc(N)[n]c1 Amb18949287 [1,1,0,0,0,0|2,0,0]=4 3130 B11R1.20 CC(=O)Nc1ccc(O)[n]c1 Amb22752688 [1,1,0,0,0,0|2,0,0]=4 3131 B11R1.20 CC(=O)Nc1ccc(O)c[n]1 Amb22002364 [1,1,0,0,0,0|2,0,0]=4 3132 B11R1.20 CC(=O)Nc1ccc([NH3+])cc1 Amb24113861 [1,1,0,0,0,0|1,0,0]=3 3133 B11R1.20 CC(=O)Nc1ccc(cc1)N Amb1208563 [1,1,0,0,0,0|1,0,0]=3 3134 B11R1.20 CC(=O)Nc1ccc(cc1)O Amb1209347 [1,1,0,0,0,0|1,0,0]=3 3135 B11R1.20 CC(=O)Nc1ccc(cn1)Cl Amb1808922 [1,1,0,0,0,0|2,0,0]=4 3136 B11R1.20 CC(=O)Nc1ccc(cn1)I Amb2054963 [1,1,0,0,0,0|2,0,0]=4 3137 B11R1.20 CC(=O)Nc1ccc(nc1)Br Amb10071320 [1,1,0,0,0,0|2,0,0]=4 3138 B11R1.20 CC(=O)Nc1ccc(nc1)I Amb10608890 [1,1,0,0,0,0|2,0,0]=4 3139 B11R1.20 CC(=O)Nc1ccc(nc1)S Amb10569732 [1,1,0,0,0,0|2,0,0]=4 3140 B11R1.20 CC(=O)Oc1ccc(Br)[n]c1 Amb20617838 [1,1,0,0,0,0|2,0,0]=4 3141 B11R1.20 CC(=O)Oc1ccc(Br)c[n]1 Amb25149038 [1,1,0,0,0,0|2,0,0]=4 3142 B11R1.20 CC(=O)Oc1ccc(F)[n]c1 Amb25689698 [1,1,0,0,0,0|2,0,0]=4 3143 B11R1.20 CC(=O)Oc1ccc(I)cc1 Amb25330825 [1,1,0,0,0,0|1,0,0]=3 3144 B11R1.20 CC(=O)Oc1ccc(N)cc1 Amb18125232 [1,1,0,0,0,0|1,0,0]=3 3145 B11R1.20 CC(=O)Oc1ccc(cc1)O Amb10843589 [1,1,0,0,0,0|1,0,0]=3 3146 B11R1.20 CC(=O)Oc1ccc(cc1)[*] Amb22045256 [1,1,0,0,0,0|1,0,0]=3 3147 B11R1.20 CC(=O)Sc1ccc(C)cc1 Amb17741675 [1,1,0,0,0,0|1,0,0]=3 3148 B11R1.20 CC(=O)Sc1ccc(Cl)cc1 Amb24433357 [1,1,0,0,0,0|1,0,0]=3 3149 B11R1.20 CC(=O)Sc1ccc(F)cc1 Amb25348487 [1,1,0,0,0,0|1,0,0]=3 3150 B11R1.20 CC(=O)Sc1ccc(I)cc1 Amb22344406 [1,1,0,0,0,0|1,0,0]=3 3151 B11R1.20 CC(=O)Sc1ccc(cc1)Br Amb1394995 [1,1,0,0,0,0|1,0,0]=3 3152 B11R1.20 CC(=S)Nc1ccc(cc1)C Amb2553853 [1,1,0,0,0,0|1,1,0]=4 3153 B11R1.20 CC(=S)Nc1ccc(cc1)F Amb2373818 [1,1,0,0,0,0|1,1,0]=4 3154 B11R1.20 CC(=S)Oc1ccc(Br)cc1 Amb24637638 [1,1,0,0,0,0|1,1,0]=4 3155 B11R1.20 CC(Br)Cc1ccc(Br)cc1 Amb18049388 [1,1,0,0,0,0|1,0,1]=4 3156 B11R1.20 CC(Br)Cc1ccc(Cl)cc1 Amb25832281 [1,1,0,0,0,0|1,0,1]=4 3157 B11R1.20 CC(C)=Cc1ccc(C)cc1 Amb24484512 [1,1,0,0,0,0|1,0,1]=4 3158 B11R1.20 CC(C)=Cc1ccc(N)cc1 Amb18124842 [1,1,0,0,0,0|1,0,1]=4 3159 B11R1.20 CC(C)=Nc1ccc(N)cc1 Amb24761154 [1,1,0,0,0,0|2,0,0]=4 3160 B11R1.20 CC(C)Cc1ccc(Cl)cc1 Amb22750460 [1,1,0,0,0,0|1,0,1]=4 3161 B11R1.20 CC(C)Cc1ccc(I)cc1 Amb22750462 [1,1,0,0,0,0|1,0,1]=4 3162 B11R1.20 CC(C)Cc1ccc(N)cc1 Amb20668373 [1,1,0,0,0,0|1,0,1]=4 3163 B11R1.20 CC(C)Cc1ccc(O)cc1 Amb17779015 [1,1,0,0,0,0|1,0,1]=4 3164 B11R1.20 CC(Cc1ccc(cc1)Br)Cl Amb17477731 [1,1,0,0,0,0|1,0,1]=4 3165 B11R1.20 CC(Cc1ccc(cc1)Br)N Amb10205335 [1,1,0,0,0,0|1,0,1]=4 3166 B11R1.20 CC(Cc1ccc(cc1)Br)O Amb17477716 [1,1,0,0,0,0|0,0,2]=4 3167 B11R1.20 CC(Cc1ccc(cc1)C)Cl Amb17477591 [1,1,0,0,0,0|1,0,1]=4 3168 B11R1.20 CC(Cc1ccc(cc1)C)O Amb17138431 [1,1,0,0,0,0|0,0,2]=4 3169 B11R1.20 CC(Cc1ccc(cc1)Cl)Cl Amb17477736 [1,1,0,0,0,0|1,0,1]=4 3170 B11R1.20 CC(Cc1ccc(cc1)Cl)O Amb17138670 [1,1,0,0,0,0|0,0,2]=4 3171 B11R1.20 CC(Cc1ccc(cc1)F)Cl Amb17477738 [1,1,0,0,0,0|1,0,1]=4 3172 B11R1.20 CC(Cc1ccc(cc1)F)N Amb10605742 [1,1,0,0,0,0|1,0,1]=4 3173 B11R1.20 CC(Cc1ccc(cc1)F)O Amb17138452 [1,1,0,0,0,0|0,0,2]=4 3174 B11R1.20 CC(Cc1ccc(cc1)N)C Amb1133124 [1,1,0,0,0,0|1,0,1]=4 3175 B11R1.20 CC(Cl)Cc1ccc(I)cc1 Amb24573927 [1,1,0,0,0,0|1,0,1]=4 3176 B11R1.20 CC(F)Cc1ccc(Br)cc1 Amb25247565 [1,1,0,0,0,0|1,0,1]=4 3177 B11R1.20 CC(O)Cc1ccc(I)cc1 Amb25277831 [1,1,0,0,0,0|0,0,2]=4 3178 B11R1.20 CC(O)Cc1ccc(O)cc1 Amb25265892 [1,1,0,0,0,0|0,0,2]=4 3179 B11R1.20 CC(S)Cc1ccc(F)cc1 Amb24577187 [1,1,0,0,0,0|0,1,1]=4 3180 B11R1.20 CN(C)Cc1ccc(C)cc1 Amb17663830 [1,1,0,0,0,0|2,0,0]=4 3181 B11R1.20 CN(C)Cc1ccc(Cl)cc1 Amb22900098 [1,1,0,0,0,0|2,0,0]=4 3182 B11R1.20 CN(C)Cc1ccc(F)cc1 Amb25189644 [1,1,0,0,0,0|2,0,0]=4 3183 B11R1.20 CN(C)Cc1ccc(S)cc1 Amb19649791 [1,1,0,0,0,0|2,0,0]=4 3184 B11R1.20 CN(Cc1ccc(cc1)Br)C Amb2447334 [1,1,0,0,0,0|2,0,0]=4 3185 B11R1.20 CN(Cc1ccc(cc1)I)C Amb10070277 [1,1,0,0,0,0|2,0,0]=4 3186 B11R1.20 CN(Cc1ccc(cc1)N)C Amb1136045 [1,1,0,0,0,0|2,0,0]=4 3187 B11R1.20 CN(Cc1ccc(cc1)O)C Amb1803821 [1,1,0,0,0,0|2,0,0]=4 3188 B11R1.20 CN(N)Cc1ccc(Br)cc1 Amb18569747 [1,1,0,0,0,0|2,0,0]=4 3189 B11R1.20 CN(N)Cc1ccc(Cl)cc1 Amb18563956 [1,1,0,0,0,0|2,0,0]=4 3190 B11R1.20 CN(N)Cc1ccc(F)cc1 Amb18065411 [1,1,0,0,0,0|2,0,0]=4 3191 B11R1.20 CS(=O)Cc1ccc(Cl)[n]c1 Amb25227089 [1,1,0,0,0,0|2,0,0]=4 3192 B11R1.20 CS(=O)Cc1ccc(N)cc1 Amb18952403 [1,1,0,0,0,0|1,0,0]=3 3193 B11R1.20 CS(=O)Nc1ccc(Br)cc1 Amb24601287 [1,1,0,0,0,0|2,0,0]=4 3194 B11R1.20 CS(=O)Nc1ccc(I)cc1 Amb25177241 [1,1,0,0,0,0|2,0,0]=4 3195 B11R1.20 CS(=O)Nc1ccc(N)cc1 Amb25359575 [1,1,0,0,0,0|2,0,0]=4 3196 B11R1.20 C[C@@H](N)Cc1ccc(N)cc1 Amb24646766 [1,1,0,0,0,0|1,0,1]=4 3197 B11R1.20 C[C@@H](O)Cc1ccc(F)cc1 Amb24068203 [1,1,0,0,0,0|0,0,2]=4 3198 B11R1.20 C[C@@H](O)Cc1ccc(N)cc1 Amb25064736 [1,1,0,0,0,0|0,0,2]=4 3199 B11R1.20 C[C@H](N)Cc1ccc(N)cc1 Amb24485923 [1,1,0,0,0,0|1,0,1]=4 3200 B11R1.20 C[C@H](N)Cc1ccc(O)cc1 Amb25172822 [1,1,0,0,0,0|1,0,1]=4 3201 B11R1.20 C[C@H](O)Cc1ccc(Cl)cc1 Amb24421443 [1,1,0,0,0,0|0,0,2]=4 3202 B11R1.20 C\C(\N)=C\c1ccc(Cl)cc1 Amb25028102 [1,1,0,0,0,0|1,0,1]=4 3203 B11R1.20 C\C(\N)=N\c1ccc(Br)cc1 Amb24311042 [1,1,0,0,0,0|2,0,0]=4 3204 B11R1.20 C\C(\O)=C\c1ccc(F)cc1 Amb24100279 [1,1,0,0,0,0|0,0,2]=4 3205 B11R1.20 Cc1[n]cc(CC(O)=O)c[n]1 Amb18201416 [1,1,0,0,0,0|2,0,0]=4 3206 B11R1.20 Cc1c[n]c(CC(C)=O)c[n]1 Amb25234305 [1,1,0,0,0,0|2,0,0]=4 3207 B11R1.20 Cc1c[n]c(CC(O)=O)c[n]1 Amb18201438 [1,1,0,0,0,0|2,0,0]=4 3208 B11R1.20 Cc1ccc(CC(C)=C)c[n]1 Amb24484467 [1,1,0,0,0,0|2,0,0]=4 3209 B11R1.20 Cc1ccc(CC(C)C)cc1 Amb24064801 [1,1,0,0,0,0|1,0,1]=4 3210 B11R1.20 Cc1ccc(CC(C)N)cc1 Amb22055742 [1,1,0,0,0,0|1,0,1]=4 3211 B11R1.20 Cc1ccc(CC(N)=O)c[n]1 Amb25027878 [1,1,0,0,0,0|2,0,0]=4 3212 B11R1.20 Cc1ccc(CC(O)=O)[n][n]1 Amb18201450 [1,1,0,0,0,0|2,0,0]=4 3213 B11R1.20 Cc1ccc(CC(O)=O)[n]c1 Amb18201731 [1,1,0,0,0,0|1,0,0]=3 3214 B11R1.20 Cc1ccc(CC(O)=O)[n]c1 Amb22495844 [1,1,0,0,0,0|1,0,0]=3 3215 B11R1.20 Cc1ccc(CC(O)=O)cc1 Amb22434999 [1,1,0,0,0,0|0,0,0]=2 3216 B11R1.20 Cc1ccc(CC(O)=S)cc1 Amb22229853 [1,1,0,0,0,0|0,1,0]=3 3217 B11R1.20 Cc1ccc(CN(C)N)cc1 Amb18065318 [1,1,0,0,0,0|2,0,0]=4 3218 B11R1.20 Cc1ccc(C[C@@H](C)N)cc1 Amb25141953 [1,1,0,0,0,0|1,0,1]=4 3219 B11R1.20 Cc1ccc([n]c1)OC(C)=O Amb25337544 [1,1,0,0,0,0|2,0,0]=4 3220 B11R1.20 Cc1ccc(\C=C(/C)\N)cc1 Amb25111949 [1,1,0,0,0,0|1,0,1]=4 3221 B11R1.20 Cc1ccc(c[n]1)NC(C)=O Amb20248220 [1,1,0,0,0,0|2,0,0]=4 3222 B11R1.20 Cc1ccc(c[n]1)OC(C)=O Amb24103883 [1,1,0,0,0,0|2,0,0]=4 3223 B11R1.20 Cc1ccc(cc1)NC(=O)Cl Amb24419875 [1,1,0,0,0,0|2,0,0]=4 3224 B11R1.20 Cc1ccc(cc1)NC(=O)F Amb25277105 [1,1,0,0,0,0|2,0,0]=4 3225 B11R1.20 Cc1ccc(cc1)NC(C)=C Amb24374732 [1,1,0,0,0,0|2,0,0]=4 3226 B11R1.20 Cc1ccc(cc1)NC(C)=N Amb25761000 [1,1,0,0,0,0|2,0,0]=4 3227 B11R1.20 ClC(=O)Cc1ccc(cc1)Cl Amb1680103 [1,1,0,0,0,0|1,0,0]=3 3228 B11R1.20 ClC(=O)Oc1ccc(cc1)Cl Amb10068923 [1,1,0,0,0,0|2,0,0]=4 3229 B11R1.20 N=C(O)Nc1ccc(Cl)cc1 Amb24063643 [1,1,0,0,0,0|2,0,0]=4 3230 B11R1.20 NC(=N)Cc1ccc(cc1)F Amb2183302 [1,1,0,0,0,0|2,0,0]=4 3231 B11R1.20 NC(=O)CN1C=CC(=O)C=C1 Amb18177192 [1,1,0,0,0,0|2,0,0]=4 3232 B11R1.20 NC(=O)Cc1ccc(Br)c[n]1 Amb22497485 [1,1,0,0,0,0|2,0,0]=4 3233 B11R1.20 NC(=O)Cc1ccc(Cl)c[n]1 Amb23403387 [1,1,0,0,0,0|2,0,0]=4 3234 B11R1.20 NC(=O)Cc1ccc(S)cc1 Amb25148336 [1,1,0,0,0,0|1,0,0]=3 3235 B11R1.20 NC(=O)Cc1ccc(cc1)N Amb1121163 [1,1,0,0,0,0|1,0,0]=3 3236 B11R1.20 NC(=O)Nc1ccc(cc1)Br Amb1215049 [1,1,0,0,0,0|2,0,0]=4 3237 B11R1.20 NC(=O)Nc1ccc(cc1)C Amb1195893 [1,1,0,0,0,0|2,0,0]=4 3238 B11R1.20 NC(=O)Nc1ccc(cc1)Cl Amb1195894 [1,1,0,0,0,0|2,0,0]=4 3239 B11R1.20 NC(=O)Nc1ccc(cc1)F Amb1130731 [1,1,0,0,0,0|2,0,0]=4 3240 B11R1.20 NC(=O)Nc1ccc(cc1)I Amb1144373 [1,1,0,0,0,0|2,0,0]=4 3241 B11R1.20 NC(=O)Nc1ccc(cc1)N Amb1116957 [1,1,0,0,0,0|2,0,0]=4 3242 B11R1.20 NC(=O)Oc1ccc(Br)cc1 Amb25790618 [1,1,0,0,0,0|2,0,0]=4 3243 B11R1.20 NC(=O)Oc1ccc(cc1)Cl Amb10575589 [1,1,0,0,0,0|2,0,0]=4 3244 B11R1.20 NC(=S)Cc1ccc(cc1)Cl Amb1116565 [1,1,0,0,0,0|1,1,0]=4 3245 B11R1.20 NC(=S)Cc1ccc(cc1)O Amb1112056 [1,1,0,0,0,0|1,1,0]=4 3246 B11R1.20 NC(O)Cc1ccc(O)cc1 Amb24102717 [1,1,0,0,0,0|1,0,1]=4 3247 B11R1.20 Nc1c[n]c(CC(O)=O)[n]c1 Amb18201152 [1,1,0,0,0,0|2,0,0]=4 3248 B11R1.20 Nc1cc[n+](CC([O-])=O)cc1 Amb25751156 [1,1,0,0,0,0|1,0,1]=4 3249 B11R1.20 Nc1ccc(CC(N)=O)[n]c1 Amb22496373 [1,1,0,0,0,0|2,0,0]=4 3250 B11R1.20 Nc1ccc(CC(N)=O)c[n]1 Amb24622802 [1,1,0,0,0,0|2,0,0]=4 3251 B11R1.20 Nc1ccc(CC(N)=O)cc1 Amb22899489 [1,1,0,0,0,0|1,0,0]=3 3252 B11R1.20 Nc1ccc(CC(O)=O)[n]c1 Amb20248323 [1,1,0,0,0,0|1,0,0]=3 3253 B11R1.20 Nc1ccc(CC(O)=O)c[n]1 Amb24117183 [1,1,0,0,0,0|1,0,0]=3 3254 B11R1.20 Nc1ccc(C[13C](O)=O)cc1 Amb22367320 [1,1,0,0,0,0|0,0,0]=2 3255 B11R1.20 Nc1ccc(cc1)SC(=O)F Amb25169490 [1,1,0,0,0,0|2,0,0]=4 3256 B11R1.20 Nc1ccc(cc1)SC(N)=O Amb24433331 [1,1,0,0,0,0|2,0,0]=4 3257 B11R1.20 O=C(Br)Cc1ccc(F)cc1 Amb25130669 [1,1,0,0,0,0|1,0,0]=3 3258 B11R1.20 O=C(Cl)Cc1ccc(I)cc1 Amb24693364 [1,1,0,0,0,0|1,0,0]=3 3259 B11R1.20 O=C(Cl)Oc1ccc(Br)cc1 Amb21618685 [1,1,0,0,0,0|2,0,0]=4 3260 B11R1.20 O=C(Cl)Oc1ccc(I)cc1 Amb25775700 [1,1,0,0,0,0|2,0,0]=4 3261 B11R1.20 O=C(F)Nc1ccc(Cl)cc1 Amb24484940 [1,1,0,0,0,0|2,0,0]=4 3262 B11R1.20 O=C1C=CC(=NC(=O)C)C=C1 Amb10071635 [1,1,0,0,0,0|1,0,0]=3 3263 B11R1.20 OB(O)Cc1ccc(Br)cc1 Amb24388589 [1,1,0,0,0,0|1,0,1]=4 3264 B11R1.20 OB(O)Cc1ccc(Cl)cc1 Amb24068537 [1,1,0,0,0,0|1,0,1]=4 3265 B11R1.20 OB(O)Cc1ccc(F)cc1 Amb24063664 [1,1,0,0,0,0|1,0,1]=4 3266 B11R1.20 OC(=O)CC1=CNC(=O)C=N1 Amb25028216 [1,1,0,0,0,0|2,0,0]=4 3267 B11R1.20 OC(=O)CC=1C=CC(=O)NC1 Amb18024214 [1,1,0,0,0,0|1,0,0]=3 3268 B11R1.20 OC(=O)CC=1C=CC(=O)NN1 Amb18211856 [1,1,0,0,0,0|2,0,0]=4 3269 B11R1.20 OC(=O)CN1C=CC(=O)C=C1 Amb18029462 [1,1,0,0,0,0|1,0,0]=3 3270 B11R1.20 OC(=O)C[n+]1ccc(cc1)C Amb17098175 [1,1,0,0,0,0|1,0,0]=3 3271 B11R1.20 OC(=O)Cc1[n]cc(Cl)c[n]1 Amb25694923 [1,1,0,0,0,0|2,0,0]=4 3272 B11R1.20 OC(=O)Cc1[n]cc(F)c[n]1 Amb19958249 [1,1,0,0,0,0|2,0,0]=4 3273 B11R1.20 OC(=O)Cc1[n]cc(I)c[n]1 Amb24405634 [1,1,0,0,0,0|2,0,0]=4 3274 B11R1.20 OC(=O)Cc1c[n]c(Br)[n]c1 Amb24532992 [1,1,0,0,0,0|2,0,0]=4 3275 B11R1.20 OC(=O)Cc1c[n]c(Br)c[n]1 Amb18168758 [1,1,0,0,0,0|2,0,0]=4 3276 B11R1.20 OC(=O)Cc1cc[n+](cc1)[O-] Amb10552756 [1,1,0,0,0,0|1,0,0]=3 3277 B11R1.20 OC(=O)Cc1ccc(Br)c[n]1 Amb20247880 [1,1,0,0,0,0|1,0,0]=3 3278 B11R1.20 OC(=O)Cc1ccc(Cl)[n][n]1 Amb22499435 [1,1,0,0,0,0|2,0,0]=4 3279 B11R1.20 OC(=O)Cc1ccc(Cl)c[n]1 Amb20247877 [1,1,0,0,0,0|1,0,0]=3 3280 B11R1.20 OC(=O)Cc1ccc(F)[n]c1 Amb20247894 [1,1,0,0,0,0|1,0,0]=3 3281 B11R1.20 OC(=O)Cc1ccc(F)c[n]1 Amb20247873 [1,1,0,0,0,0|1,0,0]=3 3282 B11R1.20 OC(=O)Cc1ccc(cc1)Br Amb1140645 [1,1,0,0,0,0|0,0,0]=2 3283 B11R1.20 OC(=O)Cc1ccc(cc1)O Amb1214964 [1,1,0,0,0,0|0,0,0]=2 3284 B11R1.20 OC(=O)Cc1ccc(cc1)S Amb10808003 [1,1,0,0,0,0|0,0,0]=2 3285 B11R1.20 OC(=O)Cc1ccc(cn1)Br Amb16231529 [1,1,0,0,0,0|1,0,0]=3 3286 B11R1.20 OC(=O)Cc1ncc(cn1)Br Amb10603177 [1,1,0,0,0,0|2,0,0]=4 3287 B11R1.20 OC(=O)Nc1ccc(Br)c[n]1 Amb23554912 [1,1,0,0,0,0|2,0,0]=4 3288 B11R1.20 OC(=S)Cc1ccc(Br)cc1 Amb24079105 [1,1,0,0,0,0|0,1,0]=3 3289 B11R1.20 OC(O)Cc1ccc(Cl)cc1 Amb24353162 [1,1,0,0,0,0|0,0,2]=4 3290 B11R1.20 Oc1c[n]c(CC(O)=O)[n]c1 Amb18200873 [1,1,0,0,0,0|2,0,0]=4 3291 B11R1.20 Oc1ccc(CC(=O)Br)cc1 Amb25202724 [1,1,0,0,0,0|1,0,0]=3 3292 B11R1.20 Oc1ccc(CC(=O)Cl)cc1 Amb25730089 [1,1,0,0,0,0|1,0,0]=3 3293 B11R1.20 Oc1ccc(cc1)NC(O)=S Amb24076711 [1,1,0,0,0,0|1,1,0]=4 3294 B11R1.20 Oc1ccc(cc1)OP(O)=O Amb24513753 [1,1,0,0,0,0|2,0,0]=4 3295 B11R1.20 [O-]C(=O)Cc1ccc(F)cc1 Amb24088363 [1,1,0,0,0,0|0,0,1]=3 3296 B11R1.20 [O-][N+](=O)Cc1ccc(Br)cc1 Amb23589330 [1,1,0,0,0,0|1,0,1]=4 3297 B11R1.20 [O-][N+](=O)Cc1ccc(Cl)cc1 Amb23589315 [1,1,0,0,0,0|1,0,1]=4 3298 B11R1.20 [O-][N+](=O)Cc1ccc(F)cc1 Amb23589319 [1,1,0,0,0,0|1,0,1]=4 3299 B11R1.36 BrC(c1ccccc1)C(=O)C Amb16234147 [1,1,0,0,0,0|0,0,0]=2 3300 B11R1.36 C=C(C(=O)Cl)c1ccccc1 Amb24687929 [1,1,0,0,0,0|1,0,1]=4 3301 B11R1.36 C=C(C(O)=O)[n+]1ccccc1 Amb24433450 [1,1,0,0,0,0|1,0,1]=4 3302 B11R1.36 C=C(C(O)=O)c1ccc[n]c1 Amb24578705 [1,1,0,0,0,0|1,0,1]=4 3303 B11R1.36 C=C(C(O)=O)c1cccc[n]1 Amb24657250 [1,1,0,0,0,0|1,0,1]=4 3304 B11R1.36 CC(=C)C(Cl)c1ccccc1 Amb25320926 [1,1,0,0,0,0|1,0,0]=3 3305 B11R1.36 CC(=C)C(N)c1cc[n]cc1 Amb25149238 [1,1,0,0,0,0|2,0,0]=4 3306 B11R1.36 CC(=C)C(N)c1ccc[n]c1 Amb25297470 [1,1,0,0,0,0|2,0,0]=4 3307 B11R1.36 CC(=C)C(N)c1ccccc1 Amb18124853 [1,1,0,0,0,0|1,0,0]=3 3308 B11R1.36 CC(=C)C(O)c1cc[n]cc1 Amb24447288 [1,1,0,0,0,0|2,0,0]=4 3309 B11R1.36 CC(=C)C(O)c1ccc[n]c1 Amb25687146 [1,1,0,0,0,0|2,0,0]=4 3310 B11R1.36 CC(=N)C(=O)c1ccccc1 Amb24612580 [1,1,0,0,0,0|1,0,1]=4 3311 B11R1.36 CC(=N)N(C)c1ccccc1 Amb24432936 [1,1,0,0,0,0|2,0,0]=4 3312 B11R1.36 CC(=O)C(=C)c1ccccc1 Amb24062191 [1,1,0,0,0,0|0,0,1]=3 3313 B11R1.36 CC(=O)C(=O)c1c[n]ccc1 Amb25152863 [1,1,0,0,0,0|1,0,1]=4 3314 B11R1.36 CC(=O)C(F)c1cc[n]cc1 Amb25739565 [1,1,0,0,0,0|1,0,0]=3 3315 B11R1.36 CC(=O)C(N)c1cccc[n]1 Amb25082427 [1,1,0,0,0,0|1,0,0]=3 3316 B11R1.36 CC(=O)C(N)c1ccccc1 Amb25131723 [1,1,0,0,0,0|0,0,0]=2 3317 B11R1.36 CC(=O)C(O)c1ccc[n]c1 Amb24486339 [1,1,0,0,0,0|1,0,0]=3 3318 B11R1.36 CC(=O)C(O)c1cccc[n]1 Amb24392468 [1,1,0,0,0,0|1,0,0]=3 3319 B11R1.36 CC(=O)C(c1ccccn1)C Amb17593714 [1,1,0,0,0,0|1,0,0]=3 3320 B11R1.36 CC(=O)C(c1ccccn1)Cl Amb17477809 [1,1,0,0,0,0|1,0,0]=3 3321 B11R1.36 CC(=O)C(c1cccnc1)Cl Amb17477811 [1,1,0,0,0,0|1,0,0]=3 3322 B11R1.36 CC(=O)N(C)c1cc[n]cc1 Amb25049376 [1,1,0,0,0,0|2,0,0]=4 3323 B11R1.36 CC(=O)N(C)c1cccc[n]1 Amb24096739 [1,1,0,0,0,0|2,0,0]=4 3324 B11R1.36 CC(=O)N(Cl)c1ccccc1 Amb17672882 [1,1,0,0,0,0|1,0,0]=3 3325 B11R1.36 CC(=O)[C@H](F)c1ccccc1 Amb24486354 [1,1,0,0,0,0|0,0,0]=2 3326 B11R1.36 CC(=O)[C@H](O)c1ccccc1 Amb25088683 [1,1,0,0,0,0|0,0,0]=2 3327 B11R1.36 CC(Br)C(Br)c1ccccc1 Amb25067299 [1,1,0,0,0,0|1,0,1]=4 3328 B11R1.36 CC(Br)C(F)c1ccccc1 Amb24375780 [1,1,0,0,0,0|1,0,1]=4 3329 B11R1.36 CC(Br)C(N)c1ccccc1 Amb24542749 [1,1,0,0,0,0|1,0,1]=4 3330 B11R1.36 CC(Br)[C@@H](O)c1ccccc1 Amb25218214 [1,1,0,0,0,0|1,0,1]=4 3331 B11R1.36 CC(Br)[C@H](O)c1ccccc1 Amb25835623 [1,1,0,0,0,0|1,0,1]=4 3332 B11R1.36 CC(C(C)Br)c1ccccc1 Amb25191202 [1,1,0,0,0,0|1,0,1]=4 3333 B11R1.36 CC(C(C)Cl)c1ccccc1 Amb25832184 [1,1,0,0,0,0|1,0,1]=4 3334 B11R1.36 CC(C(C)N)c1ccccc1 Amb18125050 [1,1,0,0,0,0|1,0,1]=4 3335 B11R1.36 CC(C(C)N)c1ccccc1 Amb22477704 [1,1,0,0,0,0|1,0,1]=4 3336 B11R1.36 CC(C(N)=N)c1ccccc1 Amb22886648 [1,1,0,0,0,0|2,0,0]=4 3337 B11R1.36 CC(C(N)=O)c1cccc[n]1 Amb25217360 [1,1,0,0,0,0|2,0,0]=4 3338 B11R1.36 CC(C(N)=O)c1ccccc1 Amb25837417 [1,1,0,0,0,0|1,0,0]=3 3339 B11R1.36 CC(C(O)=O)[n+]1ccccc1 Amb25708377 [1,1,0,0,0,0|1,0,0]=3 3340 B11R1.36 CC(C(O)=O)c1c[n]c[n]c1 Amb18962092 [1,1,0,0,0,0|2,0,0]=4 3341 B11R1.36 CC(C(O)=O)c1c[n]cc[n]1 Amb24070205 [1,1,0,0,0,0|2,0,0]=4 3342 B11R1.36 CC(C(O)=O)c1cc[n]c[n]1 Amb18201427 [1,1,0,0,0,0|2,0,0]=4 3343 B11R1.36 CC(C(O)=O)c1cc[n]cc1 Amb18952037 [1,1,0,0,0,0|1,0,0]=3 3344 B11R1.36 CC(C(O)=O)c1ccc[n]c1 Amb18952038 [1,1,0,0,0,0|1,0,0]=3 3345 B11R1.36 CC(C(O)=O)c1cccc[n]1 Amb18951446 [1,1,0,0,0,0|1,0,0]=3 3346 B11R1.36 CC(C)=C(N)c1ccccc1 Amb24453064 [1,1,0,0,0,0|1,0,1]=4 3347 B11R1.36 CC(C)C(Br)c1ccccc1 Amb20667915 [1,1,0,0,0,0|1,0,1]=4 3348 B11R1.36 CC(C)C(N)c1ccccc1 Amb22001648 [1,1,0,0,0,0|1,0,1]=4 3349 B11R1.36 CC(C)C(S)c1ccccc1 Amb18180117 [1,1,0,0,0,0|1,0,1]=4 3350 B11R1.36 CC(C)[C@@H](N)c1ccccc1 Amb22288656 [1,1,0,0,0,0|1,0,1]=4 3351 B11R1.36 CC(C)[C@@H](O)c1ccccc1 Amb22225177 [1,1,0,0,0,0|1,0,1]=4 3352 B11R1.36 CC(C)[C@H](Cl)c1ccccc1 Amb25028094 [1,1,0,0,0,0|1,0,1]=4 3353 B11R1.36 CC(C)[C@H](N)c1ccccc1 Amb22284327 [1,1,0,0,0,0|1,0,1]=4 3354 B11R1.36 CC(C)[C@H](N)c1ccccc1 Amb22288702 [1,1,0,0,0,0|1,0,1]=4 3355 B11R1.36 CC(C)[C@H](O)c1ccccc1 Amb22226521 [1,1,0,0,0,0|1,0,1]=4 3356 B11R1.36 CC(Cl)C(F)c1ccccc1 Amb25095827 [1,1,0,0,0,0|1,0,1]=4 3357 B11R1.36 CC(N)C(Br)c1ccccc1 Amb24542874 [1,1,0,0,0,0|1,0,1]=4 3358 B11R1.36 CC(N)C(F)c1ccccc1 Amb25189148 [1,1,0,0,0,0|1,0,1]=4 3359 B11R1.36 CC(N)C(N)c1ccccc1 Amb18644444 [1,1,0,0,0,0|1,0,1]=4 3360 B11R1.36 CC(O)C(Cl)c1ccccc1 Amb25724947 [1,1,0,0,0,0|0,0,2]=4 3361 B11R1.36 CC(O)C(F)c1ccccc1 Amb25148218 [1,1,0,0,0,0|0,0,2]=4 3362 B11R1.36 CC(O)C(S)c1ccccc1 Amb25145349 [1,1,0,0,0,0|0,0,2]=4 3363 B11R1.36 CC(O)[C@H](N)c1ccccc1 Amb24659547 [1,1,0,0,0,0|0,0,2]=4 3364 B11R1.36 CC(c1ccccc1)C(=O)C Amb17593697 [1,1,0,0,0,0|0,0,0]=2 3365 B11R1.36 CC(c1ccccc1)C(=S)N Amb17465747 [1,1,0,0,0,0|1,1,0]=4 3366 B11R1.36 CN(C)C(Cl)c1ccccc1 Amb25690215 [1,1,0,0,0,0|2,0,0]=4 3367 B11R1.36 CN(C)C(N)c1ccccc1 Amb19516165 [1,1,0,0,0,0|2,0,0]=4 3368 B11R1.36 CN(C)C(O)c1ccccc1 Amb24421296 [1,1,0,0,0,0|2,0,0]=4 3369 B11R1.36 CN(c1ccccc1)C(=O)N Amb1137584 [1,1,0,0,0,0|2,0,0]=4 3370 B11R1.36 CS(=O)C(Cl)c1ccccc1 Amb25778206 [1,1,0,0,0,0|1,0,0]=3 3371 B11R1.36 C[C@@H](B(O)O)c1ccccc1 Amb25687626 [1,1,0,0,0,0|1,0,1]=4 3372 B11R1.36 C[C@@H](C(C)N)c1ccccc1 Amb25200252 [1,1,0,0,0,0|1,0,1]=4 3373 B11R1.36 C[C@@H](C(N)=S)c1ccccc1 Amb25112155 [1,1,0,0,0,0|1,1,0]=4 3374 B11R1.36 C[C@@H](Cl)[C@@H](Cl)c1ccccc1 Amb24635727 [1,1,0,0,0,0|1,0,1]=4 3375 B11R1.36 C[C@@H](Cl)[C@@H](O)c1ccccc1 Amb24602441 [1,1,0,0,0,0|1,0,1]=4 3376 B11R1.36 C[C@@H](Cl)[C@H](O)c1ccccc1 Amb24433948 [1,1,0,0,0,0|1,0,1]=4 3377 B11R1.36 C[C@@H](F)[C@@H](O)c1ccccc1 Amb25346193 [1,1,0,0,0,0|1,0,1]=4 3378 B11R1.36 C[C@@H](N)[C@@H](S)c1ccccc1 Amb25129484 [1,1,0,0,0,0|1,0,1]=4 3379 B11R1.36 C[C@@H](O)[C@@H](Br)c1ccccc1 Amb25075563 [1,1,0,0,0,0|0,0,2]=4 3380 B11R1.36 C[C@@H](O)[C@@H](Cl)c1ccccc1 Amb25310965 [1,1,0,0,0,0|0,0,2]=4 3381 B11R1.36 C[C@@H](O)[C@@H](N)c1ccccc1 Amb24695036 [1,1,0,0,0,0|0,0,2]=4 3382 B11R1.36 C[C@@H](O)[C@@H](O)c1ccccc1 Amb23604600 [1,1,0,0,0,0|0,0,2]=4 3383 B11R1.36 C[C@@H](O)[C@H](Cl)c1ccccc1 Amb24433930 [1,1,0,0,0,0|0,0,2]=4 3384 B11R1.36 C[C@@H](O)[C@H](N)c1ccccc1 Amb25794225 [1,1,0,0,0,0|0,0,2]=4 3385 B11R1.36 C[C@@H](O)[C@H](O)c1ccccc1 Amb25789551 [1,1,0,0,0,0|0,0,2]=4 3386 B11R1.36 C[C@@H]([C@@H](C)N)c1ccccc1 Amb25789348 [1,1,0,0,0,0|1,0,1]=4 3387 B11R1.36 C[C@@H](c1ccccc1)N(C)C Amb10807413 [1,1,0,0,0,0|2,0,0]=4 3388 B11R1.36 C[C@@H](c1ccccc1)[C@@H](O)C Amb16210577 [1,1,0,0,0,0|0,0,2]=4 3389 B11R1.36 C[C@H](Br)[C@@H](F)c1ccccc1 Amb25055861 [1,1,0,0,0,0|1,0,1]=4 3390 B11R1.36 C[C@H](Br)[C@@H](O)c1ccccc1 Amb25844405 [1,1,0,0,0,0|1,0,1]=4 3391 B11R1.36 C[C@H](Br)[C@H](F)c1ccccc1 Amb25313145 [1,1,0,0,0,0|1,0,1]=4 3392 B11R1.36 C[C@H](C(C)N)c1ccccc1 Amb25339523 [1,1,0,0,0,0|1,0,1]=4 3393 B11R1.36 C[C@H](C(C)O)c1ccccc1 Amb24372048 [1,1,0,0,0,0|0,0,2]=4 3394 B11R1.36 C[C@H](Cl)[C@@H](N)c1ccccc1 Amb25211090 [1,1,0,0,0,0|1,0,1]=4 3395 B11R1.36 C[C@H](Cl)[C@H](Cl)c1ccccc1 Amb25322171 [1,1,0,0,0,0|1,0,1]=4 3396 B11R1.36 C[C@H](Cl)[C@H](O)c1ccccc1 Amb24442982 [1,1,0,0,0,0|1,0,1]=4 3397 B11R1.36 C[C@H](N)[C@@H](Cl)c1ccccc1 Amb24740855 [1,1,0,0,0,0|1,0,1]=4 3398 B11R1.36 C[C@H](N)[C@@H](F)c1ccccc1 Amb25251481 [1,1,0,0,0,0|1,0,1]=4 3399 B11R1.36 C[C@H](N)[C@@H](N)c1ccccc1 Amb25053950 [1,1,0,0,0,0|1,0,1]=4 3400 B11R1.36 C[C@H](N)[C@@H](O)c1ccccc1 Amb22349976 [1,1,0,0,0,0|1,0,1]=4 3401 B11R1.36 C[C@H](N)[C@@H](S)c1ccccc1 Amb25241973 [1,1,0,0,0,0|1,0,1]=4 3402 B11R1.36 C[C@H](N)[C@H](F)c1ccccc1 Amb25073105 [1,1,0,0,0,0|1,0,1]=4 3403 B11R1.36 C[C@H](O)C(O)c1ccccc1 Amb25806789 [1,1,0,0,0,0|0,0,2]=4 3404 B11R1.36 C[C@H](O)[C@@H](Cl)c1ccccc1 Amb25288148 [1,1,0,0,0,0|0,0,2]=4 3405 B11R1.36 C[C@H](O)[C@@H](N)c1ccccc1 Amb25791116 [1,1,0,0,0,0|0,0,2]=4 3406 B11R1.36 C[C@H](O)[C@@H](O)c1ccccc1 Amb25149680 [1,1,0,0,0,0|0,0,2]=4 3407 B11R1.36 C[C@H](O)[C@H](Cl)c1ccccc1 Amb25211675 [1,1,0,0,0,0|0,0,2]=4 3408 B11R1.36 C[C@H](O)[C@H](O)c1ccccc1 Amb25362712 [1,1,0,0,0,0|0,0,2]=4 3409 B11R1.36 C[C@H]([C@@H](C)Cl)c1ccccc1 Amb24652492 [1,1,0,0,0,0|1,0,1]=4 3410 B11R1.36 C\C(\N)=C(/O)\c1ccccc1 Amb24097762 [1,1,0,0,0,0|1,0,1]=4 3411 B11R1.36 C\C(\c1ccccc1)=C(\C)/Br Amb25211055 [1,1,0,0,0,0|1,0,1]=4 3412 B11R1.36 ClC(c1ccccc1)C(=O)N Amb1678054 [1,1,0,0,0,0|1,0,0]=3 3413 B11R1.36 ClC(c1ccccc1)C(C)C Amb17138646 [1,1,0,0,0,0|1,0,1]=4 3414 B11R1.36 ClC(c1ccccc1)C(N)C Amb17594246 [1,1,0,0,0,0|1,0,1]=4 3415 B11R1.36 ClC(c1ccncc1)C(=O)C Amb17477810 [1,1,0,0,0,0|1,0,0]=3 3416 B11R1.36 N=C(C(O)=O)c1ccccc1 Amb24581249 [1,1,0,0,0,0|0,0,1]=3 3417 B11R1.36 N=C(Cl)C(O)c1ccccc1 Amb25149713 [1,1,0,0,0,0|2,0,0]=4 3418 B11R1.36 NC(=N)C(F)c1ccccc1 Amb25069563 [1,1,0,0,0,0|2,0,0]=4 3419 B11R1.36 NC(=N)C(O)c1ccccc1 Amb19890170 [1,1,0,0,0,0|2,0,0]=4 3420 B11R1.36 NC(=N)[C@@H](O)c1ccccc1 Amb22587581 [1,1,0,0,0,0|2,0,0]=4 3421 B11R1.36 NC(=N)[C@H](O)c1ccccc1 Amb22587530 [1,1,0,0,0,0|2,0,0]=4 3422 B11R1.36 NC(=O)C(=N)c1ccccc1 Amb24714517 [1,1,0,0,0,0|1,0,1]=4 3423 B11R1.36 NC(=O)C(=O)c1ccccc1 Amb18560879 [1,1,0,0,0,0|1,0,1]=4 3424 B11R1.36 NC(=O)C(Br)c1ccccc1 Amb23450271 [1,1,0,0,0,0|1,0,0]=3 3425 B11R1.36 NC(=O)C(Cl)c1ccc[n]c1 Amb18185667 [1,1,0,0,0,0|2,0,0]=4 3426 B11R1.36 NC(=O)C(N)c1ccccc1 Amb22469872 [1,1,0,0,0,0|1,0,0]=3 3427 B11R1.36 NC(=O)C(O)c1cc[n]cc1 Amb25783931 [1,1,0,0,0,0|2,0,0]=4 3428 B11R1.36 NC(=O)C(O)c1ccc[n]c1 Amb18182774 [1,1,0,0,0,0|2,0,0]=4 3429 B11R1.36 NC(=O)C(O)c1cccc[n]1 Amb24396108 [1,1,0,0,0,0|2,0,0]=4 3430 B11R1.36 NC(=O)C(c1ccccn1)N Amb17334311 [1,1,0,0,0,0|2,0,0]=4 3431 B11R1.36 NC(=O)C(c1cccnc1)N Amb17334312 [1,1,0,0,0,0|2,0,0]=4 3432 B11R1.36 NC(=O)N(N)c1ccccc1 Amb18125271 [1,1,0,0,0,0|2,0,0]=4 3433 B11R1.36 NC(=O)N(O)c1ccccc1 Amb25765611 [1,1,0,0,0,0|2,0,0]=4 3434 B11R1.36 NC(=O)[C@@H](Br)c1ccccc1 Amb24611041 [1,1,0,0,0,0|1,0,0]=3 3435 B11R1.36 NC(=O)[C@@H](N)c1ccccc1 Amb22745343 [1,1,0,0,0,0|1,0,0]=3 3436 B11R1.36 NC(=O)[C@@H](O)c1ccccc1 Amb20671372 [1,1,0,0,0,0|1,0,0]=3 3437 B11R1.36 NC(=O)[C@H](Cl)c1ccccc1 Amb25320858 [1,1,0,0,0,0|1,0,0]=3 3438 B11R1.36 NC(=O)[C@H](F)c1ccccc1 Amb25027917 [1,1,0,0,0,0|1,0,0]=3 3439 B11R1.36 NC(=O)[C@H](N)c1ccccc1 Amb22353208 [1,1,0,0,0,0|1,0,0]=3 3440 B11R1.36 NC(=O)[C@H](O)c1ccccc1 Amb20671371 [1,1,0,0,0,0|1,0,0]=3 3441 B11R1.36 NC(=S)C(N)c1ccccc1 Amb19374911 [1,1,0,0,0,0|1,1,0]=4 3442 B11R1.36 NC(C(=O)Cl)c1ccccc1 Amb21912493 [1,1,0,0,0,0|1,0,0]=3 3443 B11R1.36 NC(C(O)=O)c1[n]ccc[n]1 Amb24738404 [1,1,0,0,0,0|2,0,0]=4 3444 B11R1.36 NC(C(O)=O)c1c[n]c[n]c1 Amb24485788 [1,1,0,0,0,0|2,0,0]=4 3445 B11R1.36 NC(C(O)=O)c1c[n]cc[n]1 Amb22899538 [1,1,0,0,0,0|2,0,0]=4 3446 B11R1.36 NC(C(O)=O)c1ccc[n][n]1 Amb18201157 [1,1,0,0,0,0|2,0,0]=4 3447 B11R1.36 NC(C(O)=O)c1cccc[n]1 Amb22496612 [1,1,0,0,0,0|1,0,0]=3 3448 B11R1.36 NC(c1ccccc1)C(=O)Cl Amb16203807 [1,1,0,0,0,0|1,0,0]=3 3449 B11R1.36 NC(c1ccccc1)C(=O)N Amb13951330 [1,1,0,0,0,0|1,0,0]=3 3450 B11R1.36 NC(c1ccccc1)C(=O)O Amb1869285 [1,1,0,0,0,0|0,0,0]=2 3451 B11R1.36 NC(c1ccccc1)C(C)C Amb1129834 [1,1,0,0,0,0|1,0,1]=4 3452 B11R1.36 NC(c1ccccc1)P(O)=O Amb25191187 [1,1,0,0,0,0|1,0,0]=3 3453 B11R1.36 NC(c1ccncc1)C(=O)N Amb17334313 [1,1,0,0,0,0|2,0,0]=4 3454 B11R1.36 N[C@@H](C(=O)Cl)c1ccccc1 Amb22351781 [1,1,0,0,0,0|1,0,0]=3 3455 B11R1.36 N[C@@H](C(O)=O)[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22351396 [1,1,0,0,0,0|0,0,0]=2 3456 B11R1.36 N[C@@H](C(O)=O)c1c[n]c[n]c1 Amb24485751 [1,1,0,0,0,0|2,0,0]=4 3457 B11R1.36 N[C@@H](C(O)=O)c1ccc[n]c1 Amb24074448 [1,1,0,0,0,0|1,0,0]=3 3458 B11R1.36 N[C@@H](C(O)=O)c1ccccc1 Amb22745585 [1,1,0,0,0,0|0,0,0]=2 3459 B11R1.36 N[C@@H](c1ccccc1)C(=O)N Amb10603128 [1,1,0,0,0,0|1,0,0]=3 3460 B11R1.36 N[C@@H](c1ccccc1)C(C)C Amb10608147 [1,1,0,0,0,0|1,0,1]=4 3461 B11R1.36 N[C@H](C(=O)Cl)c1ccccc1 Amb25152830 [1,1,0,0,0,0|1,0,0]=3 3462 B11R1.36 N[C@H](C(O)=O)c1c[n]c[n]c1 Amb24484501 [1,1,0,0,0,0|2,0,0]=4 3463 B11R1.36 N[C@H](c1ccccc1)P(O)O Amb25301291 [1,1,0,0,0,0|1,0,1]=4 3464 B11R1.36 O=C(Cl)[C@@H](Cl)c1ccccc1 Amb24657090 [1,1,0,0,0,0|1,0,0]=3 3465 B11R1.36 O=C(c1ccccc1)C(=C)C Amb17593661 [1,1,0,0,0,0|1,0,1]=4 3466 B11R1.36 O=C(c1ccccc1)C(=O)Br Amb24096833 [1,1,0,0,0,0|1,0,1]=4 3467 B11R1.36 O=C(c1ccccc1)C(=O)C Amb2099500 [1,1,0,0,0,0|0,0,1]=3 3468 B11R1.36 O=C(c1ccccc1)C(=O)Cl Amb17594226 [1,1,0,0,0,0|1,0,1]=4 3469 B11R1.36 OB(O)C(Cl)c1ccccc1 Amb24468112 [1,1,0,0,0,0|1,0,1]=4 3470 B11R1.36 OC(=O)C(=O)c1c[n]ccc1 Amb22492371 [1,1,0,0,0,0|1,0,1]=4 3471 B11R1.36 OC(=O)C(=O)c1cc[n]cc1 Amb18125209 [1,1,0,0,0,0|1,0,1]=4 3472 B11R1.36 OC(=O)C(=O)c1cccc[n]1 Amb18831273 [1,1,0,0,0,0|1,0,1]=4 3473 B11R1.36 OC(=O)C(=O)c1cccnc1 Amb15701278 [1,1,0,0,0,0|1,0,1]=4 3474 B11R1.36 OC(=O)C(Br)c1ccc[n]c1 Amb19929998 [1,1,0,0,0,0|1,0,0]=3 3475 B11R1.36 OC(=O)C(Br)c1cccc[n]1 Amb24081184 [1,1,0,0,0,0|1,0,0]=3 3476 B11R1.36 OC(=O)C(Cl)c1cc[n]cc1 Amb24488132 [1,1,0,0,0,0|1,0,0]=3 3477 B11R1.36 OC(=O)C(Cl)c1ccc[n]c1 Amb24089492 [1,1,0,0,0,0|1,0,0]=3 3478 B11R1.36 OC(=O)C(F)c1c[n]cc[n]1 Amb25358269 [1,1,0,0,0,0|2,0,0]=4 3479 B11R1.36 OC(=O)C(F)c1cc[n]cc1 Amb24466152 [1,1,0,0,0,0|1,0,0]=3 3480 B11R1.36 OC(=O)C(F)c1cccc[n]1 Amb25149165 [1,1,0,0,0,0|1,0,0]=3 3481 B11R1.36 OC(=O)C(O)c1c[n]cc[n]1 Amb18200877 [1,1,0,0,0,0|2,0,0]=4 3482 B11R1.36 OC(=O)C(O)c1c[n]ccc1 Amb18952024 [1,1,0,0,0,0|1,0,0]=3 3483 B11R1.36 OC(=O)C(O)c1c[n]ccc1 Amb19373382 [1,1,0,0,0,0|1,0,0]=3 3484 B11R1.36 OC(=O)C(O)c1cc[n]cc1 Amb18201200 [1,1,0,0,0,0|1,0,0]=3 3485 B11R1.36 OC(=O)C(O)c1cccc[n]1 Amb18201201 [1,1,0,0,0,0|1,0,0]=3 3486 B11R1.36 OC(=O)C(O)c1ccccc1 Amb22729762 [1,1,0,0,0,0|0,0,0]=2 3487 B11R1.36 OC(=O)C(O)c1ccccc1 Amb22732258 [1,1,0,0,0,0|0,0,0]=2 3488 B11R1.36 OC(=O)C(c1ccccc1)N Amb2228457 [1,1,0,0,0,0|0,0,0]=2 3489 B11R1.36 OC(=O)C(c1cccnc1)N Amb10632723 [1,1,0,0,0,0|1,0,0]=3 3490 B11R1.36 OC(=O)[C@@H](Br)c1ccccc1 Amb25056175 [1,1,0,0,0,0|0,0,0]=2 3491 B11R1.36 OC(=O)[C@@H](O)c1c[n]ccc1 Amb24595431 [1,1,0,0,0,0|1,0,0]=3 3492 B11R1.36 OC(=O)[C@H](Cl)c1ccccc1 Amb24650918 [1,1,0,0,0,0|0,0,0]=2 3493 B11R1.36 OC(=O)[C@H](O)c1c[n]ccc1 Amb25060746 [1,1,0,0,0,0|1,0,0]=3 3494 B11R1.36 OC(C(=O)Br)c1ccccc1 Amb24095709 [1,1,0,0,0,0|1,0,0]=3 3495 B11R1.36 OC(C(=O)S)c1ccccc1 Amb25681441 [1,1,0,0,0,0|0,1,0]=3 3496 B11R1.36 OC(c1c[n]ccc1)P(O)=O Amb24502009 [1,1,0,0,0,0|2,0,0]=4 3497 B11R1.36 OC(c1ccccc1)C(=C)C Amb10807411 [1,1,0,0,0,0|1,0,0]=3 3498 B11R1.36 OC(c1ccccc1)C(=O)C Amb17593725 [1,1,0,0,0,0|0,0,0]=2 3499 B11R1.36 OC(c1ccccc1)C(Br)C Amb17595842 [1,1,0,0,0,0|1,0,1]=4 3500 B11R1.36 OC(c1ccccc1)P(O)=O Amb21618921 [1,1,0,0,0,0|1,0,0]=3 3501 B11R1.36 O[C@@H](C(=O)Cl)c1ccccc1 Amb25683267 [1,1,0,0,0,0|1,0,0]=3 3502 B11R1.36 O[C@@H](c1ccccc1)C(=O)C Amb17619252 [1,1,0,0,0,0|0,0,0]=2 3503 B11R1.36 O[C@@H](c1ccccc1)[C@@H](N)C Amb17619646 [1,1,0,0,0,0|1,0,1]=4 3504 B11R1.36 O[C@H](c1ccccc1)[C@H](N)C Amb10071337 [1,1,0,0,0,0|1,0,1]=4 3505 B11R1.36 SC(c1ccccc1)C(=O)C Amb17594139 [1,1,0,0,0,0|0,0,0]=2 3506 B11R1.36 [NH3+]C(C(O)=O)c1ccccc1 Amb22641589 [1,1,0,0,0,0|0,0,0]=2 3507 B11R1.36 [O-]C(=O)C(O)c1cccc[n]1 Amb23452663 [1,1,0,0,0,0|1,0,1]=4 3508 B11R1.36 [O-]C(=O)C(O)c1ccccc1 Amb22729281 [1,1,0,0,0,0|0,0,1]=3 3509 B11R1.36 [O-]C(=O)C(O)c1ccccc1 Amb22732065 [1,1,0,0,0,0|0,0,1]=3 3510 B11R1.36 [O-]C(c1cccc[n]1)C(O)=O Amb22453597 [1,1,0,0,0,0|1,0,0]=3 3511 B11R1.86 C=C(Br)Cc1ccccc1O Amb25147877 [1,1,0,0,0,0|1,0,1]=4 3512 B11R1.86 C=C(Cl)Cc1ccccc1O Amb18126586 [1,1,0,0,0,0|1,0,1]=4 3513 B11R1.86 C=C1C=CC=CC1CC(O)=O Amb24396318 [1,1,0,0,0,0|0,0,1]=3 3514 B11R1.86 CC(=C)CN1C=CC=CC1=O Amb24426989 [1,1,0,0,0,0|2,0,0]=4 3515 B11R1.86 CC(=C)Cc1ccc[n]c1F Amb25831076 [1,1,0,0,0,0|2,0,0]=4 3516 B11R1.86 CC(=C)Cc1ccccc1N Amb18124844 [1,1,0,0,0,0|1,0,0]=3 3517 B11R1.86 CC(=C)Cc1ccccc1O Amb18124924 [1,1,0,0,0,0|1,0,0]=3 3518 B11R1.86 CC(=C)Sc1ccccc1O Amb18646620 [1,1,0,0,0,0|2,0,0]=4 3519 B11R1.86 CC(=N)Nc1ccccc1F Amb25087719 [1,1,0,0,0,0|2,0,0]=4 3520 B11R1.86 CC(=N)Nc1ccccc1I Amb25064560 [1,1,0,0,0,0|2,0,0]=4 3521 B11R1.86 CC(=O)CC1=NC=CNC1=O Amb18201469 [1,1,0,0,0,0|2,0,0]=4 3522 B11R1.86 CC(=O)CC1C=CNC=C1Cl Amb25294889 [1,1,0,0,0,0|1,0,1]=4 3523 B11R1.86 CC(=O)CN1C=CC=CC1=O Amb18177167 [1,1,0,0,0,0|1,0,0]=3 3524 B11R1.86 CC(=O)CN1C=CC=CC1=S Amb20647758 [1,1,0,0,0,0|1,0,0]=3 3525 B11R1.86 CC(=O)CN1C=CC=NC1=N Amb24707140 [1,1,0,0,0,0|2,0,0]=4 3526 B11R1.86 CC(=O)CN1C=CC=NC1=O Amb18182773 [1,1,0,0,0,0|2,0,0]=4 3527 B11R1.86 CC(=O)CN1C=CC=NC1=[NH2+] Amb20661238 [1,1,0,0,0,0|2,0,0]=4 3528 B11R1.86 CC(=O)CN1N=CC=CC1=O Amb18179415 [1,1,0,0,0,0|2,0,0]=4 3529 B11R1.86 CC(=O)C[n+]1ccccc1Br Amb2522951 [1,1,0,0,0,0|1,0,0]=3 3530 B11R1.86 CC(=O)C[n+]1ccccc1C Amb2556861 [1,1,0,0,0,0|1,0,0]=3 3531 B11R1.86 CC(=O)C[n+]1ccccc1N Amb24470768 [1,1,0,0,0,0|1,0,0]=3 3532 B11R1.86 CC(=O)Cc1[n]cc[n]c1Cl Amb24662372 [1,1,0,0,0,0|2,0,0]=4 3533 B11R1.86 CC(=O)Cc1[n]cccc1Cl Amb25169236 [1,1,0,0,0,0|1,0,0]=3 3534 B11R1.86 CC(=O)Cc1[n]cccc1F Amb23402724 [1,1,0,0,0,0|1,0,0]=3 3535 B11R1.86 CC(=O)Cc1c[n]c[n]c1Cl Amb25268464 [1,1,0,0,0,0|2,0,0]=4 3536 B11R1.86 CC(=O)Cc1c[n]ccc1N Amb25824114 [1,1,0,0,0,0|1,0,0]=3 3537 B11R1.86 CC(=O)Cc1cc[n]cc1F Amb25152854 [1,1,0,0,0,0|1,0,0]=3 3538 B11R1.86 CC(=O)Cc1cc[n]cc1O Amb24579005 [1,1,0,0,0,0|1,0,0]=3 3539 B11R1.86 CC(=O)Cc1ccc[n]c1N Amb25789980 [1,1,0,0,0,0|1,0,0]=3 3540 B11R1.86 CC(=O)Cc1cccc[n+]1C Amb16224769 [1,1,0,0,0,0|1,0,0]=3 3541 B11R1.86 CC(=O)Cc1ccccc1I Amb24431271 [1,1,0,0,0,0|0,0,0]=2 3542 B11R1.86 CC(=O)Cc1ccccc1O Amb18041942 [1,1,0,0,0,0|0,0,0]=2 3543 B11R1.86 CC(=O)Cc1ccccc1S Amb25312284 [1,1,0,0,0,0|0,0,0]=2 3544 B11R1.86 CC(=O)Cc1ncccc1C Amb1995156 [1,1,0,0,0,0|1,0,0]=3 3545 B11R1.86 CC(=O)NC1=CC=CNC1=O Amb22747067 [1,1,0,0,0,0|2,0,0]=4 3546 B11R1.86 CC(=O)NC1=CC=CNC1=S Amb25322217 [1,1,0,0,0,0|2,0,0]=4 3547 B11R1.86 CC(=O)NC1=COC=CC1=O Amb25287593 [1,1,0,0,0,0|2,0,0]=4 3548 B11R1.86 CC(=O)Nc1[n]cccc1Cl Amb24083706 [1,1,0,0,0,0|2,0,0]=4 3549 B11R1.86 CC(=O)Nc1[n]cccc1F Amb23401859 [1,1,0,0,0,0|2,0,0]=4 3550 B11R1.86 CC(=O)Nc1[n]cccc1N Amb18125264 [1,1,0,0,0,0|2,0,0]=4 3551 B11R1.86 CC(=O)Nc1c[n]ccc1Cl Amb22495899 [1,1,0,0,0,0|2,0,0]=4 3552 B11R1.86 CC(=O)Nc1c[n]ccc1N Amb20247153 [1,1,0,0,0,0|2,0,0]=4 3553 B11R1.86 CC(=O)Nc1c[n]ccc1N Amb24083708 [1,1,0,0,0,0|2,0,0]=4 3554 B11R1.86 CC(=O)Nc1cc[n]cc1Cl Amb25187612 [1,1,0,0,0,0|2,0,0]=4 3555 B11R1.86 CC(=O)Nc1ccc[n]c1I Amb24613116 [1,1,0,0,0,0|2,0,0]=4 3556 B11R1.86 CC(=O)Nc1ccccc1F Amb2444091 [1,1,0,0,0,0|1,0,0]=3 3557 B11R1.86 CC(=O)Nc1ccccc1N Amb1121033 [1,1,0,0,0,0|1,0,0]=3 3558 B11R1.86 CC(=O)Nc1ccccc1O Amb1212257 [1,1,0,0,0,0|1,0,0]=3 3559 B11R1.86 CC(=O)Nc1ccccc1S Amb16186713 [1,1,0,0,0,0|1,0,0]=3 3560 B11R1.86 CC(=O)Nc1cccnc1O Amb13889927 [1,1,0,0,0,0|2,0,0]=4 3561 B11R1.86 CC(=O)Nc1cccoc1=O Amb24072052 [1,1,0,0,0,0|2,0,0]=4 3562 B11R1.86 CC(=O)Nc1ccncc1N Amb16230402 [1,1,0,0,0,0|2,0,0]=4 3563 B11R1.86 CC(=O)Nc1ccncc1O Amb13889918 [1,1,0,0,0,0|2,0,0]=4 3564 B11R1.86 CC(=O)Nc1cnccc1O Amb13889919 [1,1,0,0,0,0|2,0,0]=4 3565 B11R1.86 CC(=O)OC1=CC=CNC1=O Amb20660071 [1,1,0,0,0,0|2,0,0]=4 3566 B11R1.86 CC(=O)OC1=CC=CNC1=S Amb24677788 [1,1,0,0,0,0|2,0,0]=4 3567 B11R1.86 CC(=O)OC1=COC=CC1=O Amb25288533 [1,1,0,0,0,0|2,0,0]=4 3568 B11R1.86 CC(=O)ON1C=CC=CC1=O Amb24713195 [1,1,0,0,0,0|2,0,0]=4 3569 B11R1.86 CC(=O)Oc1[n]cccc1Br Amb25258912 [1,1,0,0,0,0|2,0,0]=4 3570 B11R1.86 CC(=O)Oc1c[n]ccc1Br Amb23412302 [1,1,0,0,0,0|2,0,0]=4 3571 B11R1.86 CC(=O)Oc1ccccc1Br Amb20242519 [1,1,0,0,0,0|1,0,0]=3 3572 B11R1.86 CC(=O)Oc1ccccc1F Amb10605688 [1,1,0,0,0,0|1,0,0]=3 3573 B11R1.86 CC(=O)Oc1ccccc1I Amb10975213 [1,1,0,0,0,0|1,0,0]=3 3574 B11R1.86 CC(=O)Oc1ccccc1N Amb18644456 [1,1,0,0,0,0|1,0,0]=3 3575 B11R1.86 CC(=O)Oc1ccccc1O Amb18125344 [1,1,0,0,0,0|1,0,0]=3 3576 B11R1.86 CC(=O)Oc1cccnc1I Amb2405507 [1,1,0,0,0,0|2,0,0]=4 3577 B11R1.86 CC(=O)\C=C\1/C=CC=CN1C Amb25282770 [1,1,0,0,0,0|1,0,1]=4 3578 B11R1.86 CC(=O)\N=C/1\C=CC=CC1N Amb24072876 [1,1,0,0,0,0|1,0,1]=4 3579 B11R1.86 CC(=S)Nc1ccccc1Br Amb22728786 [1,1,0,0,0,0|1,1,0]=4 3580 B11R1.86 CC(=S)Nc1ccccc1Cl Amb24640250 [1,1,0,0,0,0|1,1,0]=4 3581 B11R1.86 CC(=S)Nc1ccccc1F Amb25742786 [1,1,0,0,0,0|1,1,0]=4 3582 B11R1.86 CC(Br)Cc1ccccc1Cl Amb24477523 [1,1,0,0,0,0|1,0,1]=4 3583 B11R1.86 CC(Br)Cc1ccccc1F Amb24477522 [1,1,0,0,0,0|1,0,1]=4 3584 B11R1.86 CC(C)=Cc1ccccc1N Amb24509254 [1,1,0,0,0,0|1,0,1]=4 3585 B11R1.86 CC(C)=Cc1ccccc1O Amb18124916 [1,1,0,0,0,0|1,0,1]=4 3586 B11R1.86 CC(C)=Nc1ccccc1N Amb25326372 [1,1,0,0,0,0|2,0,0]=4 3587 B11R1.86 CC(C)=Nc1ccccc1O Amb25370803 [1,1,0,0,0,0|2,0,0]=4 3588 B11R1.86 CC(C)Cc1ccccc1Br Amb23400887 [1,1,0,0,0,0|1,0,1]=4 3589 B11R1.86 CC(C)Cc1ccccc1N Amb18644400 [1,1,0,0,0,0|1,0,1]=4 3590 B11R1.86 CC(C)Cc1ccccc1O Amb18125161 [1,1,0,0,0,0|1,0,1]=4 3591 B11R1.86 CC(Cc1ccccc1C)Cl Amb17477590 [1,1,0,0,0,0|1,0,1]=4 3592 B11R1.86 CC(Cc1ccccc1C)N Amb10609282 [1,1,0,0,0,0|1,0,1]=4 3593 B11R1.86 CC(Cc1ccccc1C)O Amb17138429 [1,1,0,0,0,0|0,0,2]=4 3594 B11R1.86 CC(Cc1ccccc1Cl)Cl Amb17477735 [1,1,0,0,0,0|1,0,1]=4 3595 B11R1.86 CC(Cc1ccccc1Cl)O Amb17138668 [1,1,0,0,0,0|0,0,2]=4 3596 B11R1.86 CC(Cc1ccccc1F)O Amb17138450 [1,1,0,0,0,0|0,0,2]=4 3597 B11R1.86 CC(Cl)Cc1ccccc1Br Amb25289973 [1,1,0,0,0,0|1,0,1]=4 3598 B11R1.86 CC(Cl)Cc1ccccc1F Amb18178039 [1,1,0,0,0,0|1,0,1]=4 3599 B11R1.86 CC(Cl)Cc1ccccc1N Amb25028099 [1,1,0,0,0,0|1,0,1]=4 3600 B11R1.86 CC(F)Cc1ccccc1O Amb24486439 [1,1,0,0,0,0|1,0,1]=4 3601 B11R1.86 CC(N)Cc1ccccc1Br Amb20626162 [1,1,0,0,0,0|1,0,1]=4 3602 B11R1.86 CC(N)Cc1ccccc1F Amb22055289 [1,1,0,0,0,0|1,0,1]=4 3603 B11R1.86 CC(N)Cc1ccccc1N Amb24070090 [1,1,0,0,0,0|1,0,1]=4 3604 B11R1.86 CC(O)Cc1ccccc1N Amb24369609 [1,1,0,0,0,0|0,0,2]=4 3605 B11R1.86 CC(O)Cc1ccccc1O Amb18125386 [1,1,0,0,0,0|0,0,2]=4 3606 B11R1.86 CC(O)Cc1ccccc1S Amb25346291 [1,1,0,0,0,0|0,0,2]=4 3607 B11R1.86 CN(C)Cc1ccccc1C Amb17663824 [1,1,0,0,0,0|2,0,0]=4 3608 B11R1.86 CN(C)Cc1ccccc1Cl Amb17827038 [1,1,0,0,0,0|2,0,0]=4 3609 B11R1.86 CN(C)Cc1ccccc1F Amb17717255 [1,1,0,0,0,0|2,0,0]=4 3610 B11R1.86 CN(C)Cc1ccccc1N Amb22755856 [1,1,0,0,0,0|2,0,0]=4 3611 B11R1.86 CN(C)Cc1ccccc1O Amb21868780 [1,1,0,0,0,0|2,0,0]=4 3612 B11R1.86 CN(C)Cc1ccccc1O Amb22730884 [1,1,0,0,0,0|2,0,0]=4 3613 B11R1.86 CN(C)Cc1ccccc1S Amb19649790 [1,1,0,0,0,0|2,0,0]=4 3614 B11R1.86 CN(Cc1ccccc1I)C Amb10071381 [1,1,0,0,0,0|2,0,0]=4 3615 B11R1.86 CN(Cc1ccccc1N)C Amb13949144 [1,1,0,0,0,0|2,0,0]=4 3616 B11R1.86 CN(Cc1ccccc1O)C Amb2052288 [1,1,0,0,0,0|2,0,0]=4 3617 B11R1.86 CN(N)Cc1ccccc1Br Amb25692412 [1,1,0,0,0,0|2,0,0]=4 3618 B11R1.86 CN(N)Cc1ccccc1Cl Amb18563932 [1,1,0,0,0,0|2,0,0]=4 3619 B11R1.86 CN(N)Cc1ccccc1F Amb18065410 [1,1,0,0,0,0|2,0,0]=4 3620 B11R1.86 CN(N)Cc1ccccc1O Amb24614787 [1,1,0,0,0,0|2,0,0]=4 3621 B11R1.86 CN(O)Cc1ccccc1O Amb24676904 [1,1,0,0,0,0|1,0,1]=4 3622 B11R1.86 CS(=O)Cc1ccc[n]c1N Amb25775357 [1,1,0,0,0,0|2,0,0]=4 3623 B11R1.86 CS(=O)Cc1ccccc1Cl Amb24485114 [1,1,0,0,0,0|1,0,0]=3 3624 B11R1.86 CS(=O)Cc1ccccc1N Amb18282229 [1,1,0,0,0,0|1,0,0]=3 3625 B11R1.86 CS(=O)Cc1ccccc1O Amb24486438 [1,1,0,0,0,0|1,0,0]=3 3626 B11R1.86 CS(=O)Nc1ccccc1Br Amb25177190 [1,1,0,0,0,0|2,0,0]=4 3627 B11R1.86 CS(=O)Nc1ccccc1I Amb24725109 [1,1,0,0,0,0|2,0,0]=4 3628 B11R1.86 CS(=O)Nc1ccccc1N Amb24578252 [1,1,0,0,0,0|2,0,0]=4 3629 B11R1.86 CS(=O)Nc1ccccc1O Amb25177210 [1,1,0,0,0,0|2,0,0]=4 3630 B11R1.86 C[C@@H](N)Cc1ccccc1N Amb25844561 [1,1,0,0,0,0|1,0,1]=4 3631 B11R1.86 C[C@@H](O)Cc1ccccc1Cl Amb25842201 [1,1,0,0,0,0|0,0,2]=4 3632 B11R1.86 C[C@@H](O)Cc1ccccc1O Amb22896916 [1,1,0,0,0,0|0,0,2]=4 3633 B11R1.86 C[C@H](N)Cc1ccccc1Cl Amb25793461 [1,1,0,0,0,0|1,0,1]=4 3634 B11R1.86 C[C@H](N)Cc1ccccc1F Amb25726401 [1,1,0,0,0,0|1,0,1]=4 3635 B11R1.86 C[C@H](N)Cc1ccccc1N Amb24419036 [1,1,0,0,0,0|1,0,1]=4 3636 B11R1.86 C[C@H](O)Cc1ccccc1F Amb25792429 [1,1,0,0,0,0|0,0,2]=4 3637 B11R1.86 Cc1[n]cc[n]c1CC(C)=O Amb18201921 [1,1,0,0,0,0|2,0,0]=4 3638 B11R1.86 Cc1[n]cc[n]c1CC(O)=O Amb18201468 [1,1,0,0,0,0|2,0,0]=4 3639 B11R1.86 Cc1[n]cccc1CC(=O)Cl Amb25364584 [1,1,0,0,0,0|2,0,0]=4 3640 B11R1.86 Cc1[n]cccc1CC(O)=O Amb18215698 [1,1,0,0,0,0|1,0,0]=3 3641 B11R1.86 Cc1[n]cccc1NC(C)=O Amb22750736 [1,1,0,0,0,0|2,0,0]=4 3642 B11R1.86 Cc1[n]cccc1OC(C)=O Amb24485974 [1,1,0,0,0,0|2,0,0]=4 3643 B11R1.86 Cc1c[n]ccc1NC(C)=O Amb20248230 [1,1,0,0,0,0|2,0,0]=4 3644 B11R1.86 Cc1cc[n]cc1CC(C)=C Amb24356431 [1,1,0,0,0,0|2,0,0]=4 3645 B11R1.86 Cc1cc[n]cc1CC(O)=O Amb18201752 [1,1,0,0,0,0|1,0,0]=3 3646 B11R1.86 Cc1cc[n]cc1OC(C)=O Amb24102576 [1,1,0,0,0,0|2,0,0]=4 3647 B11R1.86 Cc1ccc[n]c1CC(N)=O Amb25114188 [1,1,0,0,0,0|2,0,0]=4 3648 B11R1.86 Cc1ccc[n]c1CC(O)=O Amb20247885 [1,1,0,0,0,0|1,0,0]=3 3649 B11R1.86 Cc1ccc[n]c1CC(O)=O Amb22587588 [1,1,0,0,0,0|1,0,0]=3 3650 B11R1.86 Cc1ccccc1CB(O)O Amb25728634 [1,1,0,0,0,0|1,0,1]=4 3651 B11R1.86 Cc1ccccc1CC(N)=N Amb20622866 [1,1,0,0,0,0|2,0,0]=4 3652 B11R1.86 Cc1ccccc1CN(C)N Amb18064378 [1,1,0,0,0,0|2,0,0]=4 3653 B11R1.86 Cc1ccccc1C[C@@H](C)O Amb24432685 [1,1,0,0,0,0|0,0,2]=4 3654 B11R1.86 Cc1ccccc1NC(=O)Cl Amb24668975 [1,1,0,0,0,0|2,0,0]=4 3655 B11R1.86 Cc1ccccc1OC(=O)Cl Amb24055454 [1,1,0,0,0,0|2,0,0]=4 3656 B11R1.86 Cc1ccccc1SC(C)=O Amb25189277 [1,1,0,0,0,0|1,0,0]=3 3657 B11R1.86 ClC(=O)Oc1ccccc1Cl Amb10844668 [1,1,0,0,0,0|2,0,0]=4 3658 B11R1.86 N=C1C=CC=CN1CC(O)=O Amb19888680 [1,1,0,0,0,0|1,0,0]=3 3659 B11R1.86 N=C1C=CN=CN1CC(O)=O Amb24365199 [1,1,0,0,0,0|2,0,0]=4 3660 B11R1.86 NC(=N)Cc1ccccc1Br Amb16231135 [1,1,0,0,0,0|2,0,0]=4 3661 B11R1.86 NC(=N)Cc1ccccc1Cl Amb20673127 [1,1,0,0,0,0|2,0,0]=4 3662 B11R1.86 NC(=N)Cc1ccccc1O Amb25045573 [1,1,0,0,0,0|2,0,0]=4 3663 B11R1.86 NC(=O)CN1C=CC=CC1=O Amb18182770 [1,1,0,0,0,0|2,0,0]=4 3664 B11R1.86 NC(=O)C[n+]1ccccc1C Amb10567653 [1,1,0,0,0,0|2,0,0]=4 3665 B11R1.86 NC(=O)C[n+]1ccccc1F Amb25051063 [1,1,0,0,0,0|2,0,0]=4 3666 B11R1.86 NC(=O)Cc1[n]cccc1O Amb18125364 [1,1,0,0,0,0|2,0,0]=4 3667 B11R1.86 NC(=O)Cc1ccccc1C Amb2107849 [1,1,0,0,0,0|1,0,0]=3 3668 B11R1.86 NC(=O)Cc1ccccc1I Amb24685113 [1,1,0,0,0,0|1,0,0]=3 3669 B11R1.86 NC(=O)Cc1ccccc1N Amb1116123 [1,1,0,0,0,0|1,0,0]=3 3670 B11R1.86 NC(=O)Nc1ccccc1Br Amb1140530 [1,1,0,0,0,0|2,0,0]=4 3671 B11R1.86 NC(=O)Nc1ccccc1Cl Amb1131193 [1,1,0,0,0,0|2,0,0]=4 3672 B11R1.86 NC(=O)Nc1ccccc1F Amb1211836 [1,1,0,0,0,0|2,0,0]=4 3673 B11R1.86 NC(=O)Nc1ccccc1N Amb1114330 [1,1,0,0,0,0|2,0,0]=4 3674 B11R1.86 NC(=O)Nc1ccccc1O Amb18125361 [1,1,0,0,0,0|2,0,0]=4 3675 B11R1.86 NC(=O)Oc1ccccc1C Amb10576081 [1,1,0,0,0,0|2,0,0]=4 3676 B11R1.86 NC(=O)Oc1ccccc1Cl Amb10575594 [1,1,0,0,0,0|2,0,0]=4 3677 B11R1.86 NC(=O)Oc1ccccc1F Amb16227453 [1,1,0,0,0,0|2,0,0]=4 3678 B11R1.86 NC(=O)Sc1ccccc1Cl Amb24739645 [1,1,0,0,0,0|2,0,0]=4 3679 B11R1.86 NC(O)Cc1ccccc1O Amb25051465 [1,1,0,0,0,0|1,0,1]=4 3680 B11R1.86 Nc1[n]c[n]cc1CC(O)=O Amb18201153 [1,1,0,0,0,0|2,0,0]=4 3681 B11R1.86 Nc1[n]cccc1CC(O)=O Amb21962140 [1,1,0,0,0,0|1,0,0]=3 3682 B11R1.86 Nc1c[n]ccc1CC(O)=O Amb20171419 [1,1,0,0,0,0|1,0,0]=3 3683 B11R1.86 Nc1cc[n]cc1CC(O)=O Amb20171456 [1,1,0,0,0,0|1,0,0]=3 3684 B11R1.86 Nc1cc[n]cc1CC(O)=O Amb22491670 [1,1,0,0,0,0|1,0,0]=3 3685 B11R1.86 Nc1ccc[n]c1CC(O)=O Amb18125358 [1,1,0,0,0,0|1,0,0]=3 3686 B11R1.86 Nc1ccccc1OC(N)=O Amb24636357 [1,1,0,0,0,0|2,0,0]=4 3687 B11R1.86 O=C(F)Nc1ccccc1Cl Amb25189380 [1,1,0,0,0,0|2,0,0]=4 3688 B11R1.86 O=S(Cl)Cc1ccccc1F Amb24654921 [1,1,0,0,0,0|2,0,0]=4 3689 B11R1.86 OB(O)Cc1ccccc1Cl Amb24723210 [1,1,0,0,0,0|1,0,1]=4 3690 B11R1.86 OC(=O)CC1=CC=CNC1=O Amb18925114 [1,1,0,0,0,0|1,0,0]=3 3691 B11R1.86 OC(=O)CC1=CN=CNC1=O Amb19516784 [1,1,0,0,0,0|2,0,0]=4 3692 B11R1.86 OC(=O)CC1=CNC=CC1=O Amb25684519 [1,1,0,0,0,0|1,0,0]=3 3693 B11R1.86 OC(=O)CN1C=CC=CC1=O Amb18536106 [1,1,0,0,0,0|1,0,0]=3 3694 B11R1.86 OC(=O)CN1C=CC=NC1=O Amb18284125 [1,1,0,0,0,0|2,0,0]=4 3695 B11R1.86 OC(=O)CN1C=NC=CC1=O Amb25830306 [1,1,0,0,0,0|2,0,0]=4 3696 B11R1.86 OC(=O)CN1N=CC=CC1=O Amb18288263 [1,1,0,0,0,0|2,0,0]=4 3697 B11R1.86 OC(=O)Cc1[n]c[n]cc1Br Amb22496247 [1,1,0,0,0,0|2,0,0]=4 3698 B11R1.86 OC(=O)Cc1[n]c[n]cc1Cl Amb22496228 [1,1,0,0,0,0|2,0,0]=4 3699 B11R1.86 OC(=O)Cc1[n]cc[n]c1Cl Amb22498026 [1,1,0,0,0,0|2,0,0]=4 3700 B11R1.86 OC(=O)Cc1[n]cccc1Br Amb20247878 [1,1,0,0,0,0|1,0,0]=3 3701 B11R1.86 OC(=O)Cc1[n]cccc1Br Amb20247879 [1,1,0,0,0,0|1,0,0]=3 3702 B11R1.86 OC(=O)Cc1[n]cccc1Cl Amb19516058 [1,1,0,0,0,0|1,0,0]=3 3703 B11R1.86 OC(=O)Cc1[n]cccc1F Amb20247871 [1,1,0,0,0,0|1,0,0]=3 3704 B11R1.86 OC(=O)Cc1c[n]c[n]c1Cl Amb18198128 [1,1,0,0,0,0|2,0,0]=4 3705 B11R1.86 OC(=O)Cc1c[n]ccc1Br Amb24105356 [1,1,0,0,0,0|1,0,0]=3 3706 B11R1.86 OC(=O)Cc1c[n]ccc1Cl Amb18198378 [1,1,0,0,0,0|1,0,0]=3 3707 B11R1.86 OC(=O)Cc1c[n]ccc1F Amb20247893 [1,1,0,0,0,0|1,0,0]=3 3708 B11R1.86 OC(=O)Cc1cc[n]cc1Br Amb23586154 [1,1,0,0,0,0|1,0,0]=3 3709 B11R1.86 OC(=O)Cc1cc[n]cc1Cl Amb18198379 [1,1,0,0,0,0|1,0,0]=3 3710 B11R1.86 OC(=O)Cc1cc[n]cc1F Amb24379723 [1,1,0,0,0,0|1,0,0]=3 3711 B11R1.86 OC(=O)Cc1ccc[n]c1Br Amb25834640 [1,1,0,0,0,0|1,0,0]=3 3712 B11R1.86 OC(=O)Cc1ccc[n]c1F Amb20247892 [1,1,0,0,0,0|1,0,0]=3 3713 B11R1.86 OC(=O)Cc1ccccc1Br Amb1139894 [1,1,0,0,0,0|0,0,0]=2 3714 B11R1.86 OC(=O)Cc1ccccc1O Amb2388914 [1,1,0,0,0,0|0,0,0]=2 3715 B11R1.86 OC(=O)Cc1ccccc1S Amb17616851 [1,1,0,0,0,0|0,0,0]=2 3716 B11R1.86 OC(=O)Nc1ccccc1C Amb1261710 [1,1,0,0,0,0|1,0,0]=3 3717 B11R1.86 OC(=S)Cc1ccccc1Br Amb24065440 [1,1,0,0,0,0|0,1,0]=3 3718 B11R1.86 OC(=S)Cc1ccccc1F Amb24065632 [1,1,0,0,0,0|0,1,0]=3 3719 B11R1.86 Oc1[n]cc[n]c1CC(O)=O Amb18831046 [1,1,0,0,0,0|2,0,0]=4 3720 B11R1.86 Oc1c[n]ccc1CC(O)=O Amb25849124 [1,1,0,0,0,0|1,0,0]=3 3721 B11R1.86 Oc1ccc[n]c1CC(O)=O Amb18125512 [1,1,0,0,0,0|1,0,0]=3 3722 B11R1.86 Oc1ccc[n]c1CC(O)=O Amb20247882 [1,1,0,0,0,0|1,0,0]=3 3723 B11R1.86 Oc1ccccc1OC(=O)Cl Amb25284326 [1,1,0,0,0,0|2,0,0]=4 3724 B11R1.86 [O-]C(=O)Cc1[n]cccc1Cl Amb22899565 [1,1,0,0,0,0|1,0,1]=4 3725 B11R1.86 [O-][N+](=O)Cc1ccccc1Br Amb23589328 [1,1,0,0,0,0|1,0,1]=4 3726 B11R1.86 [O-][N+](=O)Cc1ccccc1Cl Amb23589312 [1,1,0,0,0,0|1,0,1]=4 3727 B11R1.86 [O-][N+](=O)Cc1ccccc1F Amb23589317 [1,1,0,0,0,0|1,0,1]=4 3728 B11R1.86 [O-][N+](=O)Cc1ccccc1O Amb24617748 [1,1,0,0,0,0|1,0,1]=4 3729 B11R1.86 [O-][n+]1ccccc1CC(O)=O Amb25073338 [1,1,0,0,0,0|1,0,0]=3 3730 B11R1.157 C=C(Br)Cc1cccc(O)c1 Amb25149190 [1,1,0,0,0,0|1,0,1]=4 3731 B11R1.157 CC(=C)Cc1cccc(O)c1 Amb24388029 [1,1,0,0,0,0|1,0,0]=3 3732 B11R1.157 CC(=N)Nc1cccc(Br)c1 Amb24533201 [1,1,0,0,0,0|2,0,0]=4 3733 B11R1.157 CC(=N)Nc1cccc(Cl)c1 Amb19884067 [1,1,0,0,0,0|2,0,0]=4 3734 B11R1.157 CC(=N)Nc1cccc(I)c1 Amb24373036 [1,1,0,0,0,0|2,0,0]=4 3735 B11R1.157 CC(=N)Nc1cccc(N)c1 Amb24072123 [1,1,0,0,0,0|2,0,0]=4 3736 B11R1.157 CC(=O)C[n+]1cccc(c1)Br Amb2522946 [1,1,0,0,0,0|1,0,0]=3 3737 B11R1.157 CC(=O)C[n+]1cccc(c1)C Amb1102045 [1,1,0,0,0,0|1,0,0]=3 3738 B11R1.157 CC(=O)Cc1c[n]cc(Br)c1 Amb24080127 [1,1,0,0,0,0|1,0,0]=3 3739 B11R1.157 CC(=O)Cc1c[n]cc(Cl)[n]1 Amb24519040 [1,1,0,0,0,0|2,0,0]=4 3740 B11R1.157 CC(=O)Cc1c[n]cc(N)c1 Amb24509274 [1,1,0,0,0,0|1,0,0]=3 3741 B11R1.157 CC(=O)Cc1cc(Cl)cc[n]1 Amb25808767 [1,1,0,0,0,0|1,0,0]=3 3742 B11R1.157 CC(=O)Cc1cc(O)[n]c[n]1 Amb25301633 [1,1,0,0,0,0|2,0,0]=4 3743 B11R1.157 CC(=O)Cc1cc[n]c(Cl)c1 Amb25301796 [1,1,0,0,0,0|1,0,0]=3 3744 B11R1.157 CC(=O)Cc1cc[n]c(N)c1 Amb25145695 [1,1,0,0,0,0|1,0,0]=3 3745 B11R1.157 CC(=O)Cc1cccc(Cl)[n]1 Amb25074053 [1,1,0,0,0,0|1,0,0]=3 3746 B11R1.157 CC(=O)Cc1cccc(c1)N Amb17477728 [1,1,0,0,0,0|0,0,0]=2 3747 B11R1.157 CC(=O)Cc1cccc(c1)O Amb16192704 [1,1,0,0,0,0|0,0,0]=2 3748 B11R1.157 CC(=O)Cc1cccc(n1)C Amb1995166 [1,1,0,0,0,0|1,0,0]=3 3749 B11R1.157 CC(=O)Cc1nccc(c1)C Amb1995157 [1,1,0,0,0,0|1,0,0]=3 3750 B11R1.157 CC(=O)NC1=CC(=O)NC=C1 Amb22752689 [1,1,0,0,0,0|2,0,0]=4 3751 B11R1.157 CC(=O)Nc1c[n]cc(Br)c1 Amb20242024 [1,1,0,0,0,0|2,0,0]=4 3752 B11R1.157 CC(=O)Nc1c[n]cc(F)c1 Amb25337418 [1,1,0,0,0,0|2,0,0]=4 3753 B11R1.157 CC(=O)Nc1c[n]cc(I)c1 Amb24574957 [1,1,0,0,0,0|2,0,0]=4 3754 B11R1.157 CC(=O)Nc1c[n]cc(N)c1 Amb25130782 [1,1,0,0,0,0|2,0,0]=4 3755 B11R1.157 CC(=O)Nc1c[n]cc(O)c1 Amb18125366 [1,1,0,0,0,0|2,0,0]=4 3756 B11R1.157 CC(=O)Nc1cc(Br)cc[n]1 Amb21857697 [1,1,0,0,0,0|2,0,0]=4 3757 B11R1.157 CC(=O)Nc1cc(Cl)ccn1 Amb15690612 [1,1,0,0,0,0|2,0,0]=4 3758 B11R1.157 CC(=O)Nc1cc(F)cc[n]1 Amb23400397 [1,1,0,0,0,0|2,0,0]=4 3759 B11R1.157 CC(=O)Nc1cc(I)cc[n]1 Amb21857698 [1,1,0,0,0,0|2,0,0]=4 3760 B11R1.157 CC(=O)Nc1cc(N)cc[n]1 Amb18644458 [1,1,0,0,0,0|2,0,0]=4 3761 B11R1.157 CC(=O)Nc1cc[n]c(N)c1 Amb20670782 [1,1,0,0,0,0|2,0,0]=4 3762 B11R1.157 CC(=O)Nc1ccc[n+](c1)C Amb2237835 [1,1,0,0,0,0|2,0,0]=4 3763 B11R1.157 CC(=O)Nc1ccc[n+](c1)[O-] Amb10576560 [1,1,0,0,0,0|2,0,0]=4 3764 B11R1.157 CC(=O)Nc1cccc(Cl)[n]1 Amb22736785 [1,1,0,0,0,0|2,0,0]=4 3765 B11R1.157 CC(=O)Nc1cccc(F)[n]1 Amb23401855 [1,1,0,0,0,0|2,0,0]=4 3766 B11R1.157 CC(=O)Nc1cccc(c1)Br Amb1019639 [1,1,0,0,0,0|1,0,0]=3 3767 B11R1.157 CC(=O)Nc1cccc(c1)C Amb1934773 [1,1,0,0,0,0|1,0,0]=3 3768 B11R1.157 CC(=O)Nc1cccc(c1)O Amb1208498 [1,1,0,0,0,0|1,0,0]=3 3769 B11R1.157 CC(=O)Nc1cccc(n1)C Amb1244208 [1,1,0,0,0,0|2,0,0]=4 3770 B11R1.157 CC(=O)Nc1cccn(=O)c1 Amb17749043 [1,1,0,0,0,0|2,0,0]=4 3771 B11R1.157 CC(=O)Nc1ccnc(c1)Cl Amb1257630 [1,1,0,0,0,0|2,0,0]=4 3772 B11R1.157 CC(=O)OC1=CC(=O)NC=C1 Amb25063093 [1,1,0,0,0,0|2,0,0]=4 3773 B11R1.157 CC(=O)Oc1c[n+](C)ccc1 Amb24728144 [1,1,0,0,0,0|2,0,0]=4 3774 B11R1.157 CC(=O)Oc1c[n]cc(Br)c1 Amb25847420 [1,1,0,0,0,0|2,0,0]=4 3775 B11R1.157 CC(=O)Oc1c[n]cc(Cl)c1 Amb25306173 [1,1,0,0,0,0|2,0,0]=4 3776 B11R1.157 CC(=O)Oc1cc[n]c(Br)c1 Amb20617577 [1,1,0,0,0,0|2,0,0]=4 3777 B11R1.157 CC(=O)Oc1cccc(Br)[n]1 Amb20617565 [1,1,0,0,0,0|2,0,0]=4 3778 B11R1.157 CC(=O)Oc1cccc(Br)c1 Amb21858014 [1,1,0,0,0,0|1,0,0]=3 3779 B11R1.157 CC(=O)Sc1cccc(F)c1 Amb24407201 [1,1,0,0,0,0|1,0,0]=3 3780 B11R1.157 CC(=S)Cc1cccc(Br)c1 Amb24701960 [1,1,0,0,0,0|0,1,0]=3 3781 B11R1.157 CC(=S)Cc1cccc(Cl)c1 Amb25088890 [1,1,0,0,0,0|0,1,0]=3 3782 B11R1.157 CC(=S)Nc1cccc(F)c1 Amb25352399 [1,1,0,0,0,0|1,1,0]=4 3783 B11R1.157 CC(Br)Cc1cc(Br)ccc1 Amb18548909 [1,1,0,0,0,0|1,0,1]=4 3784 B11R1.157 CC(C)=Cc1cccc(O)c1 Amb24334807 [1,1,0,0,0,0|1,0,1]=4 3785 B11R1.157 CC(C)=Nc1cccc(O)c1 Amb25087201 [1,1,0,0,0,0|2,0,0]=4 3786 B11R1.157 CC(C)Cc1cccc(Br)c1 Amb22750461 [1,1,0,0,0,0|1,0,1]=4 3787 B11R1.157 CC(C)Cc1cccc(F)c1 Amb25056766 [1,1,0,0,0,0|1,0,1]=4 3788 B11R1.157 CC(C)Cc1cccc(I)c1 Amb24487074 [1,1,0,0,0,0|1,0,1]=4 3789 B11R1.157 CC(C)Cc1cccc(O)c1 Amb18644438 [1,1,0,0,0,0|1,0,1]=4 3790 B11R1.157 CC(Cc1cccc(c1)Br)Cl Amb17477732 [1,1,0,0,0,0|1,0,1]=4 3791 B11R1.157 CC(Cc1cccc(c1)Br)N Amb10610450 [1,1,0,0,0,0|1,0,1]=4 3792 B11R1.157 CC(Cc1cccc(c1)Br)O Amb17477717 [1,1,0,0,0,0|0,0,2]=4 3793 B11R1.157 CC(Cc1cccc(c1)C)Cl Amb17477589 [1,1,0,0,0,0|1,0,1]=4 3794 B11R1.157 CC(Cc1cccc(c1)C)O Amb17138430 [1,1,0,0,0,0|0,0,2]=4 3795 B11R1.157 CC(Cc1cccc(c1)Cl)Cl Amb17477737 [1,1,0,0,0,0|1,0,1]=4 3796 B11R1.157 CC(Cc1cccc(c1)Cl)N Amb10205336 [1,1,0,0,0,0|1,0,1]=4 3797 B11R1.157 CC(Cc1cccc(c1)Cl)O Amb17138669 [1,1,0,0,0,0|0,0,2]=4 3798 B11R1.157 CC(Cc1cccc(c1)F)O Amb17138451 [1,1,0,0,0,0|0,0,2]=4 3799 B11R1.157 CC(Cc1cccc(c1)N)C Amb17138425 [1,1,0,0,0,0|1,0,1]=4 3800 B11R1.157 CC(Cl)Cc1cccc(F)c1 Amb18178038 [1,1,0,0,0,0|1,0,1]=4 3801 B11R1.157 CC(F)Cc1cccc(N)c1 Amb25377517 [1,1,0,0,0,0|1,0,1]=4 3802 B11R1.157 CC(F)Cc1cccc(O)c1 Amb25312419 [1,1,0,0,0,0|1,0,1]=4 3803 B11R1.157 CC(N)Cc1cccc(F)c1 Amb19515438 [1,1,0,0,0,0|1,0,1]=4 3804 B11R1.157 CC(N)Cc1cccc(O)c1 Amb22055403 [1,1,0,0,0,0|1,0,1]=4 3805 B11R1.157 CC(O)Cc1cccc(N)c1 Amb24666879 [1,1,0,0,0,0|0,0,2]=4 3806 B11R1.157 CN(C)Cc1cccc(C)c1 Amb17663821 [1,1,0,0,0,0|2,0,0]=4 3807 B11R1.157 CN(C)Cc1cccc(Cl)c1 Amb17663825 [1,1,0,0,0,0|2,0,0]=4 3808 B11R1.157 CN(C)Cc1cccc(F)c1 Amb17663829 [1,1,0,0,0,0|2,0,0]=4 3809 B11R1.157 CN(C)Cc1cccc(O)c1 Amb18125286 [1,1,0,0,0,0|2,0,0]=4 3810 B11R1.157 CN(C)Cc1cccc(O)c1 Amb22034547 [1,1,0,0,0,0|2,0,0]=4 3811 B11R1.157 CN(C)Cc1cccc(S)c1 Amb21959944 [1,1,0,0,0,0|2,0,0]=4 3812 B11R1.157 CN(Cc1cccc(c1)Br)C Amb2447333 [1,1,0,0,0,0|2,0,0]=4 3813 B11R1.157 CN(Cc1cccc(c1)I)C Amb10070276 [1,1,0,0,0,0|2,0,0]=4 3814 B11R1.157 CN(Cc1cccc(c1)S)C Amb16187185 [1,1,0,0,0,0|2,0,0]=4 3815 B11R1.157 CN(N)Cc1cccc(Br)c1 Amb18066854 [1,1,0,0,0,0|2,0,0]=4 3816 B11R1.157 CN(N)Cc1cccc(Cl)c1 Amb18563955 [1,1,0,0,0,0|2,0,0]=4 3817 B11R1.157 CS(=O)Cc1c[n]cc(Br)c1 Amb24696976 [1,1,0,0,0,0|2,0,0]=4 3818 B11R1.157 CS(=O)Cc1cc[n]c(N)c1 Amb25290938 [1,1,0,0,0,0|2,0,0]=4 3819 B11R1.157 CS(=O)Cc1cccc(Cl)c1 Amb25807309 [1,1,0,0,0,0|1,0,0]=3 3820 B11R1.157 CS(=O)Cc1cccc(N)c1 Amb18954301 [1,1,0,0,0,0|1,0,0]=3 3821 B11R1.157 CS(=O)Nc1cccc(Br)c1 Amb25177195 [1,1,0,0,0,0|2,0,0]=4 3822 B11R1.157 CS(=O)Nc1cccc(N)c1 Amb24565164 [1,1,0,0,0,0|2,0,0]=4 3823 B11R1.157 C[C@@H](N)Cc1cc(N)ccc1 Amb24485922 [1,1,0,0,0,0|1,0,1]=4 3824 B11R1.157 C[C@@H](N)Cc1cccc(Br)c1 Amb24670162 [1,1,0,0,0,0|1,0,1]=4 3825 B11R1.157 C[C@@H](O)Cc1cc(O)ccc1 Amb22896912 [1,1,0,0,0,0|0,0,2]=4 3826 B11R1.157 C[C@@H](O)Cc1cccc(Br)c1 Amb22896914 [1,1,0,0,0,0|0,0,2]=4 3827 B11R1.157 C[C@@H](O)Cc1cccc(F)c1 Amb25823607 [1,1,0,0,0,0|0,0,2]=4 3828 B11R1.157 C[C@H](N)Cc1cc(N)ccc1 Amb24378558 [1,1,0,0,0,0|1,0,1]=4 3829 B11R1.157 C[C@H](N)Cc1cccc(Br)c1 Amb25785909 [1,1,0,0,0,0|1,0,1]=4 3830 B11R1.157 C[C@H](N)Cc1cccc(Cl)c1 Amb24538303 [1,1,0,0,0,0|1,0,1]=4 3831 B11R1.157 C[C@H](N)Cc1cccc(F)c1 Amb25277304 [1,1,0,0,0,0|1,0,1]=4 3832 B11R1.157 C[C@H](N)Cc1cccc(S)c1 Amb24746814 [1,1,0,0,0,0|1,0,1]=4 3833 B11R1.157 C[C@H](O)Cc1cc(O)ccc1 Amb24486863 [1,1,0,0,0,0|0,0,2]=4 3834 B11R1.157 C[C@H](O)Cc1cccc(Br)c1 Amb25797570 [1,1,0,0,0,0|0,0,2]=4 3835 B11R1.157 C[n+]1cc(CC(O)=O)ccc1 Amb24443152 [1,1,0,0,0,0|1,0,0]=3 3836 B11R1.157 Cc1[n]c(CC(O)=O)cc[n]1 Amb18201470 [1,1,0,0,0,0|2,0,0]=4 3837 B11R1.157 Cc1c[n+](CC(N)=O)ccc1 Amb25274967 [1,1,0,0,0,0|2,0,0]=4 3838 B11R1.157 Cc1c[n+](CC(O)=O)ccc1 Amb25363198 [1,1,0,0,0,0|1,0,0]=3 3839 B11R1.157 Cc1cc(CC(N)=O)[n]cc1 Amb25360857 [1,1,0,0,0,0|2,0,0]=4 3840 B11R1.157 Cc1cc(CC(N)=O)c[n]c1 Amb25099355 [1,1,0,0,0,0|2,0,0]=4 3841 B11R1.157 Cc1cc(CC(O)=O)[n]c[n]1 Amb18862487 [1,1,0,0,0,0|2,0,0]=4 3842 B11R1.157 Cc1cc(CC(O)=O)[n]cc1 Amb18201755 [1,1,0,0,0,0|1,0,0]=3 3843 B11R1.157 Cc1cc(CC(O)=O)[n]cc1 Amb22587582 [1,1,0,0,0,0|1,0,0]=3 3844 B11R1.157 Cc1cc(CC(O)=O)c[n]c1 Amb18201711 [1,1,0,0,0,0|1,0,0]=3 3845 B11R1.157 Cc1cc(CC(O)=O)cc[n]1 Amb18831266 [1,1,0,0,0,0|1,0,0]=3 3846 B11R1.157 Cc1cc(CC([O-])=O)[n]cc1 Amb23440537 [1,1,0,0,0,0|1,0,1]=4 3847 B11R1.157 Cc1cc(CS([O-])=O)ccc1 Amb25039109 [1,1,0,0,0,0|1,0,1]=4 3848 B11R1.157 Cc1cc(C[N+]([O-])=O)ccc1 Amb25777011 [1,1,0,0,0,0|1,0,1]=4 3849 B11R1.157 Cc1cc(cc[n]1)NC(C)=O Amb20248228 [1,1,0,0,0,0|2,0,0]=4 3850 B11R1.157 Cc1cc(cc[n]1)OC(C)=O Amb25053397 [1,1,0,0,0,0|2,0,0]=4 3851 B11R1.157 Cc1cc(ccc1)OC(=O)Cl Amb22229382 [1,1,0,0,0,0|2,0,0]=4 3852 B11R1.157 Cc1cc(ccc1)SC(N)=O Amb25335340 [1,1,0,0,0,0|2,0,0]=4 3853 B11R1.157 Cc1cc[n]c(CC(O)=O)[n]1 Amb18224300 [1,1,0,0,0,0|2,0,0]=4 3854 B11R1.157 Cc1cccc(CC(C)C)c1 Amb24585328 [1,1,0,0,0,0|1,0,1]=4 3855 B11R1.157 Cc1cccc(CC(N)=O)[n]1 Amb22494002 [1,1,0,0,0,0|2,0,0]=4 3856 B11R1.157 Cc1cccc(CC([O-])=O)[n]1 Amb20076035 [1,1,0,0,0,0|1,0,1]=4 3857 B11R1.157 Cc1cccc(CN(C)N)c1 Amb18065019 [1,1,0,0,0,0|2,0,0]=4 3858 B11R1.157 Cc1cccc(C[C@H](C)N)c1 Amb24677552 [1,1,0,0,0,0|1,0,1]=4 3859 B11R1.157 Cc1cccc([n]1)OC(C)=O Amb24085033 [1,1,0,0,0,0|2,0,0]=4 3860 B11R1.157 Cc1cccc(n1)CC(=O)O Amb17617788 [1,1,0,0,0,0|1,0,0]=3 3861 B11R1.157 NC(=N)Cc1cccc(Br)c1 Amb24271148 [1,1,0,0,0,0|2,0,0]=4 3862 B11R1.157 NC(=N)Cc1cccc(O)c1 Amb25133500 [1,1,0,0,0,0|2,0,0]=4 3863 B11R1.157 NC(=N)Cc1cccc(c1)Cl Amb2183303 [1,1,0,0,0,0|2,0,0]=4 3864 B11R1.157 NC(=O)CC1=CC=CC(=O)N1 Amb25174273 [1,1,0,0,0,0|2,0,0]=4 3865 B11R1.157 NC(=O)Cc1c[n]cc(F)c1 Amb24707829 [1,1,0,0,0,0|2,0,0]=4 3866 B11R1.157 NC(=O)Cc1cccc(I)c1 Amb25750996 [1,1,0,0,0,0|1,0,0]=3 3867 B11R1.157 NC(=O)Cc1cccc(c1)Br Amb2447571 [1,1,0,0,0,0|1,0,0]=3 3868 B11R1.157 NC(=O)Cc1cccc(c1)C Amb2107850 [1,1,0,0,0,0|1,0,0]=3 3869 B11R1.157 NC(=O)Cc1cccc(c1)Cl Amb17400312 [1,1,0,0,0,0|1,0,0]=3 3870 B11R1.157 NC(=O)Nc1cccc(c1)Br Amb1130078 [1,1,0,0,0,0|2,0,0]=4 3871 B11R1.157 NC(=O)Nc1cccc(c1)C Amb1139814 [1,1,0,0,0,0|2,0,0]=4 3872 B11R1.157 NC(=O)Nc1cccc(c1)Cl Amb1132008 [1,1,0,0,0,0|2,0,0]=4 3873 B11R1.157 NC(=O)Nc1cccc(c1)F Amb1133367 [1,1,0,0,0,0|2,0,0]=4 3874 B11R1.157 NC(=O)Nc1cccc(c1)N Amb1116839 [1,1,0,0,0,0|2,0,0]=4 3875 B11R1.157 NC(=O)Oc1cccc(c1)Cl Amb10575592 [1,1,0,0,0,0|2,0,0]=4 3876 B11R1.157 NC(=O)Sc1cccc(Cl)c1 Amb25257996 [1,1,0,0,0,0|2,0,0]=4 3877 B11R1.157 NC(=S)Cc1cccc(O)c1 Amb25251673 [1,1,0,0,0,0|1,1,0]=4 3878 B11R1.157 NC(O)Cc1cc(O)ccc1 Amb25855628 [1,1,0,0,0,0|1,0,1]=4 3879 B11R1.157 Nc1cc(CC(O)=O)ccc1 Amb19373490 [1,1,0,0,0,0|0,0,0]=2 3880 B11R1.157 Nc1cc(CS([O-])=O)ccc1 Amb24468713 [1,1,0,0,0,0|1,0,1]=4 3881 B11R1.157 Nc1cc(ccc1)OC(=O)F Amb24417695 [1,1,0,0,0,0|2,0,0]=4 3882 B11R1.157 Nc1cc(ccc1)SC(=O)F Amb25169491 [1,1,0,0,0,0|2,0,0]=4 3883 B11R1.157 Nc1cc[n]c(CC(O)=O)[n]1 Amb18201162 [1,1,0,0,0,0|2,0,0]=4 3884 B11R1.157 Nc1cccc(CC(N)=O)[n]1 Amb25856998 [1,1,0,0,0,0|2,0,0]=4 3885 B11R1.157 Nc1cccc(CC(O)=O)[n]1 Amb22011865 [1,1,0,0,0,0|1,0,0]=3 3886 B11R1.157 Nc1cccc(c1)NC(N)=O Amb22732415 [1,1,0,0,0,0|2,0,0]=4 3887 B11R1.157 Nc1cccc(c1)OC(N)=O Amb24369239 [1,1,0,0,0,0|2,0,0]=4 3888 B11R1.157 O=C(Br)Cc1cc(Br)ccc1 Amb20620591 [1,1,0,0,0,0|1,0,0]=3 3889 B11R1.157 O=C(Cl)Cc1cc(Cl)ccc1 Amb18286412 [1,1,0,0,0,0|1,0,0]=3 3890 B11R1.157 O=C(Cl)Cc1cccc(Br)c1 Amb18284226 [1,1,0,0,0,0|1,0,0]=3 3891 B11R1.157 O=C(Cl)Cc1cccc(I)c1 Amb25322405 [1,1,0,0,0,0|1,0,0]=3 3892 B11R1.157 O=C(Cl)Nc1cc(Cl)ccc1 Amb24093909 [1,1,0,0,0,0|2,0,0]=4 3893 B11R1.157 O=C(Cl)Oc1cc(Cl)ccc1 Amb24455216 [1,1,0,0,0,0|2,0,0]=4 3894 B11R1.157 O=C(Cl)Oc1cccc(F)c1 Amb25049826 [1,1,0,0,0,0|2,0,0]=4 3895 B11R1.157 O=S(=O)Cc1cccc(Br)c1 Amb25278522 [1,1,0,0,0,0|1,0,1]=4 3896 B11R1.157 OB(O)Cc1cccc(F)c1 Amb22059300 [1,1,0,0,0,0|1,0,1]=4 3897 B11R1.157 OC(=O)CC1=CC(=O)NC=N1 Amb22009632 [1,1,0,0,0,0|2,0,0]=4 3898 B11R1.157 OC(=O)CC1=CC(=O)NN=C1 Amb25825208 [1,1,0,0,0,0|2,0,0]=4 3899 B11R1.157 OC(=O)CC1=CN=CC(=O)N1 Amb18200849 [1,1,0,0,0,0|2,0,0]=4 3900 B11R1.157 OC(=O)C[n+]1cc(Cl)ccc1 Amb25159250 [1,1,0,0,0,0|1,0,0]=3 3901 B11R1.157 OC(=O)C[n+]1cccc(c1)Cl Amb10573207 [1,1,0,0,0,0|1,0,0]=3 3902 B11R1.157 OC(=O)Cc1[n]c(Br)cc[n]1 Amb22751893 [1,1,0,0,0,0|2,0,0]=4 3903 B11R1.157 OC(=O)Cc1[n]c(Cl)cc[n]1 Amb24509273 [1,1,0,0,0,0|2,0,0]=4 3904 B11R1.157 OC(=O)Cc1[n]c(F)cc[n]1 Amb24509123 [1,1,0,0,0,0|2,0,0]=4 3905 B11R1.157 OC(=O)Cc1c[n]cc(F)c1 Amb18285911 [1,1,0,0,0,0|1,0,0]=3 3906 B11R1.157 OC(=O)Cc1cc(Br)[n]c[n]1 Amb24527832 [1,1,0,0,0,0|2,0,0]=4 3907 B11R1.157 OC(=O)Cc1cc(Cl)[n]c[n]1 Amb25152705 [1,1,0,0,0,0|2,0,0]=4 3908 B11R1.157 OC(=O)Cc1cc(Cl)cc[n]1 Amb20247876 [1,1,0,0,0,0|1,0,0]=3 3909 B11R1.157 OC(=O)Cc1cc(Cl)cc[n]1 Amb22899499 [1,1,0,0,0,0|1,0,0]=3 3910 B11R1.157 OC(=O)Cc1cc(F)[n]c[n]1 Amb25377314 [1,1,0,0,0,0|2,0,0]=4 3911 B11R1.157 OC(=O)Cc1cc(F)cc[n]1 Amb20247872 [1,1,0,0,0,0|1,0,0]=3 3912 B11R1.157 OC(=O)Cc1cc[n]c(Cl)[n]1 Amb24509076 [1,1,0,0,0,0|2,0,0]=4 3913 B11R1.157 OC(=O)Cc1cc[n]c(S)[n]1 Amb18198915 [1,1,0,0,0,0|2,0,0]=4 3914 B11R1.157 OC(=O)Cc1cccc(Br)[n]1 Amb22494936 [1,1,0,0,0,0|1,0,0]=3 3915 B11R1.157 OC(=O)Cc1cccc(F)[n]1 Amb20247874 [1,1,0,0,0,0|1,0,0]=3 3916 B11R1.157 OC(=O)Cc1cccc(c1)Br Amb1134647 [1,1,0,0,0,0|0,0,0]=2 3917 B11R1.157 OC(=O)Cc1cccc(n1)Br Amb13883482 [1,1,0,0,0,0|1,0,0]=3 3918 B11R1.157 OC(=O)Cc1cccc(n1)Cl Amb10976127 [1,1,0,0,0,0|1,0,0]=3 3919 B11R1.157 OC(=O)Cc1cncc(n1)Cl Amb10603186 [1,1,0,0,0,0|2,0,0]=4 3920 B11R1.157 OC(=O)Nc1cc(Br)cc[n]1 Amb23554914 [1,1,0,0,0,0|2,0,0]=4 3921 B11R1.157 OC(=S)Cc1cccc(Br)c1 Amb24099892 [1,1,0,0,0,0|0,1,0]=3 3922 B11R1.157 OC(=S)Cc1cccc(F)c1 Amb24094124 [1,1,0,0,0,0|0,1,0]=3 3923 B11R1.157 Oc1[n]c(CC(O)=O)cc[n]1 Amb18200881 [1,1,0,0,0,0|2,0,0]=4 3924 B11R1.157 Oc1cc(CC(=O)Cl)ccc1 Amb18177959 [1,1,0,0,0,0|1,0,0]=3 3925 B11R1.157 Oc1cc[n]c(CC(O)=O)[n]1 Amb18862504 [1,1,0,0,0,0|2,0,0]=4 3926 B11R1.157 Oc1cc[n]c(CC(O)=O)c1 Amb25320721 [1,1,0,0,0,0|1,0,0]=3 3927 B11R1.157 Oc1cccc(CC(O)=O)[n]1 Amb20247884 [1,1,0,0,0,0|1,0,0]=3 3928 B11R1.157 [O-]C(=O)Cc1cccc(Cl)[n]1 Amb22757538 [1,1,0,0,0,0|1,0,1]=4 3929 B11R1.157 [O-][N+](=O)Cc1cccc(Br)c1 Amb23589329 [1,1,0,0,0,0|1,0,1]=4 3930 B11R1.157 [O-][N+](=O)Cc1cccc(Cl)c1 Amb23589314 [1,1,0,0,0,0|1,0,1]=4 3931 B11R1.157 [O-][N+](=O)Cc1cccc(F)c1 Amb23589318 [1,1,0,0,0,0|1,0,1]=4 3932 B11R1.157 [O-][n+]1cc(CC(O)=O)ccc1 Amb24518678 [1,1,0,0,0,0|1,0,0]=3 3933 B11R1.509 CC(C)(Br)Cc1ccccc1 Amb18049599 [1,1,0,0,0,0|1,0,1]=4 3934 B11R1.509 CC(C)(N)Cc1ccccc1 Amb18524601 [1,1,0,0,0,0|1,0,1]=4 3935 B11R1.509 CC(Cc1ccccc1)(Cl)C Amb17102035 [1,1,0,0,0,0|1,0,1]=4 3936 B11R1.509 CS(=O)(=O)Oc1ccccc1 Amb2227587 [1,1,0,0,0,0|2,0,0]=4 3937 B11R1.509 CS(=O)(=O)Sc1ccccc1 Amb17619349 [1,1,0,0,0,0|2,0,0]=4 3938 B11R1.509 C[C@@](N)(O)Cc1ccccc1 Amb25716775 [1,1,0,0,0,0|0,0,2]=4 3939 B11R1.509 C[C@](N)(O)Cc1ccccc1 Amb24445153 [1,1,0,0,0,0|0,0,2]=4 3940 B11R1.509 C[N+](C)(C)Cc1ccccc1 Amb17739711 [1,1,0,0,0,0|2,0,0]=4 3941 B11R1.509 C[N+](C)(C)Cc1ccccc1 Amb19930163 [1,1,0,0,0,0|2,0,0]=4 3942 B11R1.509 C[N+](C)(C)Cc1ccccc1 Amb22002664 [1,1,0,0,0,0|2,0,0]=4 3943 B11R1.509 C[N+](C)(C)Cc1ccccc1 Amb22052447 [1,1,0,0,0,0|2,0,0]=4 3944 B11R1.509 C[N+](C)(C)Cc1ccccc1 Amb22054449 [1,1,0,0,0,0|2,0,0]=4 3945 B11R1.509 C[N+](C)(C)Cc1ccccc1 Amb22336519 [1,1,0,0,0,0|2,0,0]=4 3946 B11R1.509 C[N+](C)(C)Cc1ccccc1 Amb22351768 [1,1,0,0,0,0|2,0,0]=4 3947 B11R1.509 C[N+](C)(C)Cc1ccccc1 Amb22366021 [1,1,0,0,0,0|2,0,0]=4 3948 B11R1.509 C[N+](C)([O-])Cc1ccccc1 Amb24103349 [1,1,0,0,0,0|1,0,1]=4 3949 B11R1.509 C[N+](Cc1ccccc1)(C)C Amb10603979 [1,1,0,0,0,0|2,0,0]=4 3950 B11R1.509 C[N+](Cc1ccccc1)(C)C Amb1153962 [1,1,0,0,0,0|2,0,0]=4 3951 B11R1.509 C[N+](Cc1ccccc1)(N)C Amb1085967 [1,1,0,0,0,0|2,0,0]=4 3952 B11R1.509 C[Si](C)(C)Cc1ccccc1 Amb19893559 [1,1,0,0,0,0|1,1,0]=4 3953 B11R1.509 C[Si](C)(Cl)Cc1ccccc1 Amb19893553 [1,1,0,0,0,0|1,1,0]=4 3954 B11R1.509 C[Si](C)(F)Cc1ccccc1 Amb25293989 [1,1,0,0,0,0|1,1,0]=4 3955 B11R1.509 C[Si](Cl)(Cl)Cc1ccccc1 Amb19893557 [1,1,0,0,0,0|1,1,0]=4 3956 B11R1.509 FS(=O)(=O)Cc1ccccc1 Amb1157545 [1,1,0,0,0,0|1,0,1]=4 3957 B11R1.509 NP(O)(=O)Oc1ccccc1 Amb25200138 [1,1,0,0,0,0|2,0,0]=4 3958 B11R1.509 NS(=O)(=O)Cc1ccccc1 Amb1127409 [1,1,0,0,0,0|1,0,1]=4 3959 B11R1.509 O=P(Cl)(Cl)Cc1ccccc1 Amb25194718 [1,1,0,0,0,0|2,0,0]=4 3960 B11R1.509 OP(=O)(Oc1ccccc1)O Amb1148179 [1,1,0,0,0,0|2,0,0]=4 3961 B11R1.509 OP(O)(=O)Cc1c[n]ccc1 Amb22388736 [1,1,0,0,0,0|2,0,0]=4 3962 B11R1.509 OP(O)(=O)Cc1cc[n]cc1 Amb22388741 [1,1,0,0,0,0|2,0,0]=4 3963 B11R1.509 OP(O)(=O)Cc1cccc[n]1 Amb22388742 [1,1,0,0,0,0|2,0,0]=4 3964 B11R1.509 OP(O)(=S)Cc1ccccc1 Amb25174255 [1,1,0,0,0,0|1,0,1]=4 3965 B11R1.509 OS(=O)(=O)Cc1c[n]ccc1 Amb22298331 [1,1,0,0,0,0|2,0,0]=4 3966 B11R1.509 OS(=O)(=O)Cc1cc[n]cc1 Amb22298426 [1,1,0,0,0,0|2,0,0]=4 3967 B11R1.509 OS(=O)(=O)Nc1ccccc1 Amb22490957 [1,1,0,0,0,0|2,0,0]=4 3968 B11R1.509 [O-]S(=O)(=O)Cc1ccccc1 Amb22490986 [1,1,0,0,0,0|1,0,1]=4 3969 B11R1.928 C[C@]1(CC=CC=C1)CC(O)=O Amb24726333 [1,1,0,0,0,0|0,0,2]=4 3970 B11R1.7 CN=[S@@](C)(=O)c1ccccc1 Amb22800519 [0,1,0,0,1,0|2,0,0]=4 3971 B11R1.7 CNS(=O)(=O)c1ccccc1 Amb1152097 [0,1,0,0,1,0|2,0,0]=4 3972 B11R1.7 CNS(C)(=O)c1ccccc1 Amb17836794 [0,1,0,0,1,0|2,0,0]=4 3973 B11R1.7 COC(O)(O)c1ccccc1 Amb22749915 [0,1,0,0,1,0|0,0,2]=4 3974 B11R1.7 COS(=O)(=O)c1c[n]ccc1 Amb24466050 [0,1,0,0,1,0|2,0,0]=4 3975 B11R1.7 CO[Si](C)(C)c1ccccc1 Amb22047319 [0,1,0,0,1,0|1,1,0]=4 3976 B11R1.7 O=S(=S)(O[Na])c1ccccc1 Amb22338687 [0,1,0,0,1,0|2,0,0]=4 3977 B11R1.7 [2H]C(C)(OC)c1ccccc1 Amb22365991 [0,1,0,0,1,0|1,0,1]=4 3978 B11R1.12 CCC(c1ccccc1)C=O Amb17138422 [0,1,0,0,1,0|1,0,1]=4 3979 B11R1.12 CCN(C=O)c1ccccc1 Amb17672982 [0,1,0,0,1,0|2,0,0]=4 3980 B11R1.12 CCN(c1ccccc1)N=O Amb17618581 [0,1,0,0,1,0|2,0,0]=4 3981 B11R1.12 CC[C@H](C=O)c1ccccc1 Amb25731916 [0,1,0,0,1,0|1,0,1]=4 3982 B11R1.12 CC\C(=C/Cl)\c1ccccc1 Amb24373905 [0,1,0,0,1,0|2,0,0]=4 3983 B11R1.12 CC\C(=C\Cl)\c1ccccc1 Amb25227191 [0,1,0,0,1,0|2,0,0]=4 3984 B11R1.12 CC\C(=N\N)\c1ccccc1 Amb24396664 [0,1,0,0,1,0|2,0,0]=4 3985 B11R1.12 CN=C(NN)c1ccccc1 Amb22447540 [0,1,0,0,1,0|2,0,0]=4 3986 B11R1.12 CN\C(=N\O)\c1ccccc1 Amb25293329 [0,1,0,0,1,0|1,0,1]=4 3987 B11R1.12 COB(OC)c1ccccc1 Amb24103414 [0,1,0,0,1,0|1,0,1]=4 3988 B11R1.12 COC(=C=O)c1c[n]ccc1 Amb24084533 [0,1,0,0,1,0|1,0,0]=3 3989 B11R1.12 COC(=C=O)c1cccc[n]1 Amb24084532 [0,1,0,0,1,0|1,0,0]=3 3990 B11R1.12 COC(C#C)c1ccccc1 Amb25242698 [0,1,0,0,1,0|1,0,1]=4 3991 B11R1.12 COC(C=C)c1ccccc1 Amb22002227 [0,1,0,0,1,0|1,0,1]=4 3992 B11R1.12 COC(C=O)c1cccc[n]1 Amb25364326 [0,1,0,0,1,0|1,0,1]=4 3993 B11R1.12 COC(C=O)c1ccccc1 Amb18125121 [0,1,0,0,1,0|0,0,1]=3 3994 B11R1.12 COC(CBr)c1ccccc1 Amb24079930 [0,1,0,0,1,0|1,0,1]=4 3995 B11R1.12 COC(CCl)c1ccccc1 Amb17674030 [0,1,0,0,1,0|1,0,1]=4 3996 B11R1.12 CO[C+](OC)c1ccccc1 Amb25369960 [0,1,0,0,1,0|0,0,2]=4 3997 B11R1.12 CO[C@@H](C=O)c1ccccc1 Amb25252891 [0,1,0,0,1,0|0,0,1]=3 3998 B11R1.12 CO[C@@H](CO)c1ccccc1 Amb21617903 [0,1,0,0,1,0|0,0,2]=4 3999 B11R1.12 CO[C@H](CBr)c1ccccc1 Amb24760200 [0,1,0,0,1,0|1,0,1]=4 4000 B11R1.12 CO\C(=C\Cl)\c1ccccc1 Amb24710342 [0,1,0,0,1,0|1,0,0]=3 4001 B11R1.12 CSC(C=O)c1ccccc1 Amb18646623 [0,1,0,0,1,0|0,1,1]=4 4002 B11R1.12 CS\C(=C\Cl)\c1ccccc1 Amb24511893 [0,1,0,0,1,0|1,1,0]=4 4003 B11R1.12 C\C=C(/C=O)\c1cc[n]cc1 Amb24418258 [0,1,0,0,1,0|2,0,0]=4 4004 B11R1.12 C\C=C(/C=O)\c1ccccc1 Amb18644269 [0,1,0,0,1,0|1,0,0]=3 4005 B11R1.12 C\C=C(/CBr)\c1ccccc1 Amb24356608 [0,1,0,0,1,0|2,0,0]=4 4006 B11R1.12 C\C=C(\C#N)/c1ccccc1 Amb24595488 [0,1,0,0,1,0|2,0,0]=4 4007 B11R1.12 C\C=C(\C=O)/c1cc[n]cc1 Amb24588747 [0,1,0,0,1,0|2,0,0]=4 4008 B11R1.12 C\C=C(\C=O)/c1ccccc1 Amb20242407 [0,1,0,0,1,0|1,0,0]=3 4009 B11R1.12 C\C=C(\CO)/c1ccccc1 Amb25084503 [0,1,0,0,1,0|1,0,1]=4 4010 B11R1.12 C\C=C(\c1ccccc1)/C#N Amb17231965 [0,1,0,0,1,0|2,0,0]=4 4011 B11R1.12 Cl\C=C(/c1ccccc1)\C=O Amb17594154 [0,1,0,0,1,0|2,0,0]=4 4012 B11R1.12 NCC(c1ccccc1)OC Amb10609834 [0,1,0,0,1,0|1,0,1]=4 4013 B11R1.12 N\C=C(/C=O)\c1ccccc1 Amb24468220 [0,1,0,0,1,0|2,0,0]=4 4014 B11R1.12 N\C=C(\C=O)/c1ccccc1 Amb25103676 [0,1,0,0,1,0|2,0,0]=4 4015 B11R1.12 O=C\C(=C/Br)\c1ccccc1 Amb25778114 [0,1,0,0,1,0|2,0,0]=4 4016 B11R1.12 O=C\C(=C/S)\c1ccccc1 Amb18126408 [0,1,0,0,1,0|2,0,0]=4 4017 B11R1.12 O=C\C(=C\Br)\c1ccccc1 Amb24634608 [0,1,0,0,1,0|2,0,0]=4 4018 B11R1.12 OC[C@H](c1ccccc1)OC Amb10807423 [0,1,0,0,1,0|0,0,2]=4 4019 B11R1.12 O\C=C(\C=O)/c1ccccc1 Amb25092916 [0,1,0,0,1,0|2,0,0]=4 4020 B11R1.12 O\C=C(\c1ccccc1)/C=O Amb10576572 [0,1,0,0,1,0|2,0,0]=4 4021 B11R1.22 BrCC(=O)c1ccc(cc1)C Amb1981331 [0,1,0,0,1,0|2,0,0]=4 4022 B11R1.22 BrCC(=O)c1ccc(cc1)Cl Amb2505006 [0,1,0,0,1,0|2,0,0]=4 4023 B11R1.22 BrCC(=O)c1ccc(cc1)F Amb1885038 [0,1,0,0,1,0|2,0,0]=4 4024 B11R1.22 C#CC(=O)c1ccc(Cl)cc1 Amb25720663 [0,1,0,0,1,0|1,0,1]=4 4025 B11R1.22 C#CC(=O)c1ccc(F)cc1 Amb24447227 [0,1,0,0,1,0|1,0,1]=4 4026 B11R1.22 C#CC(=O)c1ccc(I)cc1 Amb25106761 [0,1,0,0,1,0|1,0,1]=4 4027 B11R1.22 C#CC(=O)c1ccc(N)cc1 Amb24488157 [0,1,0,0,1,0|1,0,1]=4 4028 B11R1.22 C=CC(=O)c1ccc(Br)cc1 Amb18066306 [0,1,0,0,1,0|1,0,1]=4 4029 B11R1.22 C=CC(=O)c1ccc(Cl)cc1 Amb18563779 [0,1,0,0,1,0|1,0,1]=4 4030 B11R1.22 C=CC(=O)c1ccc(F)cc1 Amb18065313 [0,1,0,0,1,0|1,0,1]=4 4031 B11R1.22 C=CC(=O)c1ccc(I)cc1 Amb24567537 [0,1,0,0,1,0|1,0,1]=4 4032 B11R1.22 C=CC(=O)c1ccc(O)cc1 Amb24121488 [0,1,0,0,1,0|1,0,1]=4 4033 B11R1.22 CC=1C=CN(CC1)C(=O)OC Amb24060040 [0,1,0,0,1,0|1,0,1]=4 4034 B11R1.22 CCC(=C)c1ccc(Br)cc1 Amb20668394 [0,1,0,0,1,0|2,0,0]=4 4035 B11R1.22 CCC(=O)N1C=CC(=O)C=C1 Amb25838673 [0,1,0,0,1,0|2,0,0]=4 4036 B11R1.22 CCC(=O)c1ccc(Br)[n]c1 Amb23446252 [0,1,0,0,1,0|2,0,0]=4 4037 B11R1.22 CCC(=O)c1ccc(F)c[n]1 Amb25759749 [0,1,0,0,1,0|2,0,0]=4 4038 B11R1.22 CCC(=O)c1ccc(I)[n]c1 Amb23446977 [0,1,0,0,1,0|2,0,0]=4 4039 B11R1.22 CCC(=O)c1ccc(N)[n]c1 Amb23446324 [0,1,0,0,1,0|2,0,0]=4 4040 B11R1.22 CCC(=O)c1ccc(O)[n]c1 Amb23446708 [0,1,0,0,1,0|2,0,0]=4 4041 B11R1.22 CCC(=O)c1ccc(O)c[n]1 Amb25028212 [0,1,0,0,1,0|2,0,0]=4 4042 B11R1.22 CCC(=O)c1ccc(S)[n]c1 Amb23446721 [0,1,0,0,1,0|2,0,0]=4 4043 B11R1.22 CCC(=O)c1ccc(S)cc1 Amb25273108 [0,1,0,0,1,0|1,0,0]=3 4044 B11R1.22 CCC(=O)c1ccc(cc1)O Amb1336085 [0,1,0,0,1,0|1,0,0]=3 4045 B11R1.22 CCC(=S)c1ccc(O)cc1 Amb25258595 [0,1,0,0,1,0|1,1,0]=4 4046 B11R1.22 CCS(=O)c1ccc(F)cc1 Amb25771877 [0,1,0,0,1,0|2,0,0]=4 4047 B11R1.22 CCS(=O)c1ccc(N)cc1 Amb18284277 [0,1,0,0,1,0|2,0,0]=4 4048 B11R1.22 CN=C(N)c1ccc(F)cc1 Amb24070278 [0,1,0,0,1,0|2,0,0]=4 4049 B11R1.22 CN=C(N)c1ccc(N)cc1 Amb24091300 [0,1,0,0,1,0|2,0,0]=4 4050 B11R1.22 CNC(=N)c1ccc(Cl)cc1 Amb24415099 [0,1,0,0,1,0|2,0,0]=4 4051 B11R1.22 CNC(=N)c1ccc(O)cc1 Amb18125142 [0,1,0,0,1,0|2,0,0]=4 4052 B11R1.22 CNC(=O)C1=CNC(=O)C=C1 Amb18799400 [0,1,0,0,1,0|2,0,0]=4 4053 B11R1.22 CNC(=O)c1ccc(Br)[n]c1 Amb19959847 [0,1,0,0,1,0|2,0,0]=4 4054 B11R1.22 CNC(=O)c1ccc(F)[n]c1 Amb24660138 [0,1,0,0,1,0|2,0,0]=4 4055 B11R1.22 CNC(=O)c1ccc(N)[n]c1 Amb18946779 [0,1,0,0,1,0|2,0,0]=4 4056 B11R1.22 CNC(=O)c1ccc(O)c[n]1 Amb19895115 [0,1,0,0,1,0|2,0,0]=4 4057 B11R1.22 CNC(=O)c1ccc(S)cc1 Amb24486099 [0,1,0,0,1,0|1,0,0]=3 4058 B11R1.22 CNC(=O)c1ccc(cc1)Br Amb1232931 [0,1,0,0,1,0|1,0,0]=3 4059 B11R1.22 CNC(=O)c1ccc(cc1)Br Amb1774478 [0,1,0,0,1,0|1,0,0]=3 4060 B11R1.22 CNC(=O)c1ccc(cc1)Br Amb1774979 [0,1,0,0,1,0|1,0,0]=3 4061 B11R1.22 CNC(=O)c1ccc(cc1)Br Amb1797209 [0,1,0,0,1,0|1,0,0]=3 4062 B11R1.22 CNC(=O)c1ccc(cc1)C Amb1771439 [0,1,0,0,1,0|1,0,0]=3 4063 B11R1.22 CNC(=O)c1ccc(cc1)C Amb1796878 [0,1,0,0,1,0|1,0,0]=3 4064 B11R1.22 CNC(=O)c1ccc(cc1)C Amb1806248 [0,1,0,0,1,0|1,0,0]=3 4065 B11R1.22 CNC(=O)c1ccc(cc1)C Amb1814728 [0,1,0,0,1,0|1,0,0]=3 4066 B11R1.22 CNC(=O)c1ccc(cc1)I Amb1230427 [0,1,0,0,1,0|1,0,0]=3 4067 B11R1.22 CNC(=O)c1ccc(cn1)Br Amb10068169 [0,1,0,0,1,0|2,0,0]=4 4068 B11R1.22 CNC(=O)c1ccc(nc1)Cl Amb2106608 [0,1,0,0,1,0|2,0,0]=4 4069 B11R1.22 CNC(=S)c1ccc(Br)cc1 Amb24528870 [0,1,0,0,1,0|1,1,0]=4 4070 B11R1.22 CNS(=O)c1ccc(N)cc1 Amb18862841 [0,1,0,0,1,0|2,0,0]=4 4071 B11R1.22 COC(=C)c1ccc(Br)cc1 Amb25325540 [0,1,0,0,1,0|1,0,0]=3 4072 B11R1.22 COC(=N)c1ccc(Br)cc1 Amb24056401 [0,1,0,0,1,0|1,0,0]=3 4073 B11R1.22 COC(=N)c1ccc(Cl)cc1 Amb18180239 [0,1,0,0,1,0|1,0,0]=3 4074 B11R1.22 COC(=N)c1ccc(Cl)cc1 Amb22736537 [0,1,0,0,1,0|1,0,0]=3 4075 B11R1.22 COC(=N)c1ccc(F)c[n]1 Amb25286867 [0,1,0,0,1,0|2,0,0]=4 4076 B11R1.22 COC(=N)c1ccc(F)cc1 Amb18791533 [0,1,0,0,1,0|1,0,0]=3 4077 B11R1.22 COC(=N)c1ccc(N)cc1 Amb24096140 [0,1,0,0,1,0|1,0,0]=3 4078 B11R1.22 COC(=N)c1ccc(O)cc1 Amb18181685 [0,1,0,0,1,0|1,0,0]=3 4079 B11R1.22 COC(=O)C1=CNC(=O)C=C1 Amb18182832 [0,1,0,0,1,0|1,0,0]=3 4080 B11R1.22 COC(=O)C1=CNC(=O)C=C1 Amb19372931 [0,1,0,0,1,0|1,0,0]=3 4081 B11R1.22 COC(=O)C1=CNC(=O)N=C1 Amb21964436 [0,1,0,0,1,0|2,0,0]=4 4082 B11R1.22 COC(=O)C1=CNC(=O)N=C1 Amb22495305 [0,1,0,0,1,0|2,0,0]=4 4083 B11R1.22 COC(=O)C1=COC(=O)C=C1 Amb18796753 [0,1,0,0,1,0|1,0,0]=3 4084 B11R1.22 COC(=O)C1C=CN(C)C=C1 Amb24099561 [0,1,0,0,1,0|1,0,1]=4 4085 B11R1.22 COC(=O)C=1C=CC(=O)NN1 Amb18372542 [0,1,0,0,1,0|2,0,0]=4 4086 B11R1.22 COC(=O)C=1C=CN(C)CC1 Amb24099559 [0,1,0,0,1,0|1,0,1]=4 4087 B11R1.22 COC(=O)C=1CCC(N)=CC1 Amb24099079 [0,1,0,0,1,0|0,0,2]=4 4088 B11R1.22 COC(=O)N1C=CC(C)C=C1 Amb24060187 [0,1,0,0,1,0|1,0,1]=4 4089 B11R1.22 COC(=O)c1[n]cc(Cl)c[n]1 Amb22886749 [0,1,0,0,1,0|2,0,0]=4 4090 B11R1.22 COC(=O)c1[n]cc(F)c[n]1 Amb22263818 [0,1,0,0,1,0|2,0,0]=4 4091 B11R1.22 COC(=O)c1[n]cc(N)c[n]1 Amb22899758 [0,1,0,0,1,0|2,0,0]=4 4092 B11R1.22 COC(=O)c1[n]cc(O)c[n]1 Amb25697454 [0,1,0,0,1,0|2,0,0]=4 4093 B11R1.22 COC(=O)c1c[nH]c(=S)c[n]1 Amb24096177 [0,1,0,0,1,0|2,0,0]=4 4094 B11R1.22 COC(=O)c1c[n]c(Br)[n]c1 Amb22751737 [0,1,0,0,1,0|2,0,0]=4 4095 B11R1.22 COC(=O)c1c[n]c(F)c[n]1 Amb24096170 [0,1,0,0,1,0|2,0,0]=4 4096 B11R1.22 COC(=O)c1c[n]c(N)c[n]1 Amb21960728 [0,1,0,0,1,0|2,0,0]=4 4097 B11R1.22 COC(=O)c1c[n]c(O)[n]c1 Amb18125641 [0,1,0,0,1,0|2,0,0]=4 4098 B11R1.22 COC(=O)c1cc[n+](cc1)C Amb2502553 [0,1,0,0,1,0|1,0,0]=3 4099 B11R1.22 COC(=O)c1ccc(Br)[n][n]1 Amb22277068 [0,1,0,0,1,0|2,0,0]=4 4100 B11R1.22 COC(=O)c1ccc(C)nn1 Amb17798484 [0,1,0,0,1,0|2,0,0]=4 4101 B11R1.22 COC(=O)c1ccc(Cl)c[n]1 Amb22751028 [0,1,0,0,1,0|1,0,0]=3 4102 B11R1.22 COC(=O)c1ccc(F)[n][n]1 Amb22750322 [0,1,0,0,1,0|2,0,0]=4 4103 B11R1.22 COC(=O)c1ccc(F)c[n]1 Amb19930069 [0,1,0,0,1,0|1,0,0]=3 4104 B11R1.22 COC(=O)c1ccc(I)[nH+]c1 Amb22474983 [0,1,0,0,1,0|1,0,0]=3 4105 B11R1.22 COC(=O)c1ccc(I)[n][n]1 Amb24066762 [0,1,0,0,1,0|2,0,0]=4 4106 B11R1.22 COC(=O)c1ccc(I)[n]c1 Amb22057831 [0,1,0,0,1,0|1,0,0]=3 4107 B11R1.22 COC(=O)c1ccc(N)[n][n]1 Amb22492029 [0,1,0,0,1,0|2,0,0]=4 4108 B11R1.22 COC(=O)c1ccc(N)[n]c1 Amb24066753 [0,1,0,0,1,0|1,0,0]=3 4109 B11R1.22 COC(=O)c1ccc(N)c[n]1 Amb22751029 [0,1,0,0,1,0|1,0,0]=3 4110 B11R1.22 COC(=O)c1ccc(N)nn1 Amb17935795 [0,1,0,0,1,0|2,0,0]=4 4111 B11R1.22 COC(=O)c1ccc(O)[n][n]1 Amb21811761 [0,1,0,0,1,0|2,0,0]=4 4112 B11R1.22 COC(=O)c1ccc(S)[n]c1 Amb23446717 [0,1,0,0,1,0|1,0,0]=3 4113 B11R1.22 COC(=O)c1ccc(S)c[n]1 Amb25216569 [0,1,0,0,1,0|1,0,0]=3 4114 B11R1.22 COC(=O)c1ccc(cc1)Br Amb1394975 [0,1,0,0,1,0|0,0,0]=2 4115 B11R1.22 COC(=O)c1ccc(cc1)C Amb1210121 [0,1,0,0,1,0|0,0,0]=2 4116 B11R1.22 COC(=O)c1ccc(cc1)F Amb2227542 [0,1,0,0,1,0|0,0,0]=2 4117 B11R1.22 COC(=O)c1ccc(cc1)I Amb2411582 [0,1,0,0,1,0|0,0,0]=2 4118 B11R1.22 COC(=O)c1ccc(cc1)N Amb1215269 [0,1,0,0,1,0|0,0,0]=2 4119 B11R1.22 COC(=O)c1ccc(cn1)Cl Amb15695243 [0,1,0,0,1,0|1,0,0]=3 4120 B11R1.22 COC(=O)c1ccc(cn1)N Amb10603994 [0,1,0,0,1,0|1,0,0]=3 4121 B11R1.22 COC(=O)c1ccc(cn1)O Amb2236633 [0,1,0,0,1,0|1,0,0]=3 4122 B11R1.22 COC(=O)c1ccc(nc1)Cl Amb16207561 [0,1,0,0,1,0|1,0,0]=3 4123 B11R1.22 COC(=O)c1ccc(nc1)N Amb2413102 [0,1,0,0,1,0|1,0,0]=3 4124 B11R1.22 COC(=O)c1cnc(cn1)Br Amb10603997 [0,1,0,0,1,0|2,0,0]=4 4125 B11R1.22 COC(=O)c1cnc(cn1)N Amb17608285 [0,1,0,0,1,0|2,0,0]=4 4126 B11R1.22 COC(=O)c1cnc(cn1)O Amb1093992 [0,1,0,0,1,0|2,0,0]=4 4127 B11R1.22 COC(=O)c1cnc(nc1)C Amb13892051 [0,1,0,0,1,0|2,0,0]=4 4128 B11R1.22 COC(=O)c1ncc(cn1)Br Amb10606664 [0,1,0,0,1,0|2,0,0]=4 4129 B11R1.22 COC(=O)c1ncc(cn1)N Amb16231456 [0,1,0,0,1,0|2,0,0]=4 4130 B11R1.22 COC(=S)c1ccc(Br)cc1 Amb25288803 [0,1,0,0,1,0|0,1,0]=3 4131 B11R1.22 COC(=S)c1ccc(Cl)cc1 Amb25300049 [0,1,0,0,1,0|0,1,0]=3 4132 B11R1.22 COC(=S)c1ccc(N)cc1 Amb25758861 [0,1,0,0,1,0|0,1,0]=3 4133 B11R1.22 COC(C)c1ccc(F)cc1 Amb18633172 [0,1,0,0,1,0|1,0,1]=4 4134 B11R1.22 COC(C)c1ccc(I)cc1 Amb23568516 [0,1,0,0,1,0|1,0,1]=4 4135 B11R1.22 COC(C)c1ccc(N)cc1 Amb18952191 [0,1,0,0,1,0|1,0,1]=4 4136 B11R1.22 COC(C)c1ccc(O)cc1 Amb18644512 [0,1,0,0,1,0|1,0,1]=4 4137 B11R1.22 COC(C)c1ccc(S)cc1 Amb23568715 [0,1,0,0,1,0|1,0,1]=4 4138 B11R1.22 COC(O)c1ccc(O)cc1 Amb25714240 [0,1,0,0,1,0|0,0,2]=4 4139 B11R1.22 COP(=O)c1ccc(O)cc1 Amb25713698 [0,1,0,0,1,0|1,0,0]=3 4140 B11R1.22 COS(=O)c1ccc(cc1)Cl Amb10070067 [0,1,0,0,1,0|1,0,0]=3 4141 B11R1.22 CO[C@H](C)c1ccc(Br)cc1 Amb25739065 [0,1,0,0,1,0|1,0,1]=4 4142 B11R1.22 CO\C(\O)=C/1\C=CC(=O)C=N1 Amb24389848 [0,1,0,0,1,0|1,0,1]=4 4143 B11R1.22 CSC(=O)c1ccc(Cl)cc1 Amb25061919 [0,1,0,0,1,0|0,1,0]=3 4144 B11R1.22 C[n+]1ccc(cc1)C(=O)NC Amb22475467 [0,1,0,0,1,0|2,0,0]=4 4145 B11R1.22 C\C(=C/C)\c1ccc(N)cc1 Amb25834627 [0,1,0,0,1,0|2,0,0]=4 4146 B11R1.22 C\C(=C/C)\c1ccc(O)cc1 Amb25807631 [0,1,0,0,1,0|2,0,0]=4 4147 B11R1.22 C\C(=C\C)\c1ccc(N)cc1 Amb24574842 [0,1,0,0,1,0|2,0,0]=4 4148 B11R1.22 C\C=C(/Cl)\c1ccc(O)cc1 Amb25371858 [0,1,0,0,1,0|2,0,0]=4 4149 B11R1.22 C\C=C(/O)\c1ccc(F)cc1 Amb24100278 [0,1,0,0,1,0|1,0,1]=4 4150 B11R1.22 C\C=C(\Cl)/c1ccc(O)cc1 Amb24697857 [0,1,0,0,1,0|2,0,0]=4 4151 B11R1.22 Cc1c[n]c([n]c1)C(=O)OC Amb22304676 [0,1,0,0,1,0|2,0,0]=4 4152 B11R1.22 Cc1ccc([n]c1)C(=N)OC Amb24475317 [0,1,0,0,1,0|2,0,0]=4 4153 B11R1.22 Cc1ccc([n]c1)C(=O)CC Amb22898827 [0,1,0,0,1,0|2,0,0]=4 4154 B11R1.22 Cc1ccc([n]c1)C(=O)NC Amb25151403 [0,1,0,0,1,0|2,0,0]=4 4155 B11R1.22 Cc1ccc([n]c1)C(=O)OC Amb19958650 [0,1,0,0,1,0|1,0,0]=3 4156 B11R1.22 Cc1ccc(c[n]1)C(=O)NC Amb24072724 [0,1,0,0,1,0|2,0,0]=4 4157 B11R1.22 Cc1ccc(cc1)C(=N)OC Amb22269339 [0,1,0,0,1,0|1,0,0]=3 4158 B11R1.22 Cc1ccc(cc1)C(=O)C=C Amb18063916 [0,1,0,0,1,0|1,0,1]=4 4159 B11R1.22 Cc1ccc(cc1)C(=O)CF Amb24084136 [0,1,0,0,1,0|2,0,0]=4 4160 B11R1.22 Cc1ccc(cc1)C(=O)CN Amb22490690 [0,1,0,0,1,0|2,0,0]=4 4161 B11R1.22 Cc1ccc(cc1)C(=O)SC Amb25305675 [0,1,0,0,1,0|0,1,0]=3 4162 B11R1.22 Cc1ccc(cc1)C(=S)NC Amb24739783 [0,1,0,0,1,0|1,1,0]=4 4163 B11R1.22 Cc1ccc(cc1)S(=O)OC Amb22230928 [0,1,0,0,1,0|1,0,0]=3 4164 B11R1.22 ClCC(=O)c1ccc(cc1)Br Amb1103620 [0,1,0,0,1,0|2,0,0]=4 4165 B11R1.22 ClCC(=O)c1ccc(cc1)C Amb1105496 [0,1,0,0,1,0|2,0,0]=4 4166 B11R1.22 ClCC(=O)c1ccc(cc1)F Amb1221364 [0,1,0,0,1,0|2,0,0]=4 4167 B11R1.22 ClCC(=O)c1ccc(cc1)O Amb1218323 [0,1,0,0,1,0|2,0,0]=4 4168 B11R1.22 Clc1ccc(cc1)C(=O)C#N Amb17939433 [0,1,0,0,1,0|2,0,0]=4 4169 B11R1.22 FCC(=O)c1ccc(cc1)Cl Amb10603324 [0,1,0,0,1,0|2,0,0]=4 4170 B11R1.22 N#CC(=O)c1ccc(I)cc1 Amb22495535 [0,1,0,0,1,0|2,0,0]=4 4171 B11R1.22 N#CC(=O)c1ccc(O)cc1 Amb25842027 [0,1,0,0,1,0|2,0,0]=4 4172 B11R1.22 N#CC(=O)c1ccc(cc1)C Amb17231996 [0,1,0,0,1,0|2,0,0]=4 4173 B11R1.22 N#CC(=O)c1ccc(cc1)F Amb17232050 [0,1,0,0,1,0|2,0,0]=4 4174 B11R1.22 NCC(=O)c1ccc(Cl)cc1 Amb19884070 [0,1,0,0,1,0|2,0,0]=4 4175 B11R1.22 NCC(=O)c1ccc(I)cc1 Amb21962789 [0,1,0,0,1,0|2,0,0]=4 4176 B11R1.22 NCC(=O)c1ccc(O)cc1 Amb22001575 [0,1,0,0,1,0|2,0,0]=4 4177 B11R1.22 NCC(=O)c1ccc(S)cc1 Amb25082898 [0,1,0,0,1,0|2,0,0]=4 4178 B11R1.22 NCC(=O)c1ccc(cc1)Br Amb1811968 [0,1,0,0,1,0|2,0,0]=4 4179 B11R1.22 NCC(=O)c1ccc(cc1)Cl Amb1208662 [0,1,0,0,1,0|2,0,0]=4 4180 B11R1.22 NCC(=O)c1ccc(cc1)Cl Amb2370537 [0,1,0,0,1,0|2,0,0]=4 4181 B11R1.22 NCC(=O)c1ccc(cc1)F Amb1419069 [0,1,0,0,1,0|2,0,0]=4 4182 B11R1.22 NCC(=O)c1ccc(cc1)O Amb17593762 [0,1,0,0,1,0|2,0,0]=4 4183 B11R1.22 NNC(=O)c1ccc(S)cc1 Amb25228454 [0,1,0,0,1,0|2,0,0]=4 4184 B11R1.22 NNC(=O)c1ccc(cc1)Br Amb1207367 [0,1,0,0,1,0|2,0,0]=4 4185 B11R1.22 NNC(=O)c1ccc(cc1)Cl Amb1209335 [0,1,0,0,1,0|2,0,0]=4 4186 B11R1.22 NNC(=O)c1ccc(cc1)F Amb1104475 [0,1,0,0,1,0|2,0,0]=4 4187 B11R1.22 NNC(=O)c1ccc(cc1)I Amb1788092 [0,1,0,0,1,0|2,0,0]=4 4188 B11R1.22 NNC(=O)c1ccc(cc1)O Amb1212100 [0,1,0,0,1,0|2,0,0]=4 4189 B11R1.22 NOC(=O)c1ccc(Cl)cc1 Amb24539350 [0,1,0,0,1,0|1,0,0]=3 4190 B11R1.22 Nc1ccc(cc1)C(=O)C#N Amb24068507 [0,1,0,0,1,0|2,0,0]=4 4191 B11R1.22 Nc1ccc(cc1)C(=O)CI Amb25317674 [0,1,0,0,1,0|2,0,0]=4 4192 B11R1.22 Nc1ccc(cc1)C(=O)CN Amb24106018 [0,1,0,0,1,0|2,0,0]=4 4193 B11R1.22 Nc1ccc(cc1)C(=O)CS Amb25169304 [0,1,0,0,1,0|2,0,0]=4 4194 B11R1.22 Nc1ccc(cc1)C(=O)O[Na] Amb22338470 [0,1,0,0,1,0|1,0,0]=3 4195 B11R1.22 O=C(CF)c1ccc(F)cc1 Amb22490651 [0,1,0,0,1,0|2,0,0]=4 4196 B11R1.22 O=C(CI)c1ccc(Br)cc1 Amb23579956 [0,1,0,0,1,0|2,0,0]=4 4197 B11R1.22 O=C(CI)c1ccc(Cl)cc1 Amb23579973 [0,1,0,0,1,0|2,0,0]=4 4198 B11R1.22 O=CC(=O)c1ccc(cc1)Br Amb10067934 [0,1,0,0,1,0|2,0,0]=4 4199 B11R1.22 O=CC(=O)c1ccc(cc1)C Amb10067935 [0,1,0,0,1,0|2,0,0]=4 4200 B11R1.22 O=CC(=O)c1ccc(cc1)Cl Amb10067933 [0,1,0,0,1,0|2,0,0]=4 4201 B11R1.22 O=CC(=O)c1ccc(cc1)O Amb10069044 [0,1,0,0,1,0|2,0,0]=4 4202 B11R1.22 Oc1ccc(cc1)C(=O)CF Amb24084117 [0,1,0,0,1,0|2,0,0]=4 4203 B11R1.22 Oc1ccc(cc1)C(=O)CS Amb24486187 [0,1,0,0,1,0|2,0,0]=4 4204 B11R1.22 SCC(=O)c1ccc(cc1)Br Amb17407556 [0,1,0,0,1,0|2,0,0]=4 4205 B11R1.22 SCC(=O)c1ccc(cc1)C Amb17400215 [0,1,0,0,1,0|2,0,0]=4 4206 B11R1.22 SCC(=O)c1ccc(cc1)Cl Amb17401093 [0,1,0,0,1,0|2,0,0]=4 4207 B11R1.22 SCC(=O)c1ccc(cc1)F Amb17400324 [0,1,0,0,1,0|2,0,0]=4 4208 B11R1.22 [NH3+]CC(=O)c1ccc(Br)cc1 Amb24113825 [0,1,0,0,1,0|2,0,0]=4 4209 B11R1.22 [NH3+]CC(=O)c1ccc(cc1)C Amb10606218 [0,1,0,0,1,0|2,0,0]=4 4210 B11R1.23 BrCC(=O)c1cccc(c1)Cl Amb1224657 [0,1,0,0,1,0|2,0,0]=4 4211 B11R1.23 BrCC(=O)c1cccc(c1)I Amb1885036 [0,1,0,0,1,0|2,0,0]=4 4212 B11R1.23 BrCC(=O)c1cccc(c1)O Amb1981340 [0,1,0,0,1,0|2,0,0]=4 4213 B11R1.23 C#CC(=O)c1cccc(Br)c1 Amb25842033 [0,1,0,0,1,0|1,0,1]=4 4214 B11R1.23 C#CC(=O)c1cccc(Cl)c1 Amb25687191 [0,1,0,0,1,0|1,0,1]=4 4215 B11R1.23 C#CC(=O)c1cccc(I)c1 Amb24421428 [0,1,0,0,1,0|1,0,1]=4 4216 B11R1.23 C#CC(=O)c1cccc(N)c1 Amb24550417 [0,1,0,0,1,0|1,0,1]=4 4217 B11R1.23 C=CC(=O)c1cccc(Cl)c1 Amb25783480 [0,1,0,0,1,0|1,0,1]=4 4218 B11R1.23 C=CC(=O)c1cccc(N)c1 Amb25291745 [0,1,0,0,1,0|1,0,1]=4 4219 B11R1.23 C=CC(=O)c1cccc(O)c1 Amb18124877 [0,1,0,0,1,0|1,0,1]=4 4220 B11R1.23 CC=1CN(C=CC1)C(=O)OC Amb24060030 [0,1,0,0,1,0|1,0,1]=4 4221 B11R1.23 CCC(=O)c1c[n]cc(Br)c1 Amb23450052 [0,1,0,0,1,0|2,0,0]=4 4222 B11R1.23 CCC(=O)c1c[n]cc(Cl)c1 Amb25185418 [0,1,0,0,1,0|2,0,0]=4 4223 B11R1.23 CCC(=O)c1c[n]cc(F)c1 Amb18791535 [0,1,0,0,1,0|2,0,0]=4 4224 B11R1.23 CCC(=O)c1cc[n]c(Br)c1 Amb25032550 [0,1,0,0,1,0|2,0,0]=4 4225 B11R1.23 CCC(=O)c1cc[n]c(N)c1 Amb18125140 [0,1,0,0,1,0|2,0,0]=4 4226 B11R1.23 CCC(=O)c1cccc(N)[n]1 Amb25314535 [0,1,0,0,1,0|2,0,0]=4 4227 B11R1.23 CCC(=O)c1cccc(S)c1 Amb24549290 [0,1,0,0,1,0|1,0,0]=3 4228 B11R1.23 CCC(=O)c1cccc(c1)Br Amb1233199 [0,1,0,0,1,0|1,0,0]=3 4229 B11R1.23 CCS(=O)c1cccc(F)c1 Amb24689196 [0,1,0,0,1,0|2,0,0]=4 4230 B11R1.23 CCS(=O)c1cccc(N)c1 Amb25363005 [0,1,0,0,1,0|2,0,0]=4 4231 B11R1.23 CCS(=O)c1cccc(O)c1 Amb25085240 [0,1,0,0,1,0|2,0,0]=4 4232 B11R1.23 CN(OC)c1cccc(Cl)c1 Amb20620735 [0,1,0,0,1,0|2,0,0]=4 4233 B11R1.23 CN1C=C(CC=C1)C(=O)OC Amb24062401 [0,1,0,0,1,0|1,0,1]=4 4234 B11R1.23 CNC(=N)c1cccc(Cl)c1 Amb24533036 [0,1,0,0,1,0|2,0,0]=4 4235 B11R1.23 CNC(=O)c1c[n+]([O-])ccc1 Amb25822992 [0,1,0,0,1,0|2,0,0]=4 4236 B11R1.23 CNC(=O)c1c[n]cc(F)c1 Amb25052399 [0,1,0,0,1,0|2,0,0]=4 4237 B11R1.23 CNC(=O)c1c[n]cc(I)c1 Amb25272275 [0,1,0,0,1,0|2,0,0]=4 4238 B11R1.23 CNC(=O)c1c[n]cc(N)c1 Amb23452695 [0,1,0,0,1,0|2,0,0]=4 4239 B11R1.23 CNC(=O)c1c[n]cc(O)c1 Amb24062366 [0,1,0,0,1,0|2,0,0]=4 4240 B11R1.23 CNC(=O)c1cc(Br)cc[n]1 Amb25312186 [0,1,0,0,1,0|2,0,0]=4 4241 B11R1.23 CNC(=O)c1cc(Cl)ccn1 Amb1216582 [0,1,0,0,1,0|2,0,0]=4 4242 B11R1.23 CNC(=O)c1cc(Cl)ccn1 Amb17611087 [0,1,0,0,1,0|2,0,0]=4 4243 B11R1.23 CNC(=O)c1cc(F)cc[n]1 Amb25714403 [0,1,0,0,1,0|2,0,0]=4 4244 B11R1.23 CNC(=O)c1cc(O)cc[n]1 Amb22755769 [0,1,0,0,1,0|2,0,0]=4 4245 B11R1.23 CNC(=O)c1cc[n]c(F)c1 Amb18787496 [0,1,0,0,1,0|2,0,0]=4 4246 B11R1.23 CNC(=O)c1cc[n]c(N)c1 Amb18946781 [0,1,0,0,1,0|2,0,0]=4 4247 B11R1.23 CNC(=O)c1cccc(=O)[nH]1 Amb24096727 [0,1,0,0,1,0|2,0,0]=4 4248 B11R1.23 CNC(=O)c1cccc(Br)[n]1 Amb19959848 [0,1,0,0,1,0|2,0,0]=4 4249 B11R1.23 CNC(=O)c1cccc(N)[n]1 Amb18946961 [0,1,0,0,1,0|2,0,0]=4 4250 B11R1.23 CNC(=O)c1cccc(N)c1 Amb24053079 [0,1,0,0,1,0|1,0,0]=3 4251 B11R1.23 CNC(=O)c1cccc(S)c1 Amb25188808 [0,1,0,0,1,0|1,0,0]=3 4252 B11R1.23 CNC(=O)c1cccc(c1)N Amb1212262 [0,1,0,0,1,0|1,0,0]=3 4253 B11R1.23 CNC(=O)c1cccc(n1)Cl Amb10877696 [0,1,0,0,1,0|2,0,0]=4 4254 B11R1.23 CNC(=O)c1ccnc(c1)Br Amb15691039 [0,1,0,0,1,0|2,0,0]=4 4255 B11R1.23 COC(=N)c1cccc(Br)c1 Amb24420410 [0,1,0,0,1,0|1,0,0]=3 4256 B11R1.23 COC(=N)c1cccc(Cl)c1 Amb18180240 [0,1,0,0,1,0|1,0,0]=3 4257 B11R1.23 COC(=N)c1cccc(F)c1 Amb18791534 [0,1,0,0,1,0|1,0,0]=3 4258 B11R1.23 COC(=N)c1cccc(I)c1 Amb25829119 [0,1,0,0,1,0|1,0,0]=3 4259 B11R1.23 COC(=N)c1cccc(N)c1 Amb24096058 [0,1,0,0,1,0|1,0,0]=3 4260 B11R1.23 COC(=N)c1cccc(O)c1 Amb18179386 [0,1,0,0,1,0|1,0,0]=3 4261 B11R1.23 COC(=O)C1=CC(=O)C=CS1 Amb25348661 [0,1,0,0,1,0|1,0,0]=3 4262 B11R1.23 COC(=O)C1=CC(=O)C=NN1 Amb24359096 [0,1,0,0,1,0|2,0,0]=4 4263 B11R1.23 COC(=O)C1=CC(=O)N=CN1 Amb22497602 [0,1,0,0,1,0|2,0,0]=4 4264 B11R1.23 COC(=O)C1=CC(=O)NC=C1 Amb19895329 [0,1,0,0,1,0|1,0,0]=3 4265 B11R1.23 COC(=O)C1=CC(=O)NN=C1 Amb22235613 [0,1,0,0,1,0|2,0,0]=4 4266 B11R1.23 COC(=O)C1=CC=CC(=O)N1 Amb21963502 [0,1,0,0,1,0|1,0,0]=3 4267 B11R1.23 COC(=O)C=1C=CCN(C)C1 Amb24062405 [0,1,0,0,1,0|1,0,1]=4 4268 B11R1.23 COC(=O)C=1C=CNC(=N)C1 Amb19281876 [0,1,0,0,1,0|1,0,0]=3 4269 B11R1.23 COC(=O)C=1C=CNC(=O)N1 Amb22275937 [0,1,0,0,1,0|2,0,0]=4 4270 B11R1.23 COC(=O)C=1NC(=S)C=CN1 Amb24354855 [0,1,0,0,1,0|2,0,0]=4 4271 B11R1.23 COC(=O)c1[n]c(Br)cc[n]1 Amb22001872 [0,1,0,0,1,0|2,0,0]=4 4272 B11R1.23 COC(=O)c1[n]c(Cl)cc[n]1 Amb20617427 [0,1,0,0,1,0|2,0,0]=4 4273 B11R1.23 COC(=O)c1[n]c(I)cc[n]1 Amb24602324 [0,1,0,0,1,0|2,0,0]=4 4274 B11R1.23 COC(=O)c1[n]ccc(=O)o1 Amb24096201 [0,1,0,0,1,0|2,0,0]=4 4275 B11R1.23 COC(=O)c1c[n]cc(Br)[n]1 Amb19958092 [0,1,0,0,1,0|2,0,0]=4 4276 B11R1.23 COC(=O)c1c[n]cc(N)[n]1 Amb19879012 [0,1,0,0,1,0|2,0,0]=4 4277 B11R1.23 COC(=O)c1c[n]cc(N)c1 Amb22756402 [0,1,0,0,1,0|1,0,0]=3 4278 B11R1.23 COC(=O)c1c[n]cc(O)[n]1 Amb18125640 [0,1,0,0,1,0|2,0,0]=4 4279 B11R1.23 COC(=O)c1c[n]cc(S)[n]1 Amb24720136 [0,1,0,0,1,0|2,0,0]=4 4280 B11R1.23 COC(=O)c1cc(Br)[n]c[n]1 Amb22752399 [0,1,0,0,1,0|2,0,0]=4 4281 B11R1.23 COC(=O)c1cc(Br)ccn1 Amb10072124 [0,1,0,0,1,0|1,0,0]=3 4282 B11R1.23 COC(=O)c1cc(Cl)[n]c[n]1 Amb20241221 [0,1,0,0,1,0|2,0,0]=4 4283 B11R1.23 COC(=O)c1cc(Cl)cc[n]1 Amb22489514 [0,1,0,0,1,0|1,0,0]=3 4284 B11R1.23 COC(=O)c1cc(Cl)ccn1 Amb2425400 [0,1,0,0,1,0|1,0,0]=3 4285 B11R1.23 COC(=O)c1cc(F)cc[n]1 Amb21857845 [0,1,0,0,1,0|1,0,0]=3 4286 B11R1.23 COC(=O)c1cc(I)ccn1 Amb10072115 [0,1,0,0,1,0|1,0,0]=3 4287 B11R1.23 COC(=O)c1cc(N)[n]c[n]1 Amb21963300 [0,1,0,0,1,0|2,0,0]=4 4288 B11R1.23 COC(=O)c1cc(O)cc[n]1 Amb22754537 [0,1,0,0,1,0|1,0,0]=3 4289 B11R1.23 COC(=O)c1cc(O)ccn1 Amb10603787 [0,1,0,0,1,0|1,0,0]=3 4290 B11R1.23 COC(=O)c1cc(S)cc[n]1 Amb25691218 [0,1,0,0,1,0|1,0,0]=3 4291 B11R1.23 COC(=O)c1cc[n]c(Br)[n]1 Amb21964601 [0,1,0,0,1,0|2,0,0]=4 4292 B11R1.23 COC(=O)c1cc[n]c(F)[n]1 Amb25249346 [0,1,0,0,1,0|2,0,0]=4 4293 B11R1.23 COC(=O)c1cc[n]c(N)[n]1 Amb22275936 [0,1,0,0,1,0|2,0,0]=4 4294 B11R1.23 COC(=O)c1cc[n]c(N)c1 Amb20621557 [0,1,0,0,1,0|1,0,0]=3 4295 B11R1.23 COC(=O)c1cc[n]c(O)c1 Amb22741052 [0,1,0,0,1,0|1,0,0]=3 4296 B11R1.23 COC(=O)c1ccc[n+](c1)C Amb10573203 [0,1,0,0,1,0|1,0,0]=3 4297 B11R1.23 COC(=O)c1cccc(N)c1 Amb22001392 [0,1,0,0,1,0|0,0,0]=2 4298 B11R1.23 COC(=O)c1cccc(c1)S Amb17617595 [0,1,0,0,1,0|0,0,0]=2 4299 B11R1.23 COC(=O)c1cccc(n1)Cl Amb1197599 [0,1,0,0,1,0|1,0,0]=3 4300 B11R1.23 COC(=O)c1cccc(n1)F Amb16231928 [0,1,0,0,1,0|1,0,0]=3 4301 B11R1.23 COC(=O)c1ccnc(c1)F Amb16231929 [0,1,0,0,1,0|1,0,0]=3 4302 B11R1.23 COC(=O)c1cncc(O)c1 Amb17739876 [0,1,0,0,1,0|1,0,0]=3 4303 B11R1.23 COC(=O)c1cncc(c1)Br Amb2446343 [0,1,0,0,1,0|1,0,0]=3 4304 B11R1.23 COC(=O)c1cncc(c1)Cl Amb10603998 [0,1,0,0,1,0|1,0,0]=3 4305 B11R1.23 COC(=O)c1cncc(c1)F Amb10606907 [0,1,0,0,1,0|1,0,0]=3 4306 B11R1.23 COC(=O)c1cncc(c1)I Amb13887026 [0,1,0,0,1,0|1,0,0]=3 4307 B11R1.23 COC(=O)c1cncc(n1)Cl Amb10067228 [0,1,0,0,1,0|2,0,0]=4 4308 B11R1.23 COC(=O)c1cnnc(c1)Cl Amb10604004 [0,1,0,0,1,0|2,0,0]=4 4309 B11R1.23 COC(=O)c1ncc[n+](c1)C Amb10573253 [0,1,0,0,1,0|2,0,0]=4 4310 B11R1.23 COC(=O)c1nccc(n1)N Amb10067821 [0,1,0,0,1,0|2,0,0]=4 4311 B11R1.23 COC(C)c1cccc(Br)c1 Amb25242655 [0,1,0,0,1,0|1,0,1]=4 4312 B11R1.23 COC(c1cccc(c1)N)C Amb13952800 [0,1,0,0,1,0|1,0,1]=4 4313 B11R1.23 CSC(=N)c1cccc(Cl)c1 Amb22472392 [0,1,0,0,1,0|1,1,0]=4 4314 B11R1.23 C[n+]1cc(ccc1)C(=O)NC Amb19942299 [0,1,0,0,1,0|2,0,0]=4 4315 B11R1.23 C\C(=C/C)\c1cc(F)ccc1 Amb25837290 [0,1,0,0,1,0|2,0,0]=4 4316 B11R1.23 C\C(=C\C)\c1cc(Br)ccc1 Amb25674836 [0,1,0,0,1,0|2,0,0]=4 4317 B11R1.23 Cc1[n]c(cc[n]1)C(=O)OC Amb20171561 [0,1,0,0,1,0|2,0,0]=4 4318 B11R1.23 Cc1c[n]cc([n]1)C(=O)OC Amb22236001 [0,1,0,0,1,0|2,0,0]=4 4319 B11R1.23 Cc1c[n]cc(c1)C(=O)CC Amb25782565 [0,1,0,0,1,0|2,0,0]=4 4320 B11R1.23 Cc1cc([n][n]c1)C(=O)OC Amb24183592 [0,1,0,0,1,0|2,0,0]=4 4321 B11R1.23 Cc1cc([n]c[n]1)C(=O)OC Amb22233997 [0,1,0,0,1,0|2,0,0]=4 4322 B11R1.23 Cc1cc(c[n][n]1)C(=O)OC Amb24639931 [0,1,0,0,1,0|2,0,0]=4 4323 B11R1.23 Cc1cc(cc[n]1)C(=O)NC Amb25678971 [0,1,0,0,1,0|2,0,0]=4 4324 B11R1.23 Cc1cc(cc[n]1)C(=O)OC Amb19944358 [0,1,0,0,1,0|1,0,0]=3 4325 B11R1.23 Cc1cc(ccc1)C(=C)CC Amb25151911 [0,1,0,0,1,0|2,0,0]=4 4326 B11R1.23 Cc1cc(ccc1)C(=N)NC Amb24520876 [0,1,0,0,1,0|2,0,0]=4 4327 B11R1.23 Cc1cc(ccc1)C(=O)C#C Amb25086983 [0,1,0,0,1,0|1,0,1]=4 4328 B11R1.23 Cc1cc(ccc1)C(=O)C=O Amb18124885 [0,1,0,0,1,0|2,0,0]=4 4329 B11R1.23 Cc1cc(ccc1)C(=O)C=O Amb24055227 [0,1,0,0,1,0|2,0,0]=4 4330 B11R1.23 Cc1cc(ccc1)C(=O)CCl Amb18806064 [0,1,0,0,1,0|2,0,0]=4 4331 B11R1.23 Cc1cc(ccc1)C(=O)CF Amb24084129 [0,1,0,0,1,0|2,0,0]=4 4332 B11R1.23 Cc1cc(ccc1)C(=O)CN Amb20171473 [0,1,0,0,1,0|2,0,0]=4 4333 B11R1.23 Cc1cc(ccc1)C(=O)CO Amb18182731 [0,1,0,0,1,0|2,0,0]=4 4334 B11R1.23 Cc1cc(ccc1)C(=S)NC Amb24635576 [0,1,0,0,1,0|1,1,0]=4 4335 B11R1.23 Cc1cc[n]c([n]1)C(=O)OC Amb21857157 [0,1,0,0,1,0|2,0,0]=4 4336 B11R1.23 Cc1cc[n]c(c1)C(=O)CC Amb20247623 [0,1,0,0,1,0|2,0,0]=4 4337 B11R1.23 Cc1cc[n]c(c1)C(=O)OC Amb21963460 [0,1,0,0,1,0|1,0,0]=3 4338 B11R1.23 Cc1cccc([n]1)C(=O)CC Amb24182056 [0,1,0,0,1,0|2,0,0]=4 4339 B11R1.23 Cc1cccc(c1)C(O)OC Amb24661117 [0,1,0,0,1,0|0,0,2]=4 4340 B11R1.23 ClCC(=O)c1cccc(c1)Br Amb17345812 [0,1,0,0,1,0|2,0,0]=4 4341 B11R1.23 ClCC(=O)c1cccc(c1)F Amb10873159 [0,1,0,0,1,0|2,0,0]=4 4342 B11R1.23 N#CC(=O)c1cccc(Br)c1 Amb22269768 [0,1,0,0,1,0|2,0,0]=4 4343 B11R1.23 N#CC(=O)c1cccc(c1)C Amb17231995 [0,1,0,0,1,0|2,0,0]=4 4344 B11R1.23 N#CC(=O)c1cccc(c1)F Amb17232049 [0,1,0,0,1,0|2,0,0]=4 4345 B11R1.23 NCC(=O)c1cccc(Br)c1 Amb18281391 [0,1,0,0,1,0|2,0,0]=4 4346 B11R1.23 NCC(=O)c1cccc(Cl)c1 Amb18951219 [0,1,0,0,1,0|2,0,0]=4 4347 B11R1.23 NCC(=O)c1cccc(F)c1 Amb18951218 [0,1,0,0,1,0|2,0,0]=4 4348 B11R1.23 NCC(=O)c1cccc(c1)C Amb10976904 [0,1,0,0,1,0|2,0,0]=4 4349 B11R1.23 NCC(=O)c1cccc(c1)F Amb10840040 [0,1,0,0,1,0|2,0,0]=4 4350 B11R1.23 NCC(=O)c1cccc(c1)O Amb17593761 [0,1,0,0,1,0|2,0,0]=4 4351 B11R1.23 NNC(=O)c1cccc(S)c1 Amb24460345 [0,1,0,0,1,0|2,0,0]=4 4352 B11R1.23 NNC(=O)c1cccc(c1)Br Amb1906809 [0,1,0,0,1,0|2,0,0]=4 4353 B11R1.23 NNC(=O)c1cccc(c1)Cl Amb1207384 [0,1,0,0,1,0|2,0,0]=4 4354 B11R1.23 NNC(=O)c1cccc(c1)F Amb1129033 [0,1,0,0,1,0|2,0,0]=4 4355 B11R1.23 NNC(=O)c1cccc(c1)O Amb1208719 [0,1,0,0,1,0|2,0,0]=4 4356 B11R1.23 Nc1cc(ccc1)C(=O)CBr Amb24064137 [0,1,0,0,1,0|2,0,0]=4 4357 B11R1.23 Nc1cc(ccc1)C(=O)CO Amb24630822 [0,1,0,0,1,0|2,0,0]=4 4358 B11R1.23 Nc1cc(ccc1)C(=O)NO Amb24729125 [0,1,0,0,1,0|2,0,0]=4 4359 B11R1.23 O=C(C=O)c1cc(Br)ccc1 Amb20671217 [0,1,0,0,1,0|2,0,0]=4 4360 B11R1.23 O=C(C=O)c1cc(Cl)ccc1 Amb18126569 [0,1,0,0,1,0|2,0,0]=4 4361 B11R1.23 O=C(CCl)c1cccc(I)c1 Amb25826664 [0,1,0,0,1,0|2,0,0]=4 4362 B11R1.23 O=C(CF)c1cc(F)ccc1 Amb23454840 [0,1,0,0,1,0|2,0,0]=4 4363 B11R1.23 O=C(CF)c1cccc(Cl)c1 Amb25714827 [0,1,0,0,1,0|2,0,0]=4 4364 B11R1.23 O=C(O[Na])c1cc(I)cc[n]1 Amb21955171 [0,1,0,0,1,0|2,0,0]=4 4365 B11R1.23 O=CC(=O)c1cccc(c1)Br Amb10067951 [0,1,0,0,1,0|2,0,0]=4 4366 B11R1.23 O=CC(=O)c1cccc(c1)Cl Amb10067952 [0,1,0,0,1,0|2,0,0]=4 4367 B11R1.23 O=CC(=O)c1cccc(c1)F Amb10605526 [0,1,0,0,1,0|2,0,0]=4 4368 B11R1.23 O=CC(=O)c1cccc(c1)F Amb10982490 [0,1,0,0,1,0|2,0,0]=4 4369 B11R1.23 OCC(=O)c1cccc(Br)c1 Amb24579747 [0,1,0,0,1,0|2,0,0]=4 4370 B11R1.23 OCC(=O)c1cccc(Cl)c1 Amb18185666 [0,1,0,0,1,0|2,0,0]=4 4371 B11R1.23 OCC(=O)c1cccc(F)c1 Amb18182894 [0,1,0,0,1,0|2,0,0]=4 4372 B11R1.23 Oc1cc(ccc1)C(=O)C=O Amb18125054 [0,1,0,0,1,0|2,0,0]=4 4373 B11R1.23 Oc1cc(ccc1)C(=O)CCl Amb18126733 [0,1,0,0,1,0|2,0,0]=4 4374 B11R1.23 Oc1cc(ccc1)C(=O)CO Amb24334804 [0,1,0,0,1,0|2,0,0]=4 4375 B11R1.23 Oc1cc(ccc1)C(=O)OF Amb25334914 [0,1,0,0,1,0|1,0,0]=3 4376 B11R1.23 [Na]OC(=O)c1cccc(c1)I Amb10564565 [0,1,0,0,1,0|1,0,0]=3 4377 B11R1.23 [O-][n+]1cc(ncc1)C(=O)OC Amb10552567 [0,1,0,0,1,0|2,0,0]=4 4378 B11R1.222 BrCC(=O)c1ccccc1Br Amb1106771 [0,1,0,0,1,0|2,0,0]=4 4379 B11R1.222 BrCC(=O)c1ccccc1F Amb1106770 [0,1,0,0,1,0|2,0,0]=4 4380 B11R1.222 C#CC(=O)c1ccccc1N Amb24351123 [0,1,0,0,1,0|1,0,1]=4 4381 B11R1.222 C=CC(=O)c1ccccc1Cl Amb25307612 [0,1,0,0,1,0|1,0,1]=4 4382 B11R1.222 C=CC(=O)c1ccccc1O Amb17593686 [0,1,0,0,1,0|1,0,1]=4 4383 B11R1.222 CCC(=C)c1ccccc1N Amb24069947 [0,1,0,0,1,0|2,0,0]=4 4384 B11R1.222 CCC(=C)c1ccccc1O Amb25718309 [0,1,0,0,1,0|2,0,0]=4 4385 B11R1.222 CCC(=O)c1[n]cccc1Br Amb25133542 [0,1,0,0,1,0|2,0,0]=4 4386 B11R1.222 CCC(=O)c1[n]cccc1Cl Amb25687164 [0,1,0,0,1,0|2,0,0]=4 4387 B11R1.222 CCC(=O)c1[n]cccc1F Amb23412453 [0,1,0,0,1,0|2,0,0]=4 4388 B11R1.222 CCC(=O)c1[n]cccc1N Amb24433161 [0,1,0,0,1,0|2,0,0]=4 4389 B11R1.222 CCC(=O)c1c[n]ccc1N Amb25293482 [0,1,0,0,1,0|2,0,0]=4 4390 B11R1.222 CCC(=O)c1cc[n]cc1F Amb23455228 [0,1,0,0,1,0|2,0,0]=4 4391 B11R1.222 CCC(=O)c1cc[n]cc1N Amb23401919 [0,1,0,0,1,0|2,0,0]=4 4392 B11R1.222 CCC(=O)c1ccc[n]c1Br Amb24533130 [0,1,0,0,1,0|2,0,0]=4 4393 B11R1.222 CCC(=O)c1ccc[n]c1F Amb25723783 [0,1,0,0,1,0|2,0,0]=4 4394 B11R1.222 CCC(=O)c1ccccc1Br Amb17339933 [0,1,0,0,1,0|1,0,0]=3 4395 B11R1.222 CCC(=O)c1ccccc1C Amb16185657 [0,1,0,0,1,0|1,0,0]=3 4396 B11R1.222 CCC(=O)c1ccccc1Cl Amb17198735 [0,1,0,0,1,0|1,0,0]=3 4397 B11R1.222 CCC(=O)c1ccccc1N Amb1772753 [0,1,0,0,1,0|1,0,0]=3 4398 B11R1.222 CCC(=O)c1ccccc1O Amb1210123 [0,1,0,0,1,0|1,0,0]=3 4399 B11R1.222 CCC(=O)c1cccnc1Cl Amb10976561 [0,1,0,0,1,0|2,0,0]=4 4400 B11R1.222 CCS(=O)c1ccccc1Br Amb24502060 [0,1,0,0,1,0|2,0,0]=4 4401 B11R1.222 CCS(=O)c1ccccc1F Amb25312077 [0,1,0,0,1,0|2,0,0]=4 4402 B11R1.222 CCS(=O)c1ccccc1N Amb18955435 [0,1,0,0,1,0|2,0,0]=4 4403 B11R1.222 CN1CC=CC=C1C(=O)OC Amb24095929 [0,1,0,0,1,0|1,0,1]=4 4404 B11R1.222 CNC(=N)c1ccccc1Br Amb24458040 [0,1,0,0,1,0|2,0,0]=4 4405 B11R1.222 CNC(=N)c1ccccc1Cl Amb24509222 [0,1,0,0,1,0|2,0,0]=4 4406 B11R1.222 CNC(=N)c1ccccc1S Amb25805303 [0,1,0,0,1,0|2,0,0]=4 4407 B11R1.222 CNC(=O)c1[n]cccc1Br Amb24526721 [0,1,0,0,1,0|2,0,0]=4 4408 B11R1.222 CNC(=O)c1[n]cccc1N Amb18125265 [0,1,0,0,1,0|2,0,0]=4 4409 B11R1.222 CNC(=O)c1[n]cccc1O Amb22754647 [0,1,0,0,1,0|2,0,0]=4 4410 B11R1.222 CNC(=O)c1c[n]ccc1N Amb22263729 [0,1,0,0,1,0|2,0,0]=4 4411 B11R1.222 CNC(=O)c1cc[n]cc1F Amb25027872 [0,1,0,0,1,0|2,0,0]=4 4412 B11R1.222 CNC(=O)c1cc[n]cc1N Amb23556941 [0,1,0,0,1,0|2,0,0]=4 4413 B11R1.222 CNC(=O)c1cc[n]cc1O Amb25707778 [0,1,0,0,1,0|2,0,0]=4 4414 B11R1.222 CNC(=O)c1ccc[n]c1I Amb24421976 [0,1,0,0,1,0|2,0,0]=4 4415 B11R1.222 CNC(=O)c1ccc[n]c1O Amb18125363 [0,1,0,0,1,0|2,0,0]=4 4416 B11R1.222 CNC(=O)c1cccc[n+]1[O-] Amb24370487 [0,1,0,0,1,0|2,0,0]=4 4417 B11R1.222 CNC(=O)c1ccccc1F Amb1648925 [0,1,0,0,1,0|1,0,0]=3 4418 B11R1.222 CNC(=O)c1cccnc1N Amb16233797 [0,1,0,0,1,0|2,0,0]=4 4419 B11R1.222 CNC(=S)c1ccccc1Cl Amb22484599 [0,1,0,0,1,0|1,1,0]=4 4420 B11R1.222 CN\C(\F)=C/1\C=CC=CC1=O Amb24440975 [0,1,0,0,1,0|2,0,0]=4 4421 B11R1.222 CN\C(\N)=C/1\C=CC=CC1=O Amb24681966 [0,1,0,0,1,0|2,0,0]=4 4422 B11R1.222 COC(=C)c1ccccc1Br Amb20671367 [0,1,0,0,1,0|1,0,0]=3 4423 B11R1.222 COC(=N)C1=CC=CNC1=O Amb19650675 [0,1,0,0,1,0|2,0,0]=4 4424 B11R1.222 COC(=N)C1=CC=CNC1=O Amb21959612 [0,1,0,0,1,0|2,0,0]=4 4425 B11R1.222 COC(=N)c1[n]cccc1Br Amb25778892 [0,1,0,0,1,0|2,0,0]=4 4426 B11R1.222 COC(=N)c1[n]cccc1Cl Amb25149516 [0,1,0,0,1,0|2,0,0]=4 4427 B11R1.222 COC(=N)c1[n]cccc1F Amb24736447 [0,1,0,0,1,0|2,0,0]=4 4428 B11R1.222 COC(=N)c1cc[n]cc1Br Amb25259404 [0,1,0,0,1,0|2,0,0]=4 4429 B11R1.222 COC(=N)c1ccccc1Cl Amb18180241 [0,1,0,0,1,0|1,0,0]=3 4430 B11R1.222 COC(=N)c1ccccc1F Amb18065389 [0,1,0,0,1,0|1,0,0]=3 4431 B11R1.222 COC(=N)c1ccccc1O Amb25729105 [0,1,0,0,1,0|1,0,0]=3 4432 B11R1.222 COC(=O)C1=C(O)C=CCC1 Amb17593845 [0,1,0,0,1,0|0,0,2]=4 4433 B11R1.222 COC(=O)C1=CC=CNC1=O Amb19894701 [0,1,0,0,1,0|1,0,0]=3 4434 B11R1.222 COC(=O)C1=CC=COC1=O Amb19894704 [0,1,0,0,1,0|1,0,0]=3 4435 B11R1.222 COC(=O)C1=CC=NNC1=O Amb21857256 [0,1,0,0,1,0|2,0,0]=4 4436 B11R1.222 COC(=O)C1=CN=CNC1=O Amb19887177 [0,1,0,0,1,0|2,0,0]=4 4437 B11R1.222 COC(=O)C1=CSC=CC1=O Amb25142716 [0,1,0,0,1,0|1,0,0]=3 4438 B11R1.222 COC(=O)C=1NC=CNC1N Amb24483579 [0,1,0,0,1,0|2,0,0]=4 4439 B11R1.222 COC(=O)N1C=CC=CC1C Amb24060018 [0,1,0,0,1,0|1,0,1]=4 4440 B11R1.222 COC(=O)[C@H]1OC=CC=C1O Amb25074507 [0,1,0,0,1,0|1,0,1]=4 4441 B11R1.222 COC(=O)c1[n]c[n]cc1O Amb24648769 [0,1,0,0,1,0|2,0,0]=4 4442 B11R1.222 COC(=O)c1[n]cc[n]c1I Amb19958598 [0,1,0,0,1,0|2,0,0]=4 4443 B11R1.222 COC(=O)c1[n]cccc1Br Amb20247124 [0,1,0,0,1,0|1,0,0]=3 4444 B11R1.222 COC(=O)c1[n]cccc1Cl Amb19957514 [0,1,0,0,1,0|1,0,0]=3 4445 B11R1.222 COC(=O)c1c[n]c[n]c1Br Amb22496090 [0,1,0,0,1,0|2,0,0]=4 4446 B11R1.222 COC(=O)c1c[n]c[n]c1Cl Amb22262999 [0,1,0,0,1,0|2,0,0]=4 4447 B11R1.222 COC(=O)c1c[n]c[n]c1N Amb19957748 [0,1,0,0,1,0|2,0,0]=4 4448 B11R1.222 COC(=O)c1c[n]c[n]c1S Amb25300939 [0,1,0,0,1,0|2,0,0]=4 4449 B11R1.222 COC(=O)c1c[n]ccc1Cl Amb19957887 [0,1,0,0,1,0|1,0,0]=3 4450 B11R1.222 COC(=O)c1c[n]ccc1S Amb25242589 [0,1,0,0,1,0|1,0,0]=3 4451 B11R1.222 COC(=O)c1cc[n][n]c1N Amb22523474 [0,1,0,0,1,0|2,0,0]=4 4452 B11R1.222 COC(=O)c1cc[n]cc1F Amb22411142 [0,1,0,0,1,0|1,0,0]=3 4453 B11R1.222 COC(=O)c1ccc[nH]c1=O Amb2445310 [0,1,0,0,1,0|1,0,0]=3 4454 B11R1.222 COC(=O)c1ccc[n]c1S Amb22282222 [0,1,0,0,1,0|1,0,0]=3 4455 B11R1.222 COC(=O)c1cccc[n+]1[O-] Amb10573355 [0,1,0,0,1,0|1,0,0]=3 4456 B11R1.222 COC(=O)c1ccccc1N Amb1229837 [0,1,0,0,1,0|0,0,0]=2 4457 B11R1.222 COC(=O)c1ccccc1N Amb22741062 [0,1,0,0,1,0|0,0,0]=2 4458 B11R1.222 COC(=O)c1ccccc1O Amb1200750 [0,1,0,0,1,0|0,0,0]=2 4459 B11R1.222 COC(=O)c1ccccc1[NH3+] Amb22445985 [0,1,0,0,1,0|0,0,0]=2 4460 B11R1.222 COC(=O)c1cccnc1Cl Amb1241121 [0,1,0,0,1,0|1,0,0]=3 4461 B11R1.222 COC(=O)c1cccnc1I Amb10070314 [0,1,0,0,1,0|1,0,0]=3 4462 B11R1.222 COC(=O)c1cccnc1N Amb1049688 [0,1,0,0,1,0|1,0,0]=3 4463 B11R1.222 COC(=O)c1cccnc1O Amb10601402 [0,1,0,0,1,0|1,0,0]=3 4464 B11R1.222 COC(=O)c1ccncc1Br Amb10606114 [0,1,0,0,1,0|1,0,0]=3 4465 B11R1.222 COC(=O)c1ccncc1I Amb10602323 [0,1,0,0,1,0|1,0,0]=3 4466 B11R1.222 COC(=O)c1ccncc1N Amb2440807 [0,1,0,0,1,0|1,0,0]=3 4467 B11R1.222 COC(=O)c1cnccc1Br Amb10603765 [0,1,0,0,1,0|1,0,0]=3 4468 B11R1.222 COC(=O)c1cnccc1Cl Amb10603776 [0,1,0,0,1,0|1,0,0]=3 4469 B11R1.222 COC(=O)c1ncccc1Br Amb10975828 [0,1,0,0,1,0|1,0,0]=3 4470 B11R1.222 COC(=O)c1ncccc1C Amb16233270 [0,1,0,0,1,0|1,0,0]=3 4471 B11R1.222 COC(=O)c1ncccc1F Amb10602313 [0,1,0,0,1,0|1,0,0]=3 4472 B11R1.222 COC(=O)c1ncccc1O Amb2417381 [0,1,0,0,1,0|1,0,0]=3 4473 B11R1.222 COC(=O)c1nccnc1N Amb1157799 [0,1,0,0,1,0|2,0,0]=4 4474 B11R1.222 COC(=O)c1ncncc1Br Amb10603996 [0,1,0,0,1,0|2,0,0]=4 4475 B11R1.222 COC(=S)c1ccccc1O Amb22232674 [0,1,0,0,1,0|0,1,0]=3 4476 B11R1.222 COC(C)c1ccccc1N Amb24468018 [0,1,0,0,1,0|1,0,1]=4 4477 B11R1.222 COC(C)c1ccccc1O Amb18125398 [0,1,0,0,1,0|1,0,1]=4 4478 B11R1.222 CSC(=O)c1ccccc1O Amb25094287 [0,1,0,0,1,0|0,1,0]=3 4479 B11R1.222 C\C(=C/C)\c1ccccc1N Amb18124838 [0,1,0,0,1,0|2,0,0]=4 4480 B11R1.222 C\C(=C/C)\c1ccccc1O Amb18124922 [0,1,0,0,1,0|2,0,0]=4 4481 B11R1.222 C\C(=C\C)\c1ccccc1O Amb25707041 [0,1,0,0,1,0|2,0,0]=4 4482 B11R1.222 C\N=C(/Cl)\c1ccccc1O Amb25066402 [0,1,0,0,1,0|2,0,0]=4 4483 B11R1.222 C\N=C(/F)\c1ccccc1O Amb24570847 [0,1,0,0,1,0|2,0,0]=4 4484 B11R1.222 C\N=C(\Cl)/c1ccccc1O Amb24629208 [0,1,0,0,1,0|2,0,0]=4 4485 B11R1.222 Cc1[n]c[n]cc1C(=O)OC Amb23401793 [0,1,0,0,1,0|2,0,0]=4 4486 B11R1.222 Cc1[n]cc[n]c1C(=O)OC Amb21962549 [0,1,0,0,1,0|2,0,0]=4 4487 B11R1.222 Cc1[n]cccc1C(=O)NC Amb24062374 [0,1,0,0,1,0|2,0,0]=4 4488 B11R1.222 Cc1c[n][n]cc1C(=O)OC Amb22406186 [0,1,0,0,1,0|2,0,0]=4 4489 B11R1.222 Cc1c[n]ccc1C(=N)OC Amb25150164 [0,1,0,0,1,0|2,0,0]=4 4490 B11R1.222 Cc1c[n]ccc1C(=O)NC Amb24463193 [0,1,0,0,1,0|2,0,0]=4 4491 B11R1.222 Cc1cc[n]cc1C(=O)CC Amb25346959 [0,1,0,0,1,0|2,0,0]=4 4492 B11R1.222 Cc1cc[n]cc1C(=O)NC Amb24062378 [0,1,0,0,1,0|2,0,0]=4 4493 B11R1.222 Cc1cc[n]cc1C(=O)OC Amb21857718 [0,1,0,0,1,0|1,0,0]=3 4494 B11R1.222 Cc1ccc[n]c1C(=O)NC Amb24413396 [0,1,0,0,1,0|2,0,0]=4 4495 B11R1.222 Cc1ccc[n]c1C(=O)OC Amb22886637 [0,1,0,0,1,0|1,0,0]=3 4496 B11R1.222 Cc1ccc[n]c1C(=O)SC Amb25334811 [0,1,0,0,1,0|1,1,0]=4 4497 B11R1.222 Cc1ccccc1C(=O)C=O Amb18124884 [0,1,0,0,1,0|2,0,0]=4 4498 B11R1.222 Cc1ccccc1C(=O)CCl Amb18185586 [0,1,0,0,1,0|2,0,0]=4 4499 B11R1.222 Cc1ccccc1C(=O)CF Amb25807621 [0,1,0,0,1,0|2,0,0]=4 4500 B11R1.222 Cc1ccccc1C(=O)CN Amb18281552 [0,1,0,0,1,0|2,0,0]=4 4501 B11R1.222 Cc1ccccc1C(=O)CO Amb18182730 [0,1,0,0,1,0|2,0,0]=4 4502 B11R1.222 Cc1ccccc1C(=S)NC Amb25775044 [0,1,0,0,1,0|1,1,0]=4 4503 B11R1.222 Cc1ccccc1S(=O)OC Amb25241886 [0,1,0,0,1,0|1,0,0]=3 4504 B11R1.222 Cc1ccncc1C(=O)OC Amb16230838 [0,1,0,0,1,0|1,0,0]=3 4505 B11R1.222 ClCC(=O)c1ccccc1Br Amb10602047 [0,1,0,0,1,0|2,0,0]=4 4506 B11R1.222 ClCC(=O)c1ccccc1N Amb10068396 [0,1,0,0,1,0|2,0,0]=4 4507 B11R1.222 ClCC(=O)c1ccccc1N Amb10603305 [0,1,0,0,1,0|2,0,0]=4 4508 B11R1.222 ClCC(=O)c1ccccc1O Amb2209413 [0,1,0,0,1,0|2,0,0]=4 4509 B11R1.222 N#CC(=O)c1ccccc1Br Amb22269824 [0,1,0,0,1,0|2,0,0]=4 4510 B11R1.222 N#CC(=O)c1ccccc1C Amb16231820 [0,1,0,0,1,0|2,0,0]=4 4511 B11R1.222 N#CC(=O)c1ccccc1F Amb17232048 [0,1,0,0,1,0|2,0,0]=4 4512 B11R1.222 N#CC(=O)c1ccccc1I Amb22367991 [0,1,0,0,1,0|2,0,0]=4 4513 B11R1.222 NCC(=O)c1ccccc1Br Amb10069326 [0,1,0,0,1,0|2,0,0]=4 4514 B11R1.222 NCC(=O)c1ccccc1Cl Amb10069325 [0,1,0,0,1,0|2,0,0]=4 4515 B11R1.222 NCC(=O)c1ccccc1F Amb10840039 [0,1,0,0,1,0|2,0,0]=4 4516 B11R1.222 NCC(=O)c1ccccc1I Amb25172792 [0,1,0,0,1,0|2,0,0]=4 4517 B11R1.222 NCC(=O)c1ccccc1O Amb18125235 [0,1,0,0,1,0|2,0,0]=4 4518 B11R1.222 NNC(=O)c1ccccc1F Amb1104489 [0,1,0,0,1,0|2,0,0]=4 4519 B11R1.222 NNC(=O)c1ccccc1N Amb1775193 [0,1,0,0,1,0|2,0,0]=4 4520 B11R1.222 NNC(=O)c1ccccc1O Amb1796080 [0,1,0,0,1,0|2,0,0]=4 4521 B11R1.222 NOC(=O)c1ccccc1O Amb25803293 [0,1,0,0,1,0|1,0,0]=3 4522 B11R1.222 Nc1ccccc1C(=O)CBr Amb24063936 [0,1,0,0,1,0|2,0,0]=4 4523 B11R1.222 Nc1ccccc1C(=O)CN Amb18125141 [0,1,0,0,1,0|2,0,0]=4 4524 B11R1.222 Nc1ccccc1C(=O)ON Amb25322080 [0,1,0,0,1,0|1,0,0]=3 4525 B11R1.222 O=C(C=O)c1ccccc1Br Amb18131520 [0,1,0,0,1,0|2,0,0]=4 4526 B11R1.222 O=C(C=O)c1ccccc1Cl Amb18126568 [0,1,0,0,1,0|2,0,0]=4 4527 B11R1.222 O=C(C=O)c1ccccc1F Amb22011841 [0,1,0,0,1,0|2,0,0]=4 4528 B11R1.222 O=C(CBr)c1ccccc1I Amb22737619 [0,1,0,0,1,0|2,0,0]=4 4529 B11R1.222 O=C(CCl)c1ccccc1Cl Amb18330058 [0,1,0,0,1,0|2,0,0]=4 4530 B11R1.222 O=C(CCl)c1ccccc1F Amb18807753 [0,1,0,0,1,0|2,0,0]=4 4531 B11R1.222 O=C(CCl)c1ccccc1I Amb25147916 [0,1,0,0,1,0|2,0,0]=4 4532 B11R1.222 O=C(CF)c1ccccc1Br Amb22489704 [0,1,0,0,1,0|2,0,0]=4 4533 B11R1.222 O=C(CF)c1ccccc1Cl Amb23454835 [0,1,0,0,1,0|2,0,0]=4 4534 B11R1.222 O=C(CF)c1ccccc1F Amb23454839 [0,1,0,0,1,0|2,0,0]=4 4535 B11R1.222 O=C(CS)c1ccccc1Cl Amb25801973 [0,1,0,0,1,0|2,0,0]=4 4536 B11R1.222 O=CC(=O)c1ccccc1F Amb10838623 [0,1,0,0,1,0|2,0,0]=4 4537 B11R1.222 OCC(=O)c1ccccc1Br Amb24639690 [0,1,0,0,1,0|2,0,0]=4 4538 B11R1.222 OCC(=O)c1ccccc1Cl Amb18185665 [0,1,0,0,1,0|2,0,0]=4 4539 B11R1.222 OCC(=O)c1ccccc1F Amb18182895 [0,1,0,0,1,0|2,0,0]=4 4540 B11R1.222 ONC(=O)c1ccccc1O Amb2504335 [0,1,0,0,1,0|2,0,0]=4 4541 B11R1.222 ONC(=O)c1ccccc1S Amb25855420 [0,1,0,0,1,0|2,0,0]=4 4542 B11R1.222 Oc1ccccc1C(=O)C=O Amb25269559 [0,1,0,0,1,0|2,0,0]=4 4543 B11R1.222 Oc1ccccc1C(=O)CF Amb24084122 [0,1,0,0,1,0|2,0,0]=4 4544 B11R1.222 Oc1ccccc1C(=O)CO Amb18125347 [0,1,0,0,1,0|2,0,0]=4 4545 B11R1.222 Oc1ccccc1C(=O)NBr Amb25807582 [0,1,0,0,1,0|2,0,0]=4 4546 B11R1.222 Oc1ccccc1C(=O)O[Ag] Amb22053970 [0,1,0,0,1,0|1,0,0]=3 4547 B11R1.222 [Na]OC(=O)c1ncccc1Br Amb10071517 [0,1,0,0,1,0|2,0,0]=4 4548 B11R1.30 CCCC(=O)Cc1cc[s]c1 Amb18180161 [0,1,0,0,1,0|2,0,0]=4 4549 B11R1.30 CCCC(=O)Cc1ccc[s]1 Amb18180163 [0,1,0,0,1,0|2,0,0]=4 4550 B11R1.30 CCCC(=O)Cc1ccco1 Amb10608081 [0,1,0,0,1,0|2,0,0]=4 4551 B11R1.30 CCNC(=O)Cc1ccc[nH]1 Amb24397803 [0,1,0,0,1,0|2,0,0]=4 4552 B11R1.30 CCOC(=N)Cc1ccc[s]1 Amb18185611 [0,1,0,0,1,0|2,0,0]=4 4553 B11R1.30 CCOC(=O)Cc1[nH]cc[n]1 Amb22494300 [0,1,0,0,1,0|2,0,0]=4 4554 B11R1.30 CCOC(=O)Cc1c[nH][n]c1 Amb22754375 [0,1,0,0,1,0|2,0,0]=4 4555 B11R1.30 CCOC(=O)Cc1c[nH]cc1 Amb24764558 [0,1,0,0,1,0|1,0,0]=3 4556 B11R1.30 CCOC(=O)Cc1c[n]c[s]1 Amb23440873 [0,1,0,0,1,0|2,0,0]=4 4557 B11R1.30 CCOC(=O)Cc1cc[nH][n]1 Amb24099076 [0,1,0,0,1,0|2,0,0]=4 4558 B11R1.30 CCOC(=O)Cc1cc[n][s]1 Amb24765748 [0,1,0,0,1,0|2,0,0]=4 4559 B11R1.30 CCOC(=O)Cc1cc[n]o1 Amb25382988 [0,1,0,0,1,0|2,0,0]=4 4560 B11R1.30 CCOC(=O)Cc1ccc[nH]1 Amb17938824 [0,1,0,0,1,0|1,0,0]=3 4561 B11R1.30 CCOC(=O)Cc1cco[n]1 Amb23537585 [0,1,0,0,1,0|2,0,0]=4 4562 B11R1.30 CCOC(=O)Cn1cccc1 Amb2236263 [0,1,0,0,1,0|1,0,0]=3 4563 B11R1.30 CCOC(=O)Nc1cc[s]c1 Amb24683773 [0,1,0,0,1,0|2,0,0]=4 4564 B11R1.30 CCOC(=O)Nc1ccc[nH]1 Amb19651842 [0,1,0,0,1,0|2,0,0]=4 4565 B11R1.30 CCOC(=O)Nc1ccco1 Amb24744539 [0,1,0,0,1,0|2,0,0]=4 4566 B11R1.30 CCOC(=O)Nc1cccs1 Amb17935663 [0,1,0,0,1,0|2,0,0]=4 4567 B11R1.30 CCOC(=O)Oc1ccco1 Amb25383238 [0,1,0,0,1,0|2,0,0]=4 4568 B11R1.30 COCC(=O)Cc1c[n]c[s]1 Amb25379881 [0,1,0,0,1,0|2,0,0]=4 4569 B11R1.30 COCC(=O)Cc1cc[s]c1 Amb18183589 [0,1,0,0,1,0|1,0,0]=3 4570 B11R1.30 COCC(=O)Cc1ccc[s]1 Amb18801755 [0,1,0,0,1,0|1,0,0]=3 4571 B11R1.30 COCC(=O)N[n]1cccc1 Amb25751137 [0,1,0,0,1,0|2,0,0]=4 4572 B11R1.30 CONC(=O)C[n]1ccc[n]1 Amb25108848 [0,1,0,0,1,0|2,0,0]=4 4573 B11R1.30 CONC(=O)Cc1cc[nH][n]1 Amb24660356 [0,1,0,0,1,0|2,0,0]=4 4574 B11R1.30 CONC(=O)Cc1ccco1 Amb25806373 [0,1,0,0,1,0|1,0,0]=3 4575 B11R1.30 CONC(=O)Cc1cccs1 Amb16980463 [0,1,0,0,1,0|1,0,0]=3 4576 B11R1.30 CONC(=O)Cc1cco[n]1 Amb24449986 [0,1,0,0,1,0|2,0,0]=4 4577 B11R1.30 CONC(=O)Cc1cocc1 Amb24705444 [0,1,0,0,1,0|1,0,0]=3 4578 B11R1.30 CONC(=O)Nc1ccco1 Amb24705234 [0,1,0,0,1,0|2,0,0]=4 4579 B11R1.30 CSCC(=O)Cc1c[s]cc1 Amb18327166 [0,1,0,0,1,0|1,1,0]=4 4580 B11R1.30 CSCC(=O)Cc1ccc[s]1 Amb19070221 [0,1,0,0,1,0|1,1,0]=4 4581 B11R1.30 CSCC(=O)Cc1ccco1 Amb25383644 [0,1,0,0,1,0|1,1,0]=4 4582 B11R1.30 CSCC(=O)Cc1ccoc1 Amb25383643 [0,1,0,0,1,0|1,1,0]=4 4583 B11R1.30 C\C(\Cc1c[s]cc1)=N\OC Amb25343459 [0,1,0,0,1,0|2,0,0]=4 4584 B11R1.30 C\C(\Cc1ccc[s]1)=N\OC Amb24430750 [0,1,0,0,1,0|2,0,0]=4 4585 B11R1.30 C\C=C\C(=O)Cc1cc[s]c1 Amb25149513 [0,1,0,0,1,0|2,0,0]=4 4586 B11R1.30 O=C(Cc1ccc[s]1)CCCl Amb25384844 [0,1,0,0,1,0|2,0,0]=4 4587 B11R1.31 CC(C(=O)CC)c1cc[s]c1 Amb24486261 [0,1,0,0,1,0|2,0,0]=4 4588 B11R1.31 CCC(=O)C(C)c1ccco1 Amb25151443 [0,1,0,0,1,0|2,0,0]=4 4589 B11R1.31 CCC(=O)C(O)c1ccco1 Amb25807611 [0,1,0,0,1,0|2,0,0]=4 4590 B11R1.31 CCC(=O)C(c1cccs1)Cl Amb17477806 [0,1,0,0,1,0|2,0,0]=4 4591 B11R1.31 CNC(=O)C(C)[n]1cccc1 Amb18179435 [0,1,0,0,1,0|2,0,0]=4 4592 B11R1.31 CNC(=O)C(C)c1ccco1 Amb25847739 [0,1,0,0,1,0|2,0,0]=4 4593 B11R1.31 CNC(=O)C(Cl)c1cc[s]c1 Amb18330158 [0,1,0,0,1,0|2,0,0]=4 4594 B11R1.31 CNC(=O)C(Cl)c1ccc[s]1 Amb18330159 [0,1,0,0,1,0|2,0,0]=4 4595 B11R1.31 CNC(=O)C(N)c1ccc[s]1 Amb25767417 [0,1,0,0,1,0|2,0,0]=4 4596 B11R1.31 CNC(=O)C(N)c1ccco1 Amb24449779 [0,1,0,0,1,0|2,0,0]=4 4597 B11R1.31 CNC(=O)C(N)c1ccco1 Amb24498004 [0,1,0,0,1,0|2,0,0]=4 4598 B11R1.31 COC(=O)C(=O)c1c[s]cc1 Amb25718891 [0,1,0,0,1,0|1,0,1]=4 4599 B11R1.31 COC(=O)C(=O)c1ccc[nH]1 Amb17593821 [0,1,0,0,1,0|1,0,1]=4 4600 B11R1.31 COC(=O)C(=O)c1ccco1 Amb10766373 [0,1,0,0,1,0|1,0,1]=4 4601 B11R1.31 COC(=O)C(=O)c1cccs1 Amb17334793 [0,1,0,0,1,0|1,0,1]=4 4602 B11R1.31 COC(=O)C(Br)c1cc[nH]c1 Amb18866803 [0,1,0,0,1,0|1,0,0]=3 4603 B11R1.31 COC(=O)C(Br)c1cc[s]c1 Amb25148089 [0,1,0,0,1,0|1,0,0]=3 4604 B11R1.31 COC(=O)C(Br)c1ccc[s]1 Amb18870435 [0,1,0,0,1,0|1,0,0]=3 4605 B11R1.31 COC(=O)C(C)[n]1c[n]cc1 Amb18181850 [0,1,0,0,1,0|2,0,0]=4 4606 B11R1.31 COC(=O)C(C)[n]1ccc[n]1 Amb18177312 [0,1,0,0,1,0|2,0,0]=4 4607 B11R1.31 COC(=O)C(C)c1c[n]c[s]1 Amb23580673 [0,1,0,0,1,0|2,0,0]=4 4608 B11R1.31 COC(=O)C(C)c1cc[n][s]1 Amb24555740 [0,1,0,0,1,0|2,0,0]=4 4609 B11R1.31 COC(=O)C(C)c1cc[s]c1 Amb25046569 [0,1,0,0,1,0|1,0,0]=3 4610 B11R1.31 COC(=O)C(C)c1ccc[s]1 Amb18801854 [0,1,0,0,1,0|1,0,0]=3 4611 B11R1.31 COC(=O)C(C)c1ccco1 Amb25145746 [0,1,0,0,1,0|1,0,0]=3 4612 B11R1.31 COC(=O)C(C)c1cco[n]1 Amb25145880 [0,1,0,0,1,0|2,0,0]=4 4613 B11R1.31 COC(=O)C(Cl)c1c[s]c[n]1 Amb24488383 [0,1,0,0,1,0|2,0,0]=4 4614 B11R1.31 COC(=O)C(Cl)c1cc[nH]c1 Amb18862899 [0,1,0,0,1,0|1,0,0]=3 4615 B11R1.31 COC(=O)C(Cl)c1cc[s]c1 Amb18330180 [0,1,0,0,1,0|1,0,0]=3 4616 B11R1.31 COC(=O)C(Cl)c1ccc[nH]1 Amb25776941 [0,1,0,0,1,0|1,0,0]=3 4617 B11R1.31 COC(=O)C(Cl)c1ccc[s]1 Amb19078422 [0,1,0,0,1,0|1,0,0]=3 4618 B11R1.31 COC(=O)C(N)c1[n]cc[s]1 Amb25764754 [0,1,0,0,1,0|2,0,0]=4 4619 B11R1.31 COC(=O)C(N)c1c[nH]c[n]1 Amb25789371 [0,1,0,0,1,0|2,0,0]=4 4620 B11R1.31 COC(=O)C(N)c1c[n]co1 Amb25804256 [0,1,0,0,1,0|2,0,0]=4 4621 B11R1.31 COC(=O)C(N)c1cc[nH]c1 Amb24664116 [0,1,0,0,1,0|1,0,0]=3 4622 B11R1.31 COC(=O)C(N)c1cc[n][s]1 Amb24738542 [0,1,0,0,1,0|2,0,0]=4 4623 B11R1.31 COC(=O)C(N)c1cc[s][n]1 Amb24390750 [0,1,0,0,1,0|2,0,0]=4 4624 B11R1.31 COC(=O)C(N)c1ccc[s]1 Amb18976394 [0,1,0,0,1,0|1,0,0]=3 4625 B11R1.31 COC(=O)C(N)c1cocc1 Amb25169464 [0,1,0,0,1,0|1,0,0]=3 4626 B11R1.31 COC(=O)C(O)c1c[n]c[s]1 Amb25094789 [0,1,0,0,1,0|2,0,0]=4 4627 B11R1.31 COC(=O)C(O)c1c[n]co1 Amb25851964 [0,1,0,0,1,0|2,0,0]=4 4628 B11R1.31 COC(=O)C(O)c1c[s]c[n]1 Amb25273646 [0,1,0,0,1,0|2,0,0]=4 4629 B11R1.31 COC(=O)C(O)c1cc[n][s]1 Amb24569272 [0,1,0,0,1,0|2,0,0]=4 4630 B11R1.31 COC(=O)C(O)c1cc[s]c1 Amb18185713 [0,1,0,0,1,0|1,0,0]=3 4631 B11R1.31 COC(=O)C(O)c1ccc[s]1 Amb18185714 [0,1,0,0,1,0|1,0,0]=3 4632 B11R1.31 COC(=O)C(O)c1ccco1 Amb24309217 [0,1,0,0,1,0|1,0,0]=3 4633 B11R1.31 COC(=O)C(c1ccco1)N Amb10067126 [0,1,0,0,1,0|1,0,0]=3 4634 B11R1.31 COC(=O)N(C)c1ccoc1 Amb24340408 [0,1,0,0,1,0|2,0,0]=4 4635 B11R1.31 COC(=O)[C@@H](C)[n]1ccc[n]1 Amb24334671 [0,1,0,0,1,0|2,0,0]=4 4636 B11R1.31 COC(=O)[C@@H](C)[n]1cccc1 Amb25087812 [0,1,0,0,1,0|1,0,0]=3 4637 B11R1.31 COC(=O)[C@@H](N)c1c[n]c[nH]1 Amb22480939 [0,1,0,0,1,0|2,0,0]=4 4638 B11R1.31 COC(=O)[C@@H](N)c1c[n]co1 Amb24399440 [0,1,0,0,1,0|2,0,0]=4 4639 B11R1.31 COC(=O)[C@@H](N)c1ccc[s]1 Amb24373228 [0,1,0,0,1,0|1,0,0]=3 4640 B11R1.31 COC(=O)[C@@H](N)c1ccco1 Amb22799668 [0,1,0,0,1,0|1,0,0]=3 4641 B11R1.31 COC(=O)[C@@H](N)c1cocc1 Amb24452673 [0,1,0,0,1,0|1,0,0]=3 4642 B11R1.31 COC(=O)[C@H](C)[n]1c[n]cc1 Amb24598148 [0,1,0,0,1,0|2,0,0]=4 4643 B11R1.31 COC(=O)[C@H](N)c1cc[s]c1 Amb24488037 [0,1,0,0,1,0|1,0,0]=3 4644 B11R1.31 COC(=O)[C@H](O)c1c[n]co1 Amb24675574 [0,1,0,0,1,0|2,0,0]=4 4645 B11R1.31 COC(=O)[C@H](O)c1ccco1 Amb25808575 [0,1,0,0,1,0|1,0,0]=3 4646 B11R1.35 CC(=C)C(=O)Cc1ccc[s]1 Amb25801387 [0,1,0,0,1,0|2,0,0]=4 4647 B11R1.35 CC(=C)C(=O)Cc1ccco1 Amb24486373 [0,1,0,0,1,0|2,0,0]=4 4648 B11R1.35 CC(=C)C(=O)Cc1ccoc1 Amb24529007 [0,1,0,0,1,0|2,0,0]=4 4649 B11R1.35 CC(=O)C(=O)Cc1ccc[s]1 Amb24456858 [0,1,0,0,1,0|2,0,0]=4 4650 B11R1.35 CC(=O)C(=O)Cc1ccco1 Amb25177671 [0,1,0,0,1,0|2,0,0]=4 4651 B11R1.35 CC(C)C(=O)Cc1cc[s]c1 Amb18180160 [0,1,0,0,1,0|2,0,0]=4 4652 B11R1.35 CC(C)C(=O)Cc1ccc[s]1 Amb18180162 [0,1,0,0,1,0|2,0,0]=4 4653 B11R1.35 CC(C)C(=O)Cc1ccoc1 Amb25704505 [0,1,0,0,1,0|2,0,0]=4 4654 B11R1.35 CC(N)C(=O)Cc1cc[s]c1 Amb25367085 [0,1,0,0,1,0|2,0,0]=4 4655 B11R1.35 CC(N)C(=O)Cc1ccc[s]1 Amb18825907 [0,1,0,0,1,0|2,0,0]=4 4656 B11R1.35 CC(O)C(=O)Cc1ccc[s]1 Amb25343077 [0,1,0,0,1,0|2,0,0]=4 4657 B11R1.35 CN(C)C(=O)Cc1ccco1 Amb25205570 [0,1,0,0,1,0|2,0,0]=4 4658 B11R1.39 CCC(=O)Cc1cc(Br)c[s]1 Amb25090716 [0,1,0,0,1,0|2,0,0]=4 4659 B11R1.39 CCC(=O)Cc1cc(Br)oc1 Amb24646022 [0,1,0,0,1,0|2,0,0]=4 4660 B11R1.39 CCC(=O)Cc1ccc(Br)o1 Amb25093587 [0,1,0,0,1,0|2,0,0]=4 4661 B11R1.39 CCC(=O)Cc1ccc(Cl)[s]1 Amb19072170 [0,1,0,0,1,0|2,0,0]=4 4662 B11R1.39 CNC(=O)Cc1cc[n](C)c1 Amb25310938 [0,1,0,0,1,0|2,0,0]=4 4663 B11R1.39 CNC(=O)Cc1ccc(Cl)[s]1 Amb24485156 [0,1,0,0,1,0|2,0,0]=4 4664 B11R1.39 COC(=O)CC1=CC(=O)CO1 Amb25760173 [0,1,0,0,1,0|1,0,1]=4 4665 B11R1.39 COC(=O)CC1=CNC(=S)S1 Amb24695755 [0,1,0,0,1,0|2,0,0]=4 4666 B11R1.39 COC(=O)CC1C=CC(=O)O1 Amb24066588 [0,1,0,0,1,0|1,0,1]=4 4667 B11R1.39 COC(=O)CC=1CCC(=O)C1 Amb24724026 [0,1,0,0,1,0|0,0,2]=4 4668 B11R1.39 COC(=O)C[C@H]1CC(=O)C=C1 Amb24416710 [0,1,0,0,1,0|0,0,2]=4 4669 B11R1.39 COC(=O)C[n]1cc(Cl)c[n]1 Amb18180464 [0,1,0,0,1,0|2,0,0]=4 4670 B11R1.39 COC(=O)C[n]1cc(F)c[n]1 Amb23400567 [0,1,0,0,1,0|2,0,0]=4 4671 B11R1.39 COC(=O)C[n]1cc(O)c[n]1 Amb25785430 [0,1,0,0,1,0|2,0,0]=4 4672 B11R1.39 COC(=O)C[n]1ccc(Br)[n]1 Amb23541362 [0,1,0,0,1,0|2,0,0]=4 4673 B11R1.39 COC(=O)C[n]1ccc(Cl)[n]1 Amb25712647 [0,1,0,0,1,0|2,0,0]=4 4674 B11R1.39 COC(=O)C[n]1ccc(N)[n]1 Amb18987259 [0,1,0,0,1,0|2,0,0]=4 4675 B11R1.39 COC(=O)Cc1[nH]c(N)c[n]1 Amb18200489 [0,1,0,0,1,0|2,0,0]=4 4676 B11R1.39 COC(=O)Cc1[n]c(Br)c[s]1 Amb24632525 [0,1,0,0,1,0|2,0,0]=4 4677 B11R1.39 COC(=O)Cc1[n]cc(I)[s]1 Amb25855306 [0,1,0,0,1,0|2,0,0]=4 4678 B11R1.39 COC(=O)Cc1c[nH]c(N)[n]1 Amb22751364 [0,1,0,0,1,0|2,0,0]=4 4679 B11R1.39 COC(=O)Cc1c[n]c(Br)[s]1 Amb22495211 [0,1,0,0,1,0|2,0,0]=4 4680 B11R1.39 COC(=O)Cc1c[n]c(Cl)[s]1 Amb22495408 [0,1,0,0,1,0|2,0,0]=4 4681 B11R1.39 COC(=O)Cc1c[n]c(F)[s]1 Amb24566557 [0,1,0,0,1,0|2,0,0]=4 4682 B11R1.39 COC(=O)Cc1c[n]c(N)[s]1 Amb22406048 [0,1,0,0,1,0|2,0,0]=4 4683 B11R1.39 COC(=O)Cc1c[n]c(N)o1 Amb22295790 [0,1,0,0,1,0|2,0,0]=4 4684 B11R1.39 COC(=O)Cc1cc(Br)c[s]1 Amb25148335 [0,1,0,0,1,0|1,0,0]=3 4685 B11R1.39 COC(=O)Cc1cc(Cl)[n]o1 Amb24098351 [0,1,0,0,1,0|2,0,0]=4 4686 B11R1.39 COC(=O)Cc1cc(Cl)o[n]1 Amb24098365 [0,1,0,0,1,0|2,0,0]=4 4687 B11R1.39 COC(=O)Cc1cc(F)c[s]1 Amb25311737 [0,1,0,0,1,0|1,0,0]=3 4688 B11R1.39 COC(=O)Cc1cc[n](C)[n]1 Amb24405591 [0,1,0,0,1,0|2,0,0]=4 4689 B11R1.39 COC(=O)Cc1ccc(N)[s]1 Amb19001992 [0,1,0,0,1,0|1,0,0]=3 4690 B11R1.39 COC(=O)Cc1ccc(s1)Br Amb17408789 [0,1,0,0,1,0|1,0,0]=3 4691 B11R1.39 COC(=O)Cc1ccc(s1)Cl Amb2234803 [0,1,0,0,1,0|1,0,0]=3 4692 B11R1.39 COC(=O)Cc1cnc(s1)N Amb1094010 [0,1,0,0,1,0|2,0,0]=4 4693 B11R1.39 COC(=O)Cc1csc(n1)Br Amb17472538 [0,1,0,0,1,0|2,0,0]=4 4694 B11R1.39 COC(=O)Cc1csc(n1)N Amb1145427 [0,1,0,0,1,0|2,0,0]=4 4695 B11R1.39 COC(=O)Cc1csc(n1)N Amb2370478 [0,1,0,0,1,0|2,0,0]=4 4696 B11R1.39 COC(=O)Cc1n[nH]c(c1)C Amb16192262 [0,1,0,0,1,0|2,0,0]=4 4697 B11R1.39 COC(=O)Cn1cc(cn1)Br Amb10071157 [0,1,0,0,1,0|2,0,0]=4 4698 B11R1.39 COC(=O)Cn1cc(cn1)I Amb15701644 [0,1,0,0,1,0|2,0,0]=4 4699 B11R1.39 COC(=O)Cn1cc(cn1)N Amb10609573 [0,1,0,0,1,0|2,0,0]=4 4700 B11R1.39 COC(=O)Cn1ncc(c1)N Amb10609588 [0,1,0,0,1,0|2,0,0]=4 4701 B11R1.39 COC(=O)Nc1c[s]c(Cl)c1 Amb24421476 [0,1,0,0,1,0|2,0,0]=4 4702 B11R1.39 C[n]1cc(CC(=O)OC)c[n]1 Amb21964116 [0,1,0,0,1,0|2,0,0]=4 4703 B11R1.39 Cc1[n]c(CC(=O)OC)co1 Amb25317250 [0,1,0,0,1,0|2,0,0]=4 4704 B11R1.39 Cc1[n]cc(CC(=O)OC)[s]1 Amb22372037 [0,1,0,0,1,0|2,0,0]=4 4705 B11R1.39 Cc1[n]cc(CC(=O)OC)o1 Amb25208452 [0,1,0,0,1,0|2,0,0]=4 4706 B11R1.39 Cc1c[n](CC(=O)OC)c[n]1 Amb21963896 [0,1,0,0,1,0|2,0,0]=4 4707 B11R1.39 Cc1c[n][n](CC(=O)OC)c1 Amb18179503 [0,1,0,0,1,0|2,0,0]=4 4708 B11R1.39 Cc1c[n]c(CC(=O)OC)[s]1 Amb18183647 [0,1,0,0,1,0|2,0,0]=4 4709 B11R1.39 Cc1cc(CC(=O)NC)[s]c1 Amb24375253 [0,1,0,0,1,0|2,0,0]=4 4710 B11R1.39 Cc1cc(CC(=O)OC)[n]o1 Amb22886628 [0,1,0,0,1,0|2,0,0]=4 4711 B11R1.39 Cc1cc(CC(=O)OC)[s]c1 Amb24726151 [0,1,0,0,1,0|1,0,0]=3 4712 B11R1.39 Cc1cc(CC(=O)OC)o[n]1 Amb24182059 [0,1,0,0,1,0|2,0,0]=4 4713 B11R1.39 Cc1ccc(CC(=O)NC)[s]1 Amb25680443 [0,1,0,0,1,0|2,0,0]=4 4714 B11R1.39 Cc1ccc(CC(=O)NC)o1 Amb24485155 [0,1,0,0,1,0|2,0,0]=4 4715 B11R1.39 Cc1ccc(CC(=O)OC)[nH]1 Amb25041573 [0,1,0,0,1,0|1,0,0]=3 4716 B11R1.39 [K]OC(=O)Cc1ccc(s1)Br Amb2235519 [0,1,0,0,1,0|2,0,0]=4 4717 B11R1.84 C\C=C(\Cc1ccco1)/C=O Amb25365895 [0,1,0,0,1,0|2,0,0]=4 4718 B11R1.228 CCC(=O)Cc1[s]ccc1Br Amb25090717 [0,1,0,0,1,0|2,0,0]=4 4719 B11R1.228 CCC(=O)Cc1[s]ccc1Cl Amb25081695 [0,1,0,0,1,0|2,0,0]=4 4720 B11R1.228 CCC(=O)Cc1sccc1C Amb17477715 [0,1,0,0,1,0|2,0,0]=4 4721 B11R1.228 COC(=O)CC1=CCCC1=O Amb24408467 [0,1,0,0,1,0|0,0,2]=4 4722 B11R1.228 COC(=O)C[NH+]1C=CS=C1N Amb23453340 [0,1,0,0,1,0|2,0,0]=4 4723 B11R1.228 COC(=O)C[NH+]1C=CS=C1N Amb24121512 [0,1,0,0,1,0|2,0,0]=4 4724 B11R1.228 COC(=O)Cc1[n]c[s]c1F Amb25351629 [0,1,0,0,1,0|2,0,0]=4 4725 B11R1.228 COC(=O)Cc1[s]ccc1F Amb24540982 [0,1,0,0,1,0|1,0,0]=3 4726 B11R1.228 COC(=O)Cc1c[s]cc1F Amb25224902 [0,1,0,0,1,0|1,0,0]=3 4727 B11R1.228 COC(=O)Cc1cc[s]c1Cl Amb24696753 [0,1,0,0,1,0|1,0,0]=3 4728 B11R1.228 COC(=O)Cc1cc[s]c1F Amb24696412 [0,1,0,0,1,0|1,0,0]=3 4729 B11R1.228 COC(=O)Cc1o[n]cc1Br Amb25253745 [0,1,0,0,1,0|2,0,0]=4 4730 B11R1.228 COC(=O)\C=C\1/C=CCC1=O Amb24597990 [0,1,0,0,1,0|0,0,2]=4 4731 B11R1.228 C[n]1cc[n]c1CC(=O)OC Amb23440779 [0,1,0,0,1,0|2,0,0]=4 4732 B11R1.228 Cc1[n]coc1CC(=O)OC Amb24664693 [0,1,0,0,1,0|2,0,0]=4 4733 B11R1.228 Cc1[s]ccc1CC(=O)OC Amb25151424 [0,1,0,0,1,0|1,0,0]=3 4734 B11R1.228 Cc1cc[n][n]1CC(=O)OC Amb24533048 [0,1,0,0,1,0|2,0,0]=4 4735 B11R1.228 Cc1cc[s]c1CC(=O)OC Amb25100213 [0,1,0,0,1,0|1,0,0]=3 4736 B11R1.228 Cc1ccoc1NC(=O)OC Amb19373176 [0,1,0,0,1,0|2,0,0]=4 4737 B11R1.228 Cc1occc1NC(=O)OC Amb25350235 [0,1,0,0,1,0|2,0,0]=4 4738 B13R1.11 C=CC(=O)N[C@@H](c1ccccc1)C Amb16192564 [0,1,0,0,0,1|1,0,1]=4 4739 B13R1.11 CC(CC(=O)C#N)c1ccccc1 Amb24494969 [0,1,0,0,0,1|2,0,0]=4 4740 B13R1.11 CC(CC(=O)NO)c1ccccc1 Amb24387362 [0,1,0,0,0,1|2,0,0]=4 4741 B13R1.11 CC(NC(=O)CF)c1ccccc1 Amb25041090 [0,1,0,0,0,1|2,0,0]=4 4742 B13R1.11 CC(NC(=O)CI)c1ccccc1 Amb22340599 [0,1,0,0,0,1|2,0,0]=4 4743 B13R1.11 CC(NC(=O)NO)c1ccccc1 Amb25121196 [0,1,0,0,0,1|2,0,0]=4 4744 B13R1.11 CCC(=O)CC(c1ccccc1)C Amb17594493 [0,1,0,0,0,1|1,0,0]=3 4745 B13R1.11 CCC(=O)NC(=N)c1ccccc1 Amb25855572 [0,1,0,0,0,1|1,0,1]=4 4746 B13R1.11 CCC(=O)NC(C)c1cc[n]cc1 Amb25849891 [0,1,0,0,0,1|2,0,0]=4 4747 B13R1.11 CCC(=O)NN(c1ccccc1)C Amb1869422 [0,1,0,0,0,1|2,0,0]=4 4748 B13R1.11 CCC(=O)N[C@@H](C)c1cc[n]cc1 Amb24434298 [0,1,0,0,0,1|2,0,0]=4 4749 B13R1.11 CCC(=O)N[C@@H](C)c1ccc[n]c1 Amb25232496 [0,1,0,0,0,1|2,0,0]=4 4750 B13R1.11 CCC(=O)N[C@@H](C)c1cccc[n]1 Amb25752057 [0,1,0,0,0,1|2,0,0]=4 4751 B13R1.11 CCC(=O)N[C@@H](C)c1ccccc1 Amb23091317 [0,1,0,0,0,1|1,0,0]=3 4752 B13R1.11 CCC(=O)N[C@H](C)c1ccc[n]c1 Amb24489299 [0,1,0,0,0,1|2,0,0]=4 4753 B13R1.11 CCC(=O)N[C@H](C)c1cccc[n]1 Amb25120344 [0,1,0,0,0,1|2,0,0]=4 4754 B13R1.11 CCC(=O)OC(=O)c1ccccc1 Amb22500123 [0,1,0,0,0,1|1,0,1]=4 4755 B13R1.11 CN(CC(=O)NC)c1cc[n]cc1 Amb25252497 [0,1,0,0,0,1|2,0,0]=4 4756 B13R1.11 CN(CC(=O)NC)c1cccc[n]1 Amb24422204 [0,1,0,0,0,1|2,0,0]=4 4757 B13R1.11 CN(CC(=O)NC)c1ccccc1 Amb19971421 [0,1,0,0,0,1|1,0,0]=3 4758 B13R1.11 CN(CC(=O)OC)c1cccc[n]1 Amb18186549 [0,1,0,0,0,1|1,0,0]=3 4759 B13R1.11 CNC(=N)CC(=O)c1ccccc1 Amb25275499 [0,1,0,0,0,1|2,0,0]=4 4760 B13R1.11 CNC(=N)NC(C)c1ccccc1 Amb18184205 [0,1,0,0,0,1|2,0,0]=4 4761 B13R1.11 CNC(=N)NC(C)c1ccccc1 Amb20631264 [0,1,0,0,0,1|2,0,0]=4 4762 B13R1.11 CNC(=N)N[C@@H](C)c1ccccc1 Amb25152972 [0,1,0,0,0,1|2,0,0]=4 4763 B13R1.11 CNC(=O)CC(=O)c1ccccc1 Amb24361603 [0,1,0,0,0,1|1,0,0]=3 4764 B13R1.11 CNC(=O)CC(=S)c1ccccc1 Amb25125271 [0,1,0,0,0,1|1,0,0]=3 4765 B13R1.11 CNC(=O)CC(C)c1cc[n]cc1 Amb25686680 [0,1,0,0,0,1|2,0,0]=4 4766 B13R1.11 CNC(=O)CC(C)c1ccc[n]c1 Amb24397679 [0,1,0,0,0,1|2,0,0]=4 4767 B13R1.11 CNC(=O)CC(c1cccnc1)N Amb17233543 [0,1,0,0,0,1|2,0,0]=4 4768 B13R1.11 CNC(=O)CS(=O)c1cccc[n]1 Amb24749569 [0,1,0,0,0,1|2,0,0]=4 4769 B13R1.11 CNC(=O)CS(=O)c1ccccc1 Amb25807172 [0,1,0,0,0,1|1,0,0]=3 4770 B13R1.11 CNC(=O)C[C@@H](O)c1ccccc1 Amb24490336 [0,1,0,0,0,1|1,0,0]=3 4771 B13R1.11 CNC(=O)C[C@H](C)c1ccccc1 Amb25041089 [0,1,0,0,0,1|1,0,0]=3 4772 B13R1.11 CNC(=O)C[C@H](N)c1ccccc1 Amb24637726 [0,1,0,0,0,1|1,0,0]=3 4773 B13R1.11 CNC(=O)C[C@H](O)c1ccccc1 Amb24444391 [0,1,0,0,0,1|1,0,0]=3 4774 B13R1.11 CNC(=O)NC(=N)c1ccccc1 Amb24441539 [0,1,0,0,0,1|1,0,1]=4 4775 B13R1.11 CNC(=O)NC(C)c1cc[n]cc1 Amb25153495 [0,1,0,0,0,1|2,0,0]=4 4776 B13R1.11 CNC(=O)NC(C)c1ccc[n]c1 Amb25190371 [0,1,0,0,0,1|2,0,0]=4 4777 B13R1.11 CNC(=O)NC(C)c1cccc[n]1 Amb25128617 [0,1,0,0,0,1|2,0,0]=4 4778 B13R1.11 CNC(=O)NC(C)c1ccccc1 Amb25324528 [0,1,0,0,0,1|1,0,0]=3 4779 B13R1.11 CNC(=O)NN(C)c1ccccc1 Amb25137162 [0,1,0,0,0,1|2,0,0]=4 4780 B13R1.11 CNC(=O)N[C@@H](C)c1ccc[n]c1 Amb25730920 [0,1,0,0,0,1|2,0,0]=4 4781 B13R1.11 CNC(=O)N[C@H](C)c1ccccc1 Amb25040008 [0,1,0,0,0,1|1,0,0]=3 4782 B13R1.11 CNC(=S)N[C@@H](C)c1ccccc1 Amb24414685 [0,1,0,0,0,1|1,1,0]=4 4783 B13R1.11 COC(=N)CC(=O)c1ccccc1 Amb22433441 [0,1,0,0,0,1|1,0,0]=3 4784 B13R1.11 COC(=N)NC(=O)c1ccccc1 Amb25309498 [0,1,0,0,0,1|1,0,1]=4 4785 B13R1.11 COC(=O)CC(=O)N1CC=CC=C1 Amb22015167 [0,1,0,0,0,1|1,0,1]=4 4786 B13R1.11 COC(=O)CC(=O)c1c[n]c[n]c1 Amb22736773 [0,1,0,0,0,1|2,0,0]=4 4787 B13R1.11 COC(=O)CC(=O)c1cccc[n]1 Amb21857821 [0,1,0,0,0,1|1,0,0]=3 4788 B13R1.11 COC(=O)CC(=O)c1ccccc1 Amb10553935 [0,1,0,0,0,1|0,0,0]=2 4789 B13R1.11 COC(=O)CC(=O)c1cnccn1 Amb13893664 [0,1,0,0,0,1|2,0,0]=4 4790 B13R1.11 COC(=O)CC(C)c1ccccc1 Amb17843427 [0,1,0,0,0,1|0,0,0]=2 4791 B13R1.11 COC(=O)CC(O)c1c[n]cc[n]1 Amb22296209 [0,1,0,0,0,1|2,0,0]=4 4792 B13R1.11 COC(=O)CC(O)c1ccccc1 Amb22731500 [0,1,0,0,0,1|0,0,0]=2 4793 B13R1.11 COC(=O)CC(c1ccccc1)N Amb1221582 [0,1,0,0,0,1|0,0,0]=2 4794 B13R1.11 COC(=O)CC(c1ccccc1)N Amb2371447 [0,1,0,0,0,1|0,0,0]=2 4795 B13R1.11 COC(=O)CN(C)c1c[n]c[n]c1 Amb18932316 [0,1,0,0,0,1|2,0,0]=4 4796 B13R1.11 COC(=O)C[C@@H](C)c1ccccc1 Amb22363030 [0,1,0,0,0,1|0,0,0]=2 4797 B13R1.11 COC(=O)C[C@@H](N)c1ccc[n]c1 Amb24107581 [0,1,0,0,0,1|1,0,0]=3 4798 B13R1.11 COC(=O)C[C@@H](N)c1ccccc1 Amb18796125 [0,1,0,0,0,1|0,0,0]=2 4799 B13R1.11 COC(=O)C[C@@H](N)c1ccccc1 Amb19373681 [0,1,0,0,0,1|0,0,0]=2 4800 B13R1.11 COC(=O)C[C@@H](c1ccccc1)N Amb17617178 [0,1,0,0,0,1|0,0,0]=2 4801 B13R1.11 COC(=O)C[C@H](N)c1ccccc1 Amb22268691 [0,1,0,0,0,1|0,0,0]=2 4802 B13R1.11 COC(=O)NC(=N)c1ccccc1 Amb25254191 [0,1,0,0,0,1|0,0,1]=3 4803 B13R1.11 COC(=O)NC(=O)c1ccccc1 Amb25190157 [0,1,0,0,0,1|0,0,1]=3 4804 B13R1.11 COC(=O)NC(=S)c1cccc[n]1 Amb24095858 [0,1,0,0,0,1|1,0,1]=4 4805 B13R1.11 COC(=O)NC(C)c1ccc[n]c1 Amb25155951 [0,1,0,0,0,1|1,0,0]=3 4806 B13R1.11 COC(=O)NC(c1ccccc1)C Amb10568146 [0,1,0,0,0,1|0,0,0]=2 4807 B13R1.11 COC(=O)N[C@@H](C)c1cccc[n]1 Amb25788838 [0,1,0,0,0,1|1,0,0]=3 4808 B13R1.11 COC(=O)N[C@@H](C)c1ccccc1 Amb24611219 [0,1,0,0,0,1|0,0,0]=2 4809 B13R1.11 COC(=O)N[C@H](C)c1ccc[n]c1 Amb25821184 [0,1,0,0,0,1|1,0,0]=3 4810 B13R1.11 COC(=O)N[C@H](C)c1cccc[n]1 Amb24466639 [0,1,0,0,0,1|1,0,0]=3 4811 B13R1.11 COC(=O)N[C@H](C)c1ccccc1 Amb24666677 [0,1,0,0,0,1|0,0,0]=2 4812 B13R1.11 COC(=O)\C=C(/N)\c1ccc[n]c1 Amb24622421 [0,1,0,0,0,1|1,0,1]=4 4813 B13R1.11 COC(=O)\C=C(\N)/c1ccccc1 Amb25258009 [0,1,0,0,0,1|0,0,1]=3 4814 B13R1.11 COC(=S)NC(=O)c1ccccc1 Amb10553666 [0,1,0,0,0,1|0,1,1]=4 4815 B13R1.11 CSC(=O)NC(=O)c1ccccc1 Amb25743426 [0,1,0,0,0,1|0,1,1]=4 4816 B13R1.11 CSC(=O)NC(C)c1ccccc1 Amb25292316 [0,1,0,0,0,1|0,1,0]=3 4817 B13R1.11 C[C@@H](CC(=O)NN)c1ccccc1 Amb22357025 [0,1,0,0,0,1|2,0,0]=4 4818 B13R1.11 C[C@@H](NC(=O)CO)c1ccccc1 Amb25324160 [0,1,0,0,0,1|2,0,0]=4 4819 B13R1.11 C[C@H](NC(=O)C=C)c1ccccc1 Amb25858461 [0,1,0,0,0,1|1,0,1]=4 4820 B13R1.11 C[C@H](NC(=O)CBr)c1ccccc1 Amb25291312 [0,1,0,0,0,1|2,0,0]=4 4821 B13R1.11 C[C@H](NC(=O)CS)c1ccccc1 Amb25698363 [0,1,0,0,0,1|2,0,0]=4 4822 B13R1.11 C[C@H](NC(=O)NN)c1ccccc1 Amb22356343 [0,1,0,0,0,1|2,0,0]=4 4823 B13R1.11 C\C(=C/C(=O)OC)\c1cccc[n]1 Amb24555692 [0,1,0,0,0,1|1,0,1]=4 4824 B13R1.11 C\C(=C\C(=O)CC)\c1ccccc1 Amb24553546 [0,1,0,0,0,1|1,0,1]=4 4825 B13R1.11 C\C(=C\C(=O)NC)\c1ccccc1 Amb24369890 [0,1,0,0,0,1|1,0,1]=4 4826 B13R1.11 C\C(=C\C(=O)OC)\c1c[n]ccc1 Amb25191857 [0,1,0,0,0,1|1,0,1]=4 4827 B13R1.11 C\C(=C\C(=O)c1ccccc1)\OC Amb25034479 [0,1,0,0,0,1|1,0,1]=4 4828 B13R1.11 C\C(\CC(=O)c1ccccc1)=C/C Amb25768382 [0,1,0,0,0,1|2,0,0]=4 4829 B13R1.11 C\C(\CC(O)c1ccccc1)=C\C Amb24576542 [0,1,0,0,0,1|2,0,0]=4 4830 B13R1.11 C\C=C(/F)\CN(C)c1ccccc1 Amb22546801 [0,1,0,0,0,1|2,0,0]=4 4831 B13R1.11 ClCC(=O)NC(c1ccccc1)C Amb1643934 [0,1,0,0,0,1|2,0,0]=4 4832 B13R1.11 ClCC(=O)N[C@@H](c1ccccc1)C Amb10844688 [0,1,0,0,0,1|2,0,0]=4 4833 B13R1.11 ClCC(=O)N[C@H](c1ccccc1)C Amb10844690 [0,1,0,0,0,1|2,0,0]=4 4834 B13R1.11 NC(CC(=O)NO)c1ccccc1 Amb25118570 [0,1,0,0,0,1|2,0,0]=4 4835 B13R1.11 NCC(=O)NC(c1ccccc1)C Amb10767123 [0,1,0,0,0,1|2,0,0]=4 4836 B13R1.11 NNC(=O)CC(=O)c1ccccc1 Amb24416728 [0,1,0,0,0,1|2,0,0]=4 4837 B13R1.11 NNC(=O)CC(O)c1ccccc1 Amb24720262 [0,1,0,0,0,1|2,0,0]=4 4838 B13R1.11 NNC(=O)C[C@@H](O)c1ccccc1 Amb24533813 [0,1,0,0,0,1|2,0,0]=4 4839 B13R1.11 N[C@H](CC(=O)NO)c1ccccc1 Amb24586364 [0,1,0,0,0,1|2,0,0]=4 4840 B13R1.11 OCC(=O)NC(c1ccccc1)C Amb1110697 [0,1,0,0,0,1|2,0,0]=4 4841 B13R1.11 ONC(=O)CC(=O)c1ccccc1 Amb24492649 [0,1,0,0,0,1|2,0,0]=4 4842 B13R1.14 BrCC(=O)NCc1ccc(cc1)C Amb17324795 [0,1,0,0,0,1|2,0,0]=4 4843 B13R1.14 BrCC(=O)NCc1ccc(cc1)Cl Amb10605895 [0,1,0,0,0,1|2,0,0]=4 4844 B13R1.14 BrCC(=O)NCc1ccc(cc1)F Amb17325061 [0,1,0,0,0,1|2,0,0]=4 4845 B13R1.14 C#CC(=O)COc1ccc(Cl)cc1 Amb25089133 [0,1,0,0,0,1|1,0,1]=4 4846 B13R1.14 C#CC(=O)NCc1ccc(Br)cc1 Amb25765469 [0,1,0,0,0,1|1,0,1]=4 4847 B13R1.14 C#CC(=O)NCc1ccc(F)cc1 Amb25279860 [0,1,0,0,0,1|1,0,1]=4 4848 B13R1.14 C#CC(=O)NCc1ccc(N)cc1 Amb25078114 [0,1,0,0,0,1|1,0,1]=4 4849 B13R1.14 C=CC(=O)NCc1ccc(O)cc1 Amb24730970 [0,1,0,0,0,1|1,0,1]=4 4850 B13R1.14 C=CC(=O)OCc1ccc(cc1)C Amb16185122 [0,1,0,0,0,1|1,0,1]=4 4851 B13R1.14 CCC(=C)CNc1ccc(Cl)cc1 Amb25191992 [0,1,0,0,0,1|2,0,0]=4 4852 B13R1.14 CCC(=N)NCc1ccc(Br)cc1 Amb25728598 [0,1,0,0,0,1|2,0,0]=4 4853 B13R1.14 CCC(=N)NCc1ccc(Cl)cc1 Amb25187981 [0,1,0,0,0,1|2,0,0]=4 4854 B13R1.14 CCC(=N)NCc1ccc(F)cc1 Amb25372400 [0,1,0,0,0,1|2,0,0]=4 4855 B13R1.14 CCC(=O)CCc1ccc(O)cc1 Amb22547635 [0,1,0,0,0,1|1,0,0]=3 4856 B13R1.14 CCC(=O)COc1ccc(N)cc1 Amb22010451 [0,1,0,0,0,1|1,0,0]=3 4857 B13R1.14 CCC(=O)CSc1ccc(Cl)cc1 Amb19415865 [0,1,0,0,0,1|1,0,0]=3 4858 B13R1.14 CCC(=O)NCc1c[n]c(Cl)cc1 Amb21988454 [0,1,0,0,0,1|2,0,0]=4 4859 B13R1.14 CCC(=O)NCc1ccc(F)c[n]1 Amb24362378 [0,1,0,0,0,1|2,0,0]=4 4860 B13R1.14 CCC(=O)NCc1ccc(F)cc1 Amb17790296 [0,1,0,0,0,1|1,0,0]=3 4861 B13R1.14 CCC(=O)NCc1ccc(O)cc1 Amb18648248 [0,1,0,0,0,1|1,0,0]=3 4862 B13R1.14 CCC(=O)NCc1ccc(cc1)N Amb17138876 [0,1,0,0,0,1|1,0,0]=3 4863 B13R1.14 CCC(=O)NNc1ccc(Cl)cc1 Amb25221246 [0,1,0,0,0,1|2,0,0]=4 4864 B13R1.14 CCC(=O)\C=C\c1ccc(F)cc1 Amb24676917 [0,1,0,0,0,1|1,0,1]=4 4865 B13R1.14 CCC(=O)\C=C\c1ccc(N)cc1 Amb25809374 [0,1,0,0,0,1|1,0,1]=4 4866 B13R1.14 CCC(=O)\C=C\c1ccc(O)cc1 Amb24375201 [0,1,0,0,0,1|1,0,1]=4 4867 B13R1.14 CCC(=O)\N=C\c1ccc(O)cc1 Amb24072991 [0,1,0,0,0,1|1,0,1]=4 4868 B13R1.14 CCC(=S)NCc1ccc(Cl)cc1 Amb24658378 [0,1,0,0,0,1|1,1,0]=4 4869 B13R1.14 CNC(=N)CSc1ccc(F)cc1 Amb25090690 [0,1,0,0,0,1|2,0,0]=4 4870 B13R1.14 CNC(=N)NCc1ccc(Br)cc1 Amb24409986 [0,1,0,0,0,1|2,0,0]=4 4871 B13R1.14 CNC(=N)NCc1ccc(Cl)cc1 Amb19066807 [0,1,0,0,0,1|2,0,0]=4 4872 B13R1.14 CNC(=N)NCc1ccc(F)cc1 Amb18185011 [0,1,0,0,0,1|2,0,0]=4 4873 B13R1.14 CNC(=O)C#Cc1ccc(F)cc1 Amb25211304 [0,1,0,0,0,1|1,0,1]=4 4874 B13R1.14 CNC(=O)CCc1ccc(Br)cc1 Amb22900135 [0,1,0,0,0,1|1,0,0]=3 4875 B13R1.14 CNC(=O)CCc1ccc(Cl)cc1 Amb23223308 [0,1,0,0,0,1|1,0,0]=3 4876 B13R1.14 CNC(=O)CCc1ccc(cc1)C Amb15744093 [0,1,0,0,0,1|1,0,0]=3 4877 B13R1.14 CNC(=O)CNc1ccc(F)c[n]1 Amb18291205 [0,1,0,0,0,1|2,0,0]=4 4878 B13R1.14 CNC(=O)COc1ccc(Br)[n]c1 Amb25157609 [0,1,0,0,0,1|2,0,0]=4 4879 B13R1.14 CNC(=O)COc1ccc(Cl)[n]c1 Amb24359965 [0,1,0,0,0,1|2,0,0]=4 4880 B13R1.14 CNC(=O)COc1ccc(cc1)C Amb2040393 [0,1,0,0,0,1|1,0,0]=3 4881 B13R1.14 CNC(=O)COc1ccc(cc1)I Amb15778875 [0,1,0,0,0,1|1,0,0]=3 4882 B13R1.14 CNC(=O)CSc1ccc(O)cc1 Amb18321658 [0,1,0,0,0,1|1,0,0]=3 4883 B13R1.14 CNC(=O)CSc1ccc(cn1)Br Amb14000883 [0,1,0,0,0,1|2,0,0]=4 4884 B13R1.14 CNC(=O)NCc1c[n]c(N)cc1 Amb24470285 [0,1,0,0,0,1|2,0,0]=4 4885 B13R1.14 CNC(=O)NCc1ccc(Cl)c[n]1 Amb25058220 [0,1,0,0,0,1|2,0,0]=4 4886 B13R1.14 CNC(=O)NCc1ccc(F)c[n]1 Amb25769115 [0,1,0,0,0,1|2,0,0]=4 4887 B13R1.14 CNC(=O)NCc1ccc(O)cc1 Amb24491496 [0,1,0,0,0,1|1,0,0]=3 4888 B13R1.14 CNC(=O)NCc1ccc(cc1)Cl Amb2132765 [0,1,0,0,0,1|1,0,0]=3 4889 B13R1.14 CNC(=O)NCc1ccc(cc1)F Amb2132767 [0,1,0,0,0,1|1,0,0]=3 4890 B13R1.14 CNC(=O)NN=C1C=CC(=O)C=C1 Amb25081074 [0,1,0,0,0,1|2,0,0]=4 4891 B13R1.14 CNC(=O)NNc1ccc(F)cc1 Amb24677337 [0,1,0,0,0,1|2,0,0]=4 4892 B13R1.14 CNC(=O)OCc1ccc(Cl)cc1 Amb22469905 [0,1,0,0,0,1|1,0,0]=3 4893 B13R1.14 CNC(=O)OCc1ccc(F)cc1 Amb24653697 [0,1,0,0,0,1|1,0,0]=3 4894 B13R1.14 CNC(=O)OCc1ccc(N)cc1 Amb25273466 [0,1,0,0,0,1|1,0,0]=3 4895 B13R1.14 CNC(=O)SCc1ccc(Cl)cc1 Amb24490438 [0,1,0,0,0,1|1,0,0]=3 4896 B13R1.14 CNC(=O)\C=C\c1ccc(N)cc1 Amb19844255 [0,1,0,0,0,1|1,0,1]=4 4897 B13R1.14 CNC(=O)\C=C\c1ccc(cc1)Br Amb11217636 [0,1,0,0,0,1|1,0,1]=4 4898 B13R1.14 CNC(=S)NCc1ccc(Br)cc1 Amb24386709 [0,1,0,0,0,1|1,1,0]=4 4899 B13R1.14 CNC(=S)NCc1ccc(O)cc1 Amb24424530 [0,1,0,0,0,1|1,1,0]=4 4900 B13R1.14 CNC(=S)NCc1ccc(cc1)Cl Amb1838160 [0,1,0,0,0,1|1,1,0]=4 4901 B13R1.14 COC(=N)CCc1ccc(Br)cc1 Amb18071193 [0,1,0,0,0,1|1,0,0]=3 4902 B13R1.14 COC(=N)CCc1ccc(Cl)cc1 Amb18066448 [0,1,0,0,0,1|1,0,0]=3 4903 B13R1.14 COC(=N)CCc1ccc(F)cc1 Amb18066004 [0,1,0,0,0,1|1,0,0]=3 4904 B13R1.14 COC(=N)COc1ccc(Br)cc1 Amb18071477 [0,1,0,0,0,1|1,0,0]=3 4905 B13R1.14 COC(=N)COc1ccc(Cl)cc1 Amb18066509 [0,1,0,0,0,1|1,0,0]=3 4906 B13R1.14 COC(=N)COc1ccc(F)cc1 Amb18066094 [0,1,0,0,0,1|1,0,0]=3 4907 B13R1.14 COC(=O)/C=C/c1ccc(C)cc1 Amb17844465 [0,1,0,0,0,1|0,0,1]=3 4908 B13R1.14 COC(=O)C#CC1=CNC(=O)C=C1 Amb25302573 [0,1,0,0,0,1|1,0,1]=4 4909 B13R1.14 COC(=O)C#Cc1ccc(F)cc1 Amb25726510 [0,1,0,0,0,1|0,0,1]=3 4910 B13R1.14 COC(=O)C#Cc1ccc(N)cc1 Amb25257395 [0,1,0,0,0,1|0,0,1]=3 4911 B13R1.14 COC(=O)C#Cc1ccc(O)cc1 Amb25262685 [0,1,0,0,0,1|0,0,1]=3 4912 B13R1.14 COC(=O)C#Cc1ccc(nc1)C Amb10809260 [0,1,0,0,0,1|1,0,1]=4 4913 B13R1.14 COC(=O)C=Cc1ccc(N)cc1 Amb24079687 [0,1,0,0,0,1|0,0,1]=3 4914 B13R1.14 COC(=O)C=Cc1ccc(cc1)Br Amb13883656 [0,1,0,0,0,1|0,0,1]=3 4915 B13R1.14 COC(=O)CCc1ccc(N)[n]c1 Amb24183802 [0,1,0,0,0,1|1,0,0]=3 4916 B13R1.14 COC(=O)CCc1ccc(cc1)Br Amb15692693 [0,1,0,0,0,1|0,0,0]=2 4917 B13R1.14 COC(=O)CCc1ccc(cc1)C Amb17400662 [0,1,0,0,0,1|0,0,0]=2 4918 B13R1.14 COC(=O)CCc1ccc(cc1)Cl Amb1093990 [0,1,0,0,0,1|0,0,0]=2 4919 B13R1.14 COC(=O)CCc1ccc(cc1)F Amb17400909 [0,1,0,0,0,1|0,0,0]=2 4920 B13R1.14 COC(=O)CNc1[n]cc(N)c[n]1 Amb18305385 [0,1,0,0,0,1|2,0,0]=4 4921 B13R1.14 COC(=O)CNc1ccc(F)c[n]1 Amb19045363 [0,1,0,0,0,1|1,0,0]=3 4922 B13R1.14 COC(=O)CNc1ccc(N)[n][n]1 Amb25134977 [0,1,0,0,0,1|2,0,0]=4 4923 B13R1.14 COC(=O)CNc1ccc(cc1)Br Amb1921801 [0,1,0,0,0,1|0,0,0]=2 4924 B13R1.14 COC(=O)CNc1ccc(cc1)O Amb10604010 [0,1,0,0,0,1|0,0,0]=2 4925 B13R1.14 COC(=O)CNc1ccc(cc1)O Amb10604138 [0,1,0,0,0,1|0,0,0]=2 4926 B13R1.14 COC(=O)CNc1ccc(cn1)N Amb1120232 [0,1,0,0,0,1|1,0,0]=3 4927 B13R1.14 COC(=O)COc1ccc(N)cc1 Amb23385314 [0,1,0,0,0,1|0,0,0]=2 4928 B13R1.14 COC(=O)COc1ccc(O)c[n]1 Amb24095899 [0,1,0,0,0,1|1,0,0]=3 4929 B13R1.14 COC(=O)COc1ccc(cc1)I Amb1929651 [0,1,0,0,0,1|0,0,0]=2 4930 B13R1.14 COC(=O)COc1ccc(cc1)O Amb10975204 [0,1,0,0,0,1|0,0,0]=2 4931 B13R1.14 COC(=O)CSc1ccc(N)cc1 Amb24066581 [0,1,0,0,0,1|0,0,0]=2 4932 B13R1.14 COC(=O)CSc1ccc(O)cc1 Amb18321905 [0,1,0,0,0,1|0,0,0]=2 4933 B13R1.14 COC(=O)NCC1=CNC(=O)C=C1 Amb25232375 [0,1,0,0,0,1|1,0,0]=3 4934 B13R1.14 COC(=O)NCc1ccc(Br)cc1 Amb25101223 [0,1,0,0,0,1|0,0,0]=2 4935 B13R1.14 COC(=O)NCc1ccc(C)cc1 Amb17869525 [0,1,0,0,0,1|0,0,0]=2 4936 B13R1.14 COC(=O)NCc1ccc(Cl)c[n]1 Amb25741010 [0,1,0,0,0,1|1,0,0]=3 4937 B13R1.14 COC(=O)NCc1ccc(F)cc1 Amb17860018 [0,1,0,0,0,1|0,0,0]=2 4938 B13R1.14 COC(=O)NCc1ccc(O)cc1 Amb24423720 [0,1,0,0,0,1|0,0,0]=2 4939 B13R1.14 COC(=O)NN=C1C=CC(=O)C=C1 Amb24594193 [0,1,0,0,0,1|1,0,0]=3 4940 B13R1.14 COC(=O)NNc1ccc(F)cc1 Amb24370510 [0,1,0,0,0,1|1,0,0]=3 4941 B13R1.14 COC(=O)\C=C/c1ccc(Br)cc1 Amb24668018 [0,1,0,0,0,1|0,0,1]=3 4942 B13R1.14 COC(=O)\C=C/c1ccc(O)cc1 Amb23469768 [0,1,0,0,0,1|0,0,1]=3 4943 B13R1.14 COC(=O)\C=C\N1C=CC(=O)C=C1 Amb25264824 [0,1,0,0,0,1|1,0,1]=4 4944 B13R1.14 COC(=O)\C=C\c1ccc(Br)c[n]1 Amb25368788 [0,1,0,0,0,1|1,0,1]=4 4945 B13R1.14 COC(=O)\C=C\c1ccc(Br)cc1 Amb19894690 [0,1,0,0,0,1|0,0,1]=3 4946 B13R1.14 COC(=O)\C=C\c1ccc(Cl)c[n]1 Amb25047046 [0,1,0,0,0,1|1,0,1]=4 4947 B13R1.14 COC(=O)\C=C\c1ccc(I)cc1 Amb25726381 [0,1,0,0,0,1|0,0,1]=3 4948 B13R1.14 COC(=O)\C=C\c1ccc(N)[n]c1 Amb24558350 [0,1,0,0,0,1|1,0,1]=4 4949 B13R1.14 COC(=O)\C=C\c1ccc(cc1)S Amb17616841 [0,1,0,0,0,1|0,0,1]=3 4950 B13R1.14 COC(=O)\C=C\c1ccc(nc1)Cl Amb2196616 [0,1,0,0,0,1|1,0,1]=4 4951 B13R1.14 COC(C)CNc1ccc(Br)cc1 Amb25724022 [0,1,0,0,0,1|1,0,1]=4 4952 B13R1.14 COC(C)CNc1ccc(F)cc1 Amb25273643 [0,1,0,0,0,1|1,0,1]=4 4953 B13R1.14 COC(C)CNc1ccc(I)cc1 Amb24490536 [0,1,0,0,0,1|1,0,1]=4 4954 B13R1.14 COC(C)CNc1ccc(O)cc1 Amb24583405 [0,1,0,0,0,1|1,0,1]=4 4955 B13R1.14 CO\C(\Cl)=N\Nc1ccc(Br)cc1 Amb24536283 [0,1,0,0,0,1|2,0,0]=4 4956 B13R1.14 CSC(=S)NCc1ccc(cc1)C Amb2444576 [0,1,0,0,0,1|0,2,0]=4 4957 B13R1.14 CSC(=S)NCc1ccc(cc1)Cl Amb2444564 [0,1,0,0,0,1|0,2,0]=4 4958 B13R1.14 CSC(=S)NCc1ccc(cc1)F Amb2444570 [0,1,0,0,0,1|0,2,0]=4 4959 B13R1.14 CS\C(\N)=N\Cc1ccc(Br)cc1 Amb25858894 [0,1,0,0,0,1|1,1,0]=4 4960 B13R1.14 CS\C(\N)=N\Cc1ccc(Cl)cc1 Amb25205359 [0,1,0,0,0,1|1,1,0]=4 4961 B13R1.14 C\C(\CNc1ccc(Cl)cc1)=C\C Amb25206193 [0,1,0,0,0,1|2,0,0]=4 4962 B13R1.14 C\C=C(\C)/CNc1ccc(C)cc1 Amb25072343 [0,1,0,0,0,1|2,0,0]=4 4963 B13R1.14 C\N=C(\N)/SCc1ccc(Cl)cc1 Amb25372644 [0,1,0,0,0,1|2,0,0]=4 4964 B13R1.14 C\N=C(\N)/SCc1ccc(I)cc1 Amb24582301 [0,1,0,0,0,1|2,0,0]=4 4965 B13R1.14 Cc1c[n]c(CNC(=O)OC)c[n]1 Amb25206576 [0,1,0,0,0,1|2,0,0]=4 4966 B13R1.14 Cc1c[n]c(NCC(=O)OC)[n]c1 Amb25740986 [0,1,0,0,0,1|2,0,0]=4 4967 B13R1.14 Cc1ccc(C=CC(=O)CC)cc1 Amb21618917 [0,1,0,0,0,1|1,0,1]=4 4968 B13R1.14 Cc1ccc(CCC(=N)OC)cc1 Amb18065699 [0,1,0,0,0,1|1,0,0]=3 4969 B13R1.14 Cc1ccc(CCC(=O)CN)cc1 Amb18065723 [0,1,0,0,0,1|2,0,0]=4 4970 B13R1.14 Cc1ccc(CCC(=O)CO)cc1 Amb18065754 [0,1,0,0,0,1|2,0,0]=4 4971 B13R1.14 Cc1ccc(CCC(=O)NO)cc1 Amb18186323 [0,1,0,0,0,1|2,0,0]=4 4972 B13R1.14 Cc1ccc(CCC(=O)OC)c[n]1 Amb24066591 [0,1,0,0,0,1|1,0,0]=3 4973 B13R1.14 Cc1ccc(CNC(=N)CC)cc1 Amb24370371 [0,1,0,0,0,1|2,0,0]=4 4974 B13R1.14 Cc1ccc(CNC(=N)NC)cc1 Amb18186101 [0,1,0,0,0,1|2,0,0]=4 4975 B13R1.14 Cc1ccc(CNC(=O)NC)[n]c1 Amb25251294 [0,1,0,0,0,1|2,0,0]=4 4976 B13R1.14 Cc1ccc(CNC(=O)NC)c[n]1 Amb25153626 [0,1,0,0,0,1|2,0,0]=4 4977 B13R1.14 Cc1ccc(CNC(=O)OC)c[n]1 Amb25190127 [0,1,0,0,0,1|1,0,0]=3 4978 B13R1.14 Cc1ccc(CNC(=O)SC)cc1 Amb24563855 [0,1,0,0,0,1|0,1,0]=3 4979 B13R1.14 Cc1ccc(CNC(=S)NC)cc1 Amb25858873 [0,1,0,0,0,1|1,1,0]=4 4980 B13R1.14 Cc1ccc(COC(=O)NN)cc1 Amb24501329 [0,1,0,0,0,1|2,0,0]=4 4981 B13R1.14 Cc1ccc(NCC(=O)OC)[n][n]1 Amb18178995 [0,1,0,0,0,1|2,0,0]=4 4982 B13R1.14 Cc1ccc(\C=C\C(=O)OC)[n]c1 Amb25079372 [0,1,0,0,0,1|1,0,1]=4 4983 B13R1.14 Cc1ccc(\C=C\C(=O)OC)c[n]1 Amb25135039 [0,1,0,0,0,1|1,0,1]=4 4984 B13R1.14 Cc1ccc(\C=N\C(=O)OC)cc1 Amb24095905 [0,1,0,0,0,1|0,0,1]=3 4985 B13R1.14 Cc1ccc(cc1)C#CC(=O)CC Amb24492357 [0,1,0,0,0,1|1,0,1]=4 4986 B13R1.14 Cc1ccc(cc1)NCC(=O)NO Amb24695270 [0,1,0,0,0,1|2,0,0]=4 4987 B13R1.14 Cc1ccc(cc1)NCC(C)OC Amb25078495 [0,1,0,0,0,1|1,0,1]=4 4988 B13R1.14 Cc1ccc(cc1)OCC(=N)OC Amb18065839 [0,1,0,0,0,1|1,0,0]=3 4989 B13R1.14 Cc1ccc(cc1)OCC(=O)CBr Amb22275220 [0,1,0,0,0,1|2,0,0]=4 4990 B13R1.14 Cc1ccc(cc1)OCC(=O)CO Amb18065912 [0,1,0,0,0,1|2,0,0]=4 4991 B13R1.14 Cc1ccc(cc1)SCC(=O)C#C Amb24446207 [0,1,0,0,0,1|1,0,1]=4 4992 B13R1.14 Cc1ccc(cc1)SCC(=O)NO Amb24372566 [0,1,0,0,0,1|2,0,0]=4 4993 B13R1.14 Cc1ccc(cc1)SNC(=O)NC Amb25224416 [0,1,0,0,0,1|2,0,0]=4 4994 B13R1.14 ClCC(=O)CCc1ccc(cc1)Br Amb17163906 [0,1,0,0,0,1|2,0,0]=4 4995 B13R1.14 ClCC(=O)CCc1ccc(cc1)C Amb17139634 [0,1,0,0,0,1|2,0,0]=4 4996 B13R1.14 ClCC(=O)CCc1ccc(cc1)Cl Amb17141006 [0,1,0,0,0,1|2,0,0]=4 4997 B13R1.14 ClCC(=O)CCc1ccc(cc1)F Amb17139827 [0,1,0,0,0,1|2,0,0]=4 4998 B13R1.14 ClCC(=O)COc1ccc(cc1)Br Amb17164622 [0,1,0,0,0,1|2,0,0]=4 4999 B13R1.14 ClCC(=O)COc1ccc(cc1)C Amb17139730 [0,1,0,0,0,1|2,0,0]=4 5000 B13R1.14 ClCC(=O)COc1ccc(cc1)Cl Amb17141142 [0,1,0,0,0,1|2,0,0]=4 5001 B13R1.14 ClCC(=O)COc1ccc(cc1)F Amb17139899 [0,1,0,0,0,1|2,0,0]=4 5002 B13R1.14 ClCC(=O)NCc1ccc(cc1)Br Amb1132658 [0,1,0,0,0,1|2,0,0]=4 5003 B13R1.14 ClCC(=O)NCc1ccc(cc1)F Amb1202302 [0,1,0,0,0,1|2,0,0]=4 5004 B13R1.14 NCC(=O)CCc1ccc(Br)cc1 Amb18156196 [0,1,0,0,0,1|2,0,0]=4 5005 B13R1.14 NCC(=O)CCc1ccc(Cl)cc1 Amb18565992 [0,1,0,0,0,1|2,0,0]=4 5006 B13R1.14 NCC(=O)CCc1ccc(F)cc1 Amb18066019 [0,1,0,0,0,1|2,0,0]=4 5007 B13R1.14 NCC(=O)NCc1ccc(Cl)cc1 Amb18014635 [0,1,0,0,0,1|2,0,0]=4 5008 B13R1.14 NCC(=O)NCc1ccc(O)cc1 Amb25756642 [0,1,0,0,0,1|2,0,0]=4 5009 B13R1.14 NCC(=O)NCc1ccc(cc1)Br Amb17410713 [0,1,0,0,0,1|2,0,0]=4 5010 B13R1.14 NCC(=O)OCc1ccc(cc1)Br Amb17349668 [0,1,0,0,0,1|2,0,0]=4 5011 B13R1.14 NCC(=O)OCc1ccc(cc1)C Amb17335306 [0,1,0,0,0,1|2,0,0]=4 5012 B13R1.14 NCC(=O)OCc1ccc(cc1)Cl Amb17337477 [0,1,0,0,0,1|2,0,0]=4 5013 B13R1.14 NCC(=O)OCc1ccc(cc1)F Amb17335596 [0,1,0,0,0,1|2,0,0]=4 5014 B13R1.14 NNC(=O)CCc1ccc(Cl)cc1 Amb22461103 [0,1,0,0,0,1|2,0,0]=4 5015 B13R1.14 NNC(=O)CCc1ccc(cc1)O Amb10072408 [0,1,0,0,0,1|2,0,0]=4 5016 B13R1.14 NNC(=O)CNc1ccc(Br)cc1 Amb24466897 [0,1,0,0,0,1|2,0,0]=4 5017 B13R1.14 NNC(=O)CNc1ccc(cc1)Br Amb1921803 [0,1,0,0,0,1|2,0,0]=4 5018 B13R1.14 NNC(=O)CNc1ccc(cc1)C Amb1104525 [0,1,0,0,0,1|2,0,0]=4 5019 B13R1.14 NNC(=O)CNc1ccc(cc1)Cl Amb1921802 [0,1,0,0,0,1|2,0,0]=4 5020 B13R1.14 NNC(=O)CNc1ccc(cc1)F Amb1105923 [0,1,0,0,0,1|2,0,0]=4 5021 B13R1.14 NNC(=O)CNc1ccc(cc1)I Amb1005840 [0,1,0,0,0,1|2,0,0]=4 5022 B13R1.14 NNC(=O)COc1ccc(O)cc1 Amb25723334 [0,1,0,0,0,1|2,0,0]=4 5023 B13R1.14 NNC(=O)CSc1ccc(O)cc1 Amb22452321 [0,1,0,0,0,1|2,0,0]=4 5024 B13R1.14 NNC(=O)CSc1ccc(cc1)Cl Amb1104568 [0,1,0,0,0,1|2,0,0]=4 5025 B13R1.14 NNC(=O)OCc1ccc(F)cc1 Amb24741183 [0,1,0,0,0,1|2,0,0]=4 5026 B13R1.14 Nc1ccc(CCC(=O)NN)cc1 Amb23247768 [0,1,0,0,0,1|2,0,0]=4 5027 B13R1.14 Nc1ccc(CCC(=O)NO)cc1 Amb24494088 [0,1,0,0,0,1|2,0,0]=4 5028 B13R1.14 Nc1ccc(CNC(=O)CN)cc1 Amb25693389 [0,1,0,0,0,1|2,0,0]=4 5029 B13R1.14 Nc1ccc(cc1)SCC(=O)NN Amb23247911 [0,1,0,0,0,1|2,0,0]=4 5030 B13R1.14 O=C(CBr)CCc1ccc(I)cc1 Amb24184078 [0,1,0,0,0,1|2,0,0]=4 5031 B13R1.14 O=C(CBr)COc1ccc(Cl)cc1 Amb20668078 [0,1,0,0,0,1|2,0,0]=4 5032 B13R1.14 O=C(CCl)CSc1ccc(F)cc1 Amb22395322 [0,1,0,0,0,1|2,0,0]=4 5033 B13R1.14 O=C(CCl)OCc1ccc(Cl)cc1 Amb22366046 [0,1,0,0,0,1|2,0,0]=4 5034 B13R1.14 O=C(CF)NCc1ccc(Br)cc1 Amb24072321 [0,1,0,0,0,1|2,0,0]=4 5035 B13R1.14 O=C(CNc1ccc(Cl)cc1)CCl Amb24489593 [0,1,0,0,0,1|2,0,0]=4 5036 B13R1.14 OCC(=O)CCc1ccc(Br)cc1 Amb18071391 [0,1,0,0,0,1|2,0,0]=4 5037 B13R1.14 OCC(=O)CCc1ccc(Cl)cc1 Amb18566076 [0,1,0,0,0,1|2,0,0]=4 5038 B13R1.14 OCC(=O)CCc1ccc(F)cc1 Amb18066060 [0,1,0,0,0,1|2,0,0]=4 5039 B13R1.14 OCC(=O)CNc1ccc(Cl)cc1 Amb25780015 [0,1,0,0,0,1|2,0,0]=4 5040 B13R1.14 OCC(=O)COc1ccc(Br)cc1 Amb18072017 [0,1,0,0,0,1|2,0,0]=4 5041 B13R1.14 OCC(=O)COc1ccc(Cl)cc1 Amb18566286 [0,1,0,0,0,1|2,0,0]=4 5042 B13R1.14 OCC(=O)COc1ccc(F)cc1 Amb18066127 [0,1,0,0,0,1|2,0,0]=4 5043 B13R1.14 OCC(=O)NCc1ccc(cc1)Br Amb17410952 [0,1,0,0,0,1|2,0,0]=4 5044 B13R1.14 OCC(=O)NCc1ccc(cc1)Cl Amb1228441 [0,1,0,0,0,1|2,0,0]=4 5045 B13R1.14 ONC(=O)CCc1ccc(F)cc1 Amb25845754 [0,1,0,0,0,1|2,0,0]=4 5046 B13R1.14 ONC(=O)CNc1ccc(F)cc1 Amb24489109 [0,1,0,0,0,1|2,0,0]=4 5047 B13R1.14 ONC(=O)COc1ccc(cc1)Br Amb1779398 [0,1,0,0,0,1|2,0,0]=4 5048 B13R1.14 ONC(=O)COc1ccc(cc1)C Amb17233783 [0,1,0,0,0,1|2,0,0]=4 5049 B13R1.14 ONC(=O)CSc1ccc(F)cc1 Amb25848286 [0,1,0,0,0,1|2,0,0]=4 5050 B13R1.14 Oc1ccc(CNC(=O)CBr)cc1 Amb24491758 [0,1,0,0,0,1|2,0,0]=4 5051 B13R1.14 Oc1ccc(cc1)OCC(=O)NO Amb25286688 [0,1,0,0,0,1|2,0,0]=4 5052 B13R1.15 BrCC(=O)NCc1cccc(c1)C Amb17331111 [0,1,0,0,0,1|2,0,0]=4 5053 B13R1.15 BrCC(=O)NCc1cccc(c1)Cl Amb17333171 [0,1,0,0,0,1|2,0,0]=4 5054 B13R1.15 C#CC(=O)CCc1cccc(N)c1 Amb25155911 [0,1,0,0,0,1|1,0,1]=4 5055 B13R1.15 C#CC(=O)COc1cccc(Cl)c1 Amb25133574 [0,1,0,0,0,1|1,0,1]=4 5056 B13R1.15 C#CC(=O)CSc1cccc(Br)c1 Amb25212165 [0,1,0,0,0,1|1,0,1]=4 5057 B13R1.15 C#CC(=O)CSc1cccc(Cl)c1 Amb24593287 [0,1,0,0,0,1|1,0,1]=4 5058 B13R1.15 C#CC(=O)NCc1cccc(F)c1 Amb25848209 [0,1,0,0,0,1|1,0,1]=4 5059 B13R1.15 C#CC(=O)NCc1cccc(O)c1 Amb18180471 [0,1,0,0,0,1|1,0,1]=4 5060 B13R1.15 C=CC(=O)NCc1cccc(Br)c1 Amb25154808 [0,1,0,0,0,1|1,0,1]=4 5061 B13R1.15 C=CC(=O)NCc1cccc(O)c1 Amb18180640 [0,1,0,0,0,1|1,0,1]=4 5062 B13R1.15 C=CC(=O)OCc1cccc(I)c1 Amb17934076 [0,1,0,0,0,1|1,0,1]=4 5063 B13R1.15 CCC(=C)CNc1cc(Br)ccc1 Amb25113262 [0,1,0,0,0,1|2,0,0]=4 5064 B13R1.15 CCC(=N)NCc1cc(Cl)ccc1 Amb24372339 [0,1,0,0,0,1|2,0,0]=4 5065 B13R1.15 CCC(=N)NCc1cc(F)ccc1 Amb25372375 [0,1,0,0,0,1|2,0,0]=4 5066 B13R1.15 CCC(=O)COc1cc(N)ccc1 Amb22010109 [0,1,0,0,0,1|1,0,0]=3 5067 B13R1.15 CCC(=O)NCC=1C=CNC(=O)C1 Amb25336868 [0,1,0,0,0,1|2,0,0]=4 5068 B13R1.15 CCC(=O)NCc1cc(Br)c[n]c1 Amb25325257 [0,1,0,0,0,1|2,0,0]=4 5069 B13R1.15 CCC(=O)NCc1cc(Cl)cc[n]1 Amb25698426 [0,1,0,0,0,1|2,0,0]=4 5070 B13R1.15 CCC(=O)NCc1cc(N)ccc1 Amb18992892 [0,1,0,0,0,1|1,0,0]=3 5071 B13R1.15 CCC(=O)NCc1cc(O)ccc1 Amb18180918 [0,1,0,0,0,1|1,0,0]=3 5072 B13R1.15 CCC(=O)NCc1cccc(Cl)[n]1 Amb24502731 [0,1,0,0,0,1|2,0,0]=4 5073 B13R1.15 CCC(=O)NCc1cccc(F)[n]1 Amb24502732 [0,1,0,0,0,1|2,0,0]=4 5074 B13R1.15 CCC(=O)NCc1cccc(c1)Br Amb2085744 [0,1,0,0,0,1|1,0,0]=3 5075 B13R1.15 CCC(=O)NCc1cccc(c1)Cl Amb2023613 [0,1,0,0,0,1|1,0,0]=3 5076 B13R1.15 CCC(=O)NNc1cc(Cl)ccc1 Amb25357056 [0,1,0,0,0,1|2,0,0]=4 5077 B13R1.15 CCC(=O)NNc1cc(F)ccc1 Amb24706504 [0,1,0,0,0,1|2,0,0]=4 5078 B13R1.15 CCC(=O)\N=C\c1cccc(O)c1 Amb24072990 [0,1,0,0,0,1|1,0,1]=4 5079 B13R1.15 CN=C(N)NCc1cccc(Br)c1 Amb20641746 [0,1,0,0,0,1|2,0,0]=4 5080 B13R1.15 CNC(=N)NCc1cccc(Cl)c1 Amb18325458 [0,1,0,0,0,1|2,0,0]=4 5081 B13R1.15 CNC(=N)NCc1cccc(F)c1 Amb18805222 [0,1,0,0,0,1|2,0,0]=4 5082 B13R1.15 CNC(=O)C=Cc1cccc(F)c1 Amb20635247 [0,1,0,0,0,1|1,0,1]=4 5083 B13R1.15 CNC(=O)CCc1c[n]cc(O)c1 Amb25734350 [0,1,0,0,0,1|2,0,0]=4 5084 B13R1.15 CNC(=O)CCc1cccc(N)c1 Amb19959906 [0,1,0,0,0,1|1,0,0]=3 5085 B13R1.15 CNC(=O)CCc1cccc(c1)N Amb17622196 [0,1,0,0,0,1|1,0,0]=3 5086 B13R1.15 CNC(=O)CNc1cc(N)cc[n]1 Amb18981481 [0,1,0,0,0,1|2,0,0]=4 5087 B13R1.15 CNC(=O)CNc1cc[n]c(Cl)c1 Amb25191380 [0,1,0,0,0,1|2,0,0]=4 5088 B13R1.15 CNC(=O)CNc1cc[n]c(N)c1 Amb24357633 [0,1,0,0,0,1|2,0,0]=4 5089 B13R1.15 CNC(=O)CNc1cccc(Cl)[n]1 Amb25854611 [0,1,0,0,0,1|2,0,0]=4 5090 B13R1.15 CNC(=O)CNc1cccc(F)[n]1 Amb18973541 [0,1,0,0,0,1|2,0,0]=4 5091 B13R1.15 CNC(=O)COc1cccc(c1)C Amb2040394 [0,1,0,0,0,1|1,0,0]=3 5092 B13R1.15 CNC(=O)COc1cccc(c1)F Amb2131085 [0,1,0,0,0,1|1,0,0]=3 5093 B13R1.15 CNC(=O)CSc1cc(N)cc[n]1 Amb25768665 [0,1,0,0,0,1|2,0,0]=4 5094 B13R1.15 CNC(=O)CSc1cc[n]c(Cl)c1 Amb25768681 [0,1,0,0,0,1|2,0,0]=4 5095 B13R1.15 CNC(=O)CSc1cc[n]c(F)c1 Amb25819762 [0,1,0,0,0,1|2,0,0]=4 5096 B13R1.15 CNC(=O)CSc1cccc(Br)[n]1 Amb25051503 [0,1,0,0,0,1|2,0,0]=4 5097 B13R1.15 CNC(=O)CSc1cccc(Br)c1 Amb25135883 [0,1,0,0,0,1|1,0,0]=3 5098 B13R1.15 CNC(=O)CSc1cccc(Cl)[n]1 Amb25838961 [0,1,0,0,0,1|2,0,0]=4 5099 B13R1.15 CNC(=O)CSc1cccc(F)c1 Amb25271195 [0,1,0,0,0,1|1,0,0]=3 5100 B13R1.15 CNC(=O)CSc1cccc(N)c1 Amb25288027 [0,1,0,0,0,1|1,0,0]=3 5101 B13R1.15 CNC(=O)NCc1cccc(Cl)c1 Amb22584233 [0,1,0,0,0,1|1,0,0]=3 5102 B13R1.15 CNC(=O)NCc1cccc(N)c1 Amb25369261 [0,1,0,0,0,1|1,0,0]=3 5103 B13R1.15 CNC(=O)NCc1cccc(O)c1 Amb25848066 [0,1,0,0,0,1|1,0,0]=3 5104 B13R1.15 CNC(=O)NCc1cccc(c1)Br Amb15366176 [0,1,0,0,0,1|1,0,0]=3 5105 B13R1.15 CNC(=O)NNc1cc(Br)ccc1 Amb24631786 [0,1,0,0,0,1|2,0,0]=4 5106 B13R1.15 CNC(=O)OCc1cccc(Br)[n]1 Amb25212978 [0,1,0,0,0,1|2,0,0]=4 5107 B13R1.15 CNC(=O)OCc1cccc(Cl)[n]1 Amb25790568 [0,1,0,0,0,1|2,0,0]=4 5108 B13R1.15 CNC(=O)OCc1cccc(Cl)c1 Amb22460565 [0,1,0,0,0,1|1,0,0]=3 5109 B13R1.15 CNC(=O)\C=C\c1cccc(Cl)c1 Amb24552298 [0,1,0,0,0,1|1,0,1]=4 5110 B13R1.15 CNC(=O)\C=C\c1cccc(F)c1 Amb25232444 [0,1,0,0,0,1|1,0,1]=4 5111 B13R1.15 CNC(=O)\C=C\c1cccc(c1)Br Amb11217744 [0,1,0,0,0,1|1,0,1]=4 5112 B13R1.15 CNC(=O)\C=C\c1cccc(c1)N Amb17138777 [0,1,0,0,0,1|1,0,1]=4 5113 B13R1.15 CNC(=S)NCc1cccc(Cl)c1 Amb24534613 [0,1,0,0,0,1|1,1,0]=4 5114 B13R1.15 CNC(=S)NCc1cccc(F)c1 Amb24687295 [0,1,0,0,0,1|1,1,0]=4 5115 B13R1.15 CNC(=S)NCc1cccc(N)c1 Amb21683192 [0,1,0,0,0,1|1,1,0]=4 5116 B13R1.15 CNC(=S)NCc1cccc(O)c1 Amb25133910 [0,1,0,0,0,1|1,1,0]=4 5117 B13R1.15 CNC(=S)NCc1cccc(c1)Br Amb15119464 [0,1,0,0,0,1|1,1,0]=4 5118 B13R1.15 COC(=N)CCc1cccc(Br)c1 Amb18071178 [0,1,0,0,0,1|1,0,0]=3 5119 B13R1.15 COC(=N)CCc1cccc(Cl)c1 Amb18066444 [0,1,0,0,0,1|1,0,0]=3 5120 B13R1.15 COC(=N)CCc1cccc(F)c1 Amb18564164 [0,1,0,0,0,1|1,0,0]=3 5121 B13R1.15 COC(=N)COc1cccc(Br)c1 Amb18577246 [0,1,0,0,0,1|1,0,0]=3 5122 B13R1.15 COC(=N)COc1cccc(Cl)c1 Amb18066508 [0,1,0,0,0,1|1,0,0]=3 5123 B13R1.15 COC(=N)COc1cccc(F)c1 Amb18066093 [0,1,0,0,0,1|1,0,0]=3 5124 B13R1.15 COC(=O)/C=C/c1cccc(Cl)c1 Amb17844464 [0,1,0,0,0,1|0,0,1]=3 5125 B13R1.15 COC(=O)C#CC1=CC(=O)NC=C1 Amb24447181 [0,1,0,0,0,1|1,0,1]=4 5126 B13R1.15 COC(=O)C#Cc1c[n]cc(Br)c1 Amb25039652 [0,1,0,0,0,1|1,0,1]=4 5127 B13R1.15 COC(=O)C#Cc1c[n]cc(F)c1 Amb25269359 [0,1,0,0,0,1|1,0,1]=4 5128 B13R1.15 COC(=O)C#Cc1cc(F)ccc1 Amb25726243 [0,1,0,0,0,1|0,0,1]=3 5129 B13R1.15 COC(=O)C=Cc1cccc(O)c1 Amb24098382 [0,1,0,0,0,1|0,0,1]=3 5130 B13R1.15 COC(=O)CCc1cc[n]c(N)c1 Amb24105504 [0,1,0,0,0,1|1,0,0]=3 5131 B13R1.15 COC(=O)CCc1cccc(N)c1 Amb18648245 [0,1,0,0,0,1|0,0,0]=2 5132 B13R1.15 COC(=O)CCc1cccc(c1)Br Amb17410710 [0,1,0,0,0,1|0,0,0]=2 5133 B13R1.15 COC(=O)CCc1cccc(c1)C Amb17400661 [0,1,0,0,0,1|0,0,0]=2 5134 B13R1.15 COC(=O)CCc1cccc(c1)Cl Amb17402276 [0,1,0,0,0,1|0,0,0]=2 5135 B13R1.15 COC(=O)CNC1=CC(=O)NC=N1 Amb25755670 [0,1,0,0,0,1|2,0,0]=4 5136 B13R1.15 COC(=O)CNc1c[n]cc(Cl)[n]1 Amb24374824 [0,1,0,0,0,1|2,0,0]=4 5137 B13R1.15 COC(=O)CNc1c[n]cc(N)c1 Amb25673632 [0,1,0,0,0,1|1,0,0]=3 5138 B13R1.15 COC(=O)CNc1cc(Br)[n]c[n]1 Amb25330621 [0,1,0,0,0,1|2,0,0]=4 5139 B13R1.15 COC(=O)CNc1cc(Cl)cc[n]1 Amb24751655 [0,1,0,0,0,1|1,0,0]=3 5140 B13R1.15 COC(=O)CNc1cc(F)[n]c[n]1 Amb24681688 [0,1,0,0,0,1|2,0,0]=4 5141 B13R1.15 COC(=O)CNc1cc(N)cc[n]1 Amb18184983 [0,1,0,0,0,1|1,0,0]=3 5142 B13R1.15 COC(=O)CNc1cc[n]c(Cl)[n]1 Amb18308399 [0,1,0,0,0,1|2,0,0]=4 5143 B13R1.15 COC(=O)CNc1cc[n]c(Cl)c1 Amb24427620 [0,1,0,0,0,1|1,0,0]=3 5144 B13R1.15 COC(=O)CNc1cc[n]c(N)[n]1 Amb25207515 [0,1,0,0,0,1|2,0,0]=4 5145 B13R1.15 COC(=O)CNc1cc[n]c(N)c1 Amb25224860 [0,1,0,0,0,1|1,0,0]=3 5146 B13R1.15 COC(=O)CNc1cccc(Cl)[n]1 Amb25187972 [0,1,0,0,0,1|1,0,0]=3 5147 B13R1.15 COC(=O)CNc1cccc(F)[n]1 Amb19011125 [0,1,0,0,0,1|1,0,0]=3 5148 B13R1.15 COC(=O)COC=1C=NNC(=O)C1 Amb22301613 [0,1,0,0,0,1|2,0,0]=4 5149 B13R1.15 COC(=O)COc1c[n][n]c(Cl)c1 Amb22301580 [0,1,0,0,0,1|2,0,0]=4 5150 B13R1.15 COC(=O)COc1cc(Cl)cc[n]1 Amb22301619 [0,1,0,0,0,1|1,0,0]=3 5151 B13R1.15 COC(=O)COc1cccc(Cl)[n]1 Amb22486485 [0,1,0,0,0,1|1,0,0]=3 5152 B13R1.15 COC(=O)COc1cccc(c1)N Amb1117898 [0,1,0,0,0,1|0,0,0]=2 5153 B13R1.15 COC(=O)CSC=1NC(=O)C=CN1 Amb18516366 [0,1,0,0,0,1|2,0,0]=4 5154 B13R1.15 COC(=O)CSc1[n]c(N)cc[n]1 Amb22460534 [0,1,0,0,0,1|2,0,0]=4 5155 B13R1.15 COC(=O)CSc1cc(Cl)cc[n]1 Amb22304246 [0,1,0,0,0,1|1,0,0]=3 5156 B13R1.15 COC(=O)CSc1cc[n]c(N)[n]1 Amb21984193 [0,1,0,0,0,1|2,0,0]=4 5157 B13R1.15 COC(=O)CSc1cccc(Cl)[n]1 Amb22432540 [0,1,0,0,0,1|1,0,0]=3 5158 B13R1.15 COC(=O)CSc1cccc(N)c1 Amb19005104 [0,1,0,0,0,1|0,0,0]=2 5159 B13R1.15 COC(=O)CSc1nccc(n1)O Amb2522996 [0,1,0,0,0,1|2,0,0]=4 5160 B13R1.15 COC(=O)CSc1ncnc(c1)C Amb1398762 [0,1,0,0,0,1|2,0,0]=4 5161 B13R1.15 COC(=O)NCC1=CC=CC(=O)N1 Amb25802747 [0,1,0,0,0,1|1,0,0]=3 5162 B13R1.15 COC(=O)NCc1cccc(F)[n]1 Amb25796147 [0,1,0,0,0,1|1,0,0]=3 5163 B13R1.15 COC(=O)NCc1cccc(F)c1 Amb24095872 [0,1,0,0,0,1|0,0,0]=2 5164 B13R1.15 COC(=O)NCc1cccc(N)c1 Amb18992199 [0,1,0,0,0,1|0,0,0]=2 5165 B13R1.15 COC(=O)NCc1cccc(O)c1 Amb18181287 [0,1,0,0,0,1|0,0,0]=2 5166 B13R1.15 COC(=O)NCc1cccc(c1)Br Amb2135033 [0,1,0,0,0,1|0,0,0]=2 5167 B13R1.15 COC(=O)NCc1cccc(c1)Cl Amb2023614 [0,1,0,0,0,1|0,0,0]=2 5168 B13R1.15 COC(=O)NNc1cc(Br)cc[n]1 Amb24448749 [0,1,0,0,0,1|2,0,0]=4 5169 B13R1.15 COC(=O)NNc1cc(Br)ccc1 Amb24369850 [0,1,0,0,0,1|1,0,0]=3 5170 B13R1.15 COC(=O)NNc1cc(Cl)cc[n]1 Amb24510175 [0,1,0,0,0,1|2,0,0]=4 5171 B13R1.15 COC(=O)NNc1cc(Cl)ccc1 Amb24529772 [0,1,0,0,0,1|1,0,0]=3 5172 B13R1.15 COC(=O)NNc1cccc(F)[n]1 Amb24510176 [0,1,0,0,0,1|2,0,0]=4 5173 B13R1.15 COC(=O)\C=C\c1cccc(Br)[n]1 Amb20248559 [0,1,0,0,0,1|1,0,1]=4 5174 B13R1.15 COC(=O)\C=C\c1cccc(Cl)[n]1 Amb24394433 [0,1,0,0,0,1|1,0,1]=4 5175 B13R1.15 COC(=O)\C=C\c1cccc(N)c1 Amb18127872 [0,1,0,0,0,1|0,0,1]=3 5176 B13R1.15 COC(=O)\C=C\c1cccc(O)c1 Amb18128083 [0,1,0,0,0,1|0,0,1]=3 5177 B13R1.15 COC(=O)\C=C\c1cccc(c1)Br Amb2407728 [0,1,0,0,0,1|0,0,1]=3 5178 B13R1.15 COC(=O)\C=C\c1cccc(c1)F Amb10839543 [0,1,0,0,0,1|0,0,1]=3 5179 B13R1.15 COC(=O)\N=C\c1cccc(F)c1 Amb24095903 [0,1,0,0,0,1|0,0,1]=3 5180 B13R1.15 COC(C)CNc1cccc(F)c1 Amb24494410 [0,1,0,0,0,1|1,0,1]=4 5181 B13R1.15 COC(C)CNc1cccc(O)c1 Amb24662245 [0,1,0,0,0,1|1,0,1]=4 5182 B13R1.15 CS\C(\N)=N\Cc1cccc(F)c1 Amb25684172 [0,1,0,0,0,1|1,1,0]=4 5183 B13R1.15 C\N=C(\N)/SCc1cccc(Br)c1 Amb24633032 [0,1,0,0,0,1|2,0,0]=4 5184 B13R1.15 Cc1[n]c(cc[n]1)NCC(=O)OC Amb18314619 [0,1,0,0,0,1|2,0,0]=4 5185 B13R1.15 Cc1c[n]cc(CNC(=O)CC)c1 Amb24719157 [0,1,0,0,0,1|2,0,0]=4 5186 B13R1.15 Cc1c[n]cc(c1)C#CC(=O)OC Amb25114393 [0,1,0,0,0,1|1,0,1]=4 5187 B13R1.15 Cc1cc(C=CC(=O)NC)ccc1 Amb19384438 [0,1,0,0,0,1|1,0,1]=4 5188 B13R1.15 Cc1cc(CCC(=N)OC)ccc1 Amb18065695 [0,1,0,0,0,1|1,0,0]=3 5189 B13R1.15 Cc1cc(CCC(=O)CN)ccc1 Amb18065722 [0,1,0,0,0,1|2,0,0]=4 5190 B13R1.15 Cc1cc(CCC(=O)CO)ccc1 Amb18065753 [0,1,0,0,0,1|2,0,0]=4 5191 B13R1.15 Cc1cc(CCC(=O)NN)ccc1 Amb18809074 [0,1,0,0,0,1|2,0,0]=4 5192 B13R1.15 Cc1cc(CCC(=O)NO)ccc1 Amb18186322 [0,1,0,0,0,1|2,0,0]=4 5193 B13R1.15 Cc1cc(CNC(=N)CC)ccc1 Amb25285904 [0,1,0,0,0,1|2,0,0]=4 5194 B13R1.15 Cc1cc(CNC(=N)NC)ccc1 Amb18804665 [0,1,0,0,0,1|2,0,0]=4 5195 B13R1.15 Cc1cc(CNC(=O)C#C)ccc1 Amb25799168 [0,1,0,0,0,1|1,0,1]=4 5196 B13R1.15 Cc1cc(CNC(=O)C=C)ccc1 Amb18795659 [0,1,0,0,0,1|1,0,1]=4 5197 B13R1.15 Cc1cc(CNC(=O)CC)ccc1 Amb23088363 [0,1,0,0,0,1|1,0,0]=3 5198 B13R1.15 Cc1cc(CNC(=O)CF)ccc1 Amb24490261 [0,1,0,0,0,1|2,0,0]=4 5199 B13R1.15 Cc1cc(CNC(=O)NC)ccc1 Amb24677323 [0,1,0,0,0,1|1,0,0]=3 5200 B13R1.15 Cc1cc(CNC(=O)NN)ccc1 Amb18796131 [0,1,0,0,0,1|2,0,0]=4 5201 B13R1.15 Cc1cc(CNC(=O)OC)[n]c[n]1 Amb24335086 [0,1,0,0,0,1|2,0,0]=4 5202 B13R1.15 Cc1cc(CNC(=O)OC)ccc1 Amb25133958 [0,1,0,0,0,1|0,0,0]=2 5203 B13R1.15 Cc1cc(COC(=O)NC)ccc1 Amb24418396 [0,1,0,0,0,1|1,0,0]=3 5204 B13R1.15 Cc1cc(CSC(=O)NN)ccc1 Amb24425671 [0,1,0,0,0,1|2,0,0]=4 5205 B13R1.15 Cc1cc(C\N=C(/N)\SC)ccc1 Amb25241097 [0,1,0,0,0,1|1,1,0]=4 5206 B13R1.15 Cc1cc(NCC(=O)OC)[n]c[n]1 Amb18178989 [0,1,0,0,0,1|2,0,0]=4 5207 B13R1.15 Cc1cc(\C=C\C(=O)NC)ccc1 Amb25815418 [0,1,0,0,0,1|1,0,1]=4 5208 B13R1.15 Cc1cc(\C=C\C(=O)OC)c[n]c1 Amb24350037 [0,1,0,0,0,1|1,0,1]=4 5209 B13R1.15 Cc1cc(\C=N\C(=O)OC)ccc1 Amb24095904 [0,1,0,0,0,1|0,0,1]=3 5210 B13R1.15 Cc1cc(cc[n]1)C#CC(=O)OC Amb25039572 [0,1,0,0,0,1|1,0,1]=4 5211 B13R1.15 Cc1cc(cc[n]1)NCC(=O)NC Amb24738952 [0,1,0,0,0,1|2,0,0]=4 5212 B13R1.15 Cc1cc(cc[n]1)OCC(=O)NC Amb25370185 [0,1,0,0,0,1|2,0,0]=4 5213 B13R1.15 Cc1cc(ccc1)NCC(=C)CC Amb24520834 [0,1,0,0,0,1|2,0,0]=4 5214 B13R1.15 Cc1cc(ccc1)NCC(=O)NO Amb24594361 [0,1,0,0,0,1|2,0,0]=4 5215 B13R1.15 Cc1cc(ccc1)NNC(=O)CC Amb24072221 [0,1,0,0,0,1|2,0,0]=4 5216 B13R1.15 Cc1cc(ccc1)NNC(=O)NC Amb24741035 [0,1,0,0,0,1|2,0,0]=4 5217 B13R1.15 Cc1cc(ccc1)OCC(=N)OC Amb18065838 [0,1,0,0,0,1|1,0,0]=3 5218 B13R1.15 Cc1cc(ccc1)OCC(=O)CO Amb18065911 [0,1,0,0,0,1|2,0,0]=4 5219 B13R1.15 Cc1cc(ccc1)SCC(=O)NC Amb24404352 [0,1,0,0,0,1|1,0,0]=3 5220 B13R1.15 Cc1cc(ccc1)SCC(=O)OC Amb18318073 [0,1,0,0,0,1|0,0,0]=2 5221 B13R1.15 Cc1cc[n]c(CNC(=O)CC)c1 Amb25056120 [0,1,0,0,0,1|2,0,0]=4 5222 B13R1.15 Cc1cc[n]c(CNC(=O)NC)c1 Amb24586452 [0,1,0,0,0,1|2,0,0]=4 5223 B13R1.15 Cc1cc[n]c(CNC(=O)OC)c1 Amb24552288 [0,1,0,0,0,1|1,0,0]=3 5224 B13R1.15 Cc1cc[n]c(NCC(=O)OC)[n]1 Amb18315770 [0,1,0,0,0,1|2,0,0]=4 5225 B13R1.15 Cc1cc[n]c(c1)NCC(=O)NC Amb18981414 [0,1,0,0,0,1|2,0,0]=4 5226 B13R1.15 Cc1cc[n]c(c1)NCC(=O)OC Amb18184698 [0,1,0,0,0,1|1,0,0]=3 5227 B13R1.15 Cc1cccc(CNC(=O)OC)[n]1 Amb24095901 [0,1,0,0,0,1|1,0,0]=3 5228 B13R1.15 Cc1cccc(COC(=O)NC)[n]1 Amb24490234 [0,1,0,0,0,1|2,0,0]=4 5229 B13R1.15 Cc1cccc(CSC(=O)NC)[n]1 Amb25764378 [0,1,0,0,0,1|2,0,0]=4 5230 B13R1.15 Cc1cccc(NCC(=O)NC)[n]1 Amb24684473 [0,1,0,0,0,1|2,0,0]=4 5231 B13R1.15 Cc1cccc(NCC(=O)OC)[n]1 Amb18796228 [0,1,0,0,0,1|1,0,0]=3 5232 B13R1.15 Cc1cccc(c1)NCC(C)OC Amb24725863 [0,1,0,0,0,1|1,0,1]=4 5233 B13R1.15 ClCC(=O)CCc1cccc(c1)Br Amb17163905 [0,1,0,0,0,1|2,0,0]=4 5234 B13R1.15 ClCC(=O)CCc1cccc(c1)C Amb17139633 [0,1,0,0,0,1|2,0,0]=4 5235 B13R1.15 ClCC(=O)CCc1cccc(c1)Cl Amb17141005 [0,1,0,0,0,1|2,0,0]=4 5236 B13R1.15 ClCC(=O)COc1cccc(c1)Br Amb17164621 [0,1,0,0,0,1|2,0,0]=4 5237 B13R1.15 ClCC(=O)COc1cccc(c1)C Amb17139729 [0,1,0,0,0,1|2,0,0]=4 5238 B13R1.15 ClCC(=O)COc1cccc(c1)Cl Amb17141141 [0,1,0,0,0,1|2,0,0]=4 5239 B13R1.15 ClCC(=O)COc1cccc(c1)F Amb17139898 [0,1,0,0,0,1|2,0,0]=4 5240 B13R1.15 ClCC(=O)NCc1cccc(c1)Br Amb17417038 [0,1,0,0,0,1|2,0,0]=4 5241 B13R1.15 ClCC(=O)NCc1cccc(c1)C Amb17331101 [0,1,0,0,0,1|2,0,0]=4 5242 B13R1.15 ClCC(=O)NCc1cccc(c1)Cl Amb1211854 [0,1,0,0,0,1|2,0,0]=4 5243 B13R1.15 NCC(=O)CCc1cccc(Br)c1 Amb18727294 [0,1,0,0,0,1|2,0,0]=4 5244 B13R1.15 NCC(=O)CCc1cccc(Cl)c1 Amb18066460 [0,1,0,0,0,1|2,0,0]=4 5245 B13R1.15 NCC(=O)CCc1cccc(F)c1 Amb18066017 [0,1,0,0,0,1|2,0,0]=4 5246 B13R1.15 NCC(=O)COc1cc(Br)ccc1 Amb18155771 [0,1,0,0,0,1|2,0,0]=4 5247 B13R1.15 NCC(=O)NCc1cc(O)ccc1 Amb24760315 [0,1,0,0,0,1|2,0,0]=4 5248 B13R1.15 NCC(=O)NCc1cccc(c1)Br Amb17410712 [0,1,0,0,0,1|2,0,0]=4 5249 B13R1.15 NCC(=O)OCc1cccc(c1)Br Amb17349667 [0,1,0,0,0,1|2,0,0]=4 5250 B13R1.15 NCC(=O)OCc1cccc(c1)C Amb17335305 [0,1,0,0,0,1|2,0,0]=4 5251 B13R1.15 NCC(=O)OCc1cccc(c1)Cl Amb17337476 [0,1,0,0,0,1|2,0,0]=4 5252 B13R1.15 NNC(=O)CCc1cccc(F)c1 Amb24730788 [0,1,0,0,0,1|2,0,0]=4 5253 B13R1.15 NNC(=O)CNc1cccc(F)c1 Amb25297647 [0,1,0,0,0,1|2,0,0]=4 5254 B13R1.15 NNC(=O)CNc1cccc(c1)Br Amb1770281 [0,1,0,0,0,1|2,0,0]=4 5255 B13R1.15 NNC(=O)CNc1cccc(c1)C Amb1804640 [0,1,0,0,0,1|2,0,0]=4 5256 B13R1.15 NNC(=O)COc1cccc(I)c1 Amb22484578 [0,1,0,0,0,1|2,0,0]=4 5257 B13R1.15 NNC(=O)COc1cccc(c1)Cl Amb1784776 [0,1,0,0,0,1|2,0,0]=4 5258 B13R1.15 NNC(=O)COc1cccc(c1)F Amb1104515 [0,1,0,0,0,1|2,0,0]=4 5259 B13R1.15 NNC(=O)CSc1cccc(Cl)c1 Amb25703962 [0,1,0,0,0,1|2,0,0]=4 5260 B13R1.15 NNC(=O)NCc1cccc(Br)c1 Amb25816672 [0,1,0,0,0,1|2,0,0]=4 5261 B13R1.15 NNC(=O)NCc1cccc(Cl)c1 Amb19090073 [0,1,0,0,0,1|2,0,0]=4 5262 B13R1.15 Nc1cc(CCC(=O)NN)ccc1 Amb25719001 [0,1,0,0,0,1|2,0,0]=4 5263 B13R1.15 O=C(CS)NCc1cc(Br)ccc1 Amb24534027 [0,1,0,0,0,1|2,0,0]=4 5264 B13R1.15 OCC(=O)CCc1cccc(Br)c1 Amb18072015 [0,1,0,0,0,1|2,0,0]=4 5265 B13R1.15 OCC(=O)CCc1cccc(Cl)c1 Amb18066486 [0,1,0,0,0,1|2,0,0]=4 5266 B13R1.15 OCC(=O)CCc1cccc(F)c1 Amb18066059 [0,1,0,0,0,1|2,0,0]=4 5267 B13R1.15 OCC(=O)COc1cc(Br)ccc1 Amb18072016 [0,1,0,0,0,1|2,0,0]=4 5268 B13R1.15 OCC(=O)COc1cc(Cl)ccc1 Amb18566285 [0,1,0,0,0,1|2,0,0]=4 5269 B13R1.15 OCC(=O)COc1cc(F)ccc1 Amb18066126 [0,1,0,0,0,1|2,0,0]=4 5270 B13R1.15 OCC(=O)NCc1cc(F)ccc1 Amb25157022 [0,1,0,0,0,1|2,0,0]=4 5271 B13R1.15 OCC(=O)NCc1cccc(c1)Br Amb17410951 [0,1,0,0,0,1|2,0,0]=4 5272 B13R1.15 OCC(=O)NCc1cccc(c1)C Amb17400715 [0,1,0,0,0,1|2,0,0]=4 5273 B13R1.15 OCC(=O)NCc1cccc(c1)Cl Amb1111125 [0,1,0,0,0,1|2,0,0]=4 5274 B13R1.15 ONC(=O)CNc1cccc(Cl)c1 Amb24418416 [0,1,0,0,0,1|2,0,0]=4 5275 B13R1.15 ONC(=O)COc1cccc(F)c1 Amb24556324 [0,1,0,0,0,1|2,0,0]=4 5276 B13R1.15 ONC(=O)COc1cccc(I)c1 Amb25852475 [0,1,0,0,0,1|2,0,0]=4 5277 B13R1.15 ONC(=O)CSc1cccc(Br)c1 Amb25244977 [0,1,0,0,0,1|2,0,0]=4 5278 B13R1.15 Oc1cc(CNC(=O)CBr)ccc1 Amb24553538 [0,1,0,0,0,1|2,0,0]=4 5279 B13R1.42 BrCCC(=O)NCc1ccccc1 Amb17084003 [0,1,0,0,0,1|1,0,0]=3 5280 B13R1.42 BrCCC(=O)NCc1ccccn1 Amb17332657 [0,1,0,0,0,1|2,0,0]=4 5281 B13R1.42 C/C=C/C(=O)NNc1ccccc1 Amb17777823 [0,1,0,0,0,1|2,0,0]=4 5282 B13R1.42 C=CCC(=O)OCc1ccccc1 Amb25851392 [0,1,0,0,0,1|1,0,1]=4 5283 B13R1.42 C=CNC(=O)NCc1ccccc1 Amb25110137 [0,1,0,0,0,1|1,0,1]=4 5284 B13R1.42 C=CNC(=O)OCc1ccccc1 Amb19958731 [0,1,0,0,0,1|1,0,1]=4 5285 B13R1.42 C=COC(=O)CCc1ccccc1 Amb21858909 [0,1,0,0,0,1|0,0,1]=3 5286 B13R1.42 C=COC(=O)\C=C\c1ccccc1 Amb10807746 [0,1,0,0,0,1|0,0,2]=4 5287 B13R1.42 CC#CC(=O)CCc1ccccc1 Amb17619342 [0,1,0,0,0,1|1,0,0]=3 5288 B13R1.42 CC#CC(=O)\C=C\c1ccccc1 Amb24580491 [0,1,0,0,0,1|1,0,1]=4 5289 B13R1.42 CCCC(=O)C#Cc1ccccc1 Amb17594320 [0,1,0,0,0,1|1,0,1]=4 5290 B13R1.42 CCCC(=S)NCc1ccccc1 Amb25835568 [0,1,0,0,0,1|1,1,0]=4 5291 B13R1.42 CCNC(=N)NCc1ccccc1 Amb18804667 [0,1,0,0,0,1|2,0,0]=4 5292 B13R1.42 CCNC(=O)NCc1c[n]ccc1 Amb25208970 [0,1,0,0,0,1|2,0,0]=4 5293 B13R1.42 CCNC(=O)NCc1cc[n]cc1 Amb24383174 [0,1,0,0,0,1|2,0,0]=4 5294 B13R1.42 CCNC(=O)NCc1cccc[n]1 Amb25240069 [0,1,0,0,0,1|2,0,0]=4 5295 B13R1.42 CCNC(=O)NCc1ccccc1 Amb2236980 [0,1,0,0,0,1|1,0,0]=3 5296 B13R1.42 CCNC(=O)NNc1ccccc1 Amb24710661 [0,1,0,0,0,1|2,0,0]=4 5297 B13R1.42 CCNC(=O)OCc1ccccc1 Amb24375743 [0,1,0,0,0,1|1,0,0]=3 5298 B13R1.42 CCOC(=N)CCc1cc[n]cc1 Amb24094201 [0,1,0,0,0,1|2,0,0]=4 5299 B13R1.42 CCOC(=N)CCc1ccc[n]c1 Amb24094202 [0,1,0,0,0,1|2,0,0]=4 5300 B13R1.42 CCOC(=N)CCc1cccc[n]1 Amb24094195 [0,1,0,0,0,1|2,0,0]=4 5301 B13R1.42 CCOC(=O)C#Cc1cccc[n]1 Amb24494363 [0,1,0,0,0,1|1,0,1]=4 5302 B13R1.42 CCOC(=O)CCc1[n]ccc[n]1 Amb24061350 [0,1,0,0,0,1|2,0,0]=4 5303 B13R1.42 CCOC(=O)CCc1c[n]c[n]c1 Amb23571325 [0,1,0,0,0,1|2,0,0]=4 5304 B13R1.42 CCOC(=O)CNc1ccc[n]c1 Amb24180824 [0,1,0,0,0,1|1,0,0]=3 5305 B13R1.42 CCOC(=O)CNc1cccc[n]1 Amb18181060 [0,1,0,0,0,1|1,0,0]=3 5306 B13R1.42 CCOC(=O)CNc1ccccc1 Amb1025527 [0,1,0,0,0,1|0,0,0]=2 5307 B13R1.42 CCOC(=O)CNc1ccccc1 Amb21961619 [0,1,0,0,0,1|0,0,0]=2 5308 B13R1.42 CCOC(=O)COc1cccc[n]1 Amb22493952 [0,1,0,0,0,1|1,0,0]=3 5309 B13R1.42 CCOC(=O)CSc1cc[n]cc1 Amb24103490 [0,1,0,0,0,1|1,0,0]=3 5310 B13R1.42 CCOC(=O)CSc1ccc[n]c1 Amb24103483 [0,1,0,0,0,1|1,0,0]=3 5311 B13R1.42 CCOC(=O)CSc1ccccc1 Amb2408276 [0,1,0,0,0,1|0,0,0]=2 5312 B13R1.42 CCOC(=O)NCc1c[n]cc[n]1 Amb24103463 [0,1,0,0,0,1|2,0,0]=4 5313 B13R1.42 CCOC(=O)NCc1ccccn1 Amb10553732 [0,1,0,0,0,1|1,0,0]=3 5314 B13R1.42 CCOC(=O)NNc1cc[n]cc1 Amb24530140 [0,1,0,0,0,1|2,0,0]=4 5315 B13R1.42 CCOC(=O)NNc1cccc[n]1 Amb25681252 [0,1,0,0,0,1|2,0,0]=4 5316 B13R1.42 CCOC(=O)NSc1cccc[n]1 Amb24103464 [0,1,0,0,0,1|2,0,0]=4 5317 B13R1.42 CCOC(=O)\C=C/c1ccccc1 Amb17613997 [0,1,0,0,0,1|0,0,1]=3 5318 B13R1.42 CCOC(=O)\C=C\c1ccccn1 Amb15695131 [0,1,0,0,0,1|1,0,1]=4 5319 B13R1.42 CCOC(=O)\C=C\c1cccnc1 Amb15695192 [0,1,0,0,0,1|1,0,1]=4 5320 B13R1.42 CCOC(=S)NCc1ccccc1 Amb25313123 [0,1,0,0,0,1|0,1,0]=3 5321 B13R1.42 CCOC(=S)SCc1ccccc1 Amb10560707 [0,1,0,0,0,1|0,1,0]=3 5322 B13R1.42 CCO\C(\N)=N\Cc1ccccc1 Amb25138606 [0,1,0,0,0,1|1,0,0]=3 5323 B13R1.42 CCSC(=N)NCc1ccccc1 Amb24399348 [0,1,0,0,0,1|1,1,0]=4 5324 B13R1.42 CCSC(=S)NCc1ccccc1 Amb24490280 [0,1,0,0,0,1|0,2,0]=4 5325 B13R1.42 CNCC(=O)C#Cc1ccccc1 Amb24383348 [0,1,0,0,0,1|1,0,1]=4 5326 B13R1.42 CNCC(=O)NCc1cc[n]cc1 Amb21959082 [0,1,0,0,0,1|2,0,0]=4 5327 B13R1.42 CNCC(=O)NCc1ccc[n]c1 Amb21959052 [0,1,0,0,0,1|2,0,0]=4 5328 B13R1.42 CNCC(=O)NCc1cccc[n]1 Amb21959066 [0,1,0,0,0,1|2,0,0]=4 5329 B13R1.42 CNCC(=O)NCc1ccccc1 Amb21959039 [0,1,0,0,0,1|1,0,0]=3 5330 B13R1.42 CNCC(=O)NCc1ccccn1 Amb19136229 [0,1,0,0,0,1|2,0,0]=4 5331 B13R1.42 CNCC(=O)NCc1cccnc1 Amb19134439 [0,1,0,0,0,1|2,0,0]=4 5332 B13R1.42 CNCC(=O)NNc1ccccc1 Amb24735727 [0,1,0,0,0,1|2,0,0]=4 5333 B13R1.42 CNCC(=O)OCc1ccccc1 Amb18809175 [0,1,0,0,0,1|1,0,0]=3 5334 B13R1.42 CNCC(=O)OCc1ccccc1 Amb21929370 [0,1,0,0,0,1|1,0,0]=3 5335 B13R1.42 CNCC(=O)OCc1ccccc1 Amb22002169 [0,1,0,0,0,1|1,0,0]=3 5336 B13R1.42 COCC(=O)CCc1ccccc1 Amb10563175 [0,1,0,0,0,1|0,0,0]=2 5337 B13R1.42 COCC(=O)NCc1cccc[n]1 Amb23247506 [0,1,0,0,0,1|1,0,0]=3 5338 B13R1.42 COCC(=O)NNc1c[n]ccc1 Amb24720639 [0,1,0,0,0,1|2,0,0]=4 5339 B13R1.42 COCC(=O)NNc1cccc[n]1 Amb24416587 [0,1,0,0,0,1|2,0,0]=4 5340 B13R1.42 COCC(=O)NNc1ccccc1 Amb25052871 [0,1,0,0,0,1|1,0,0]=3 5341 B13R1.42 CONC(=N)NCc1ccccc1 Amb25102772 [0,1,0,0,0,1|1,0,0]=3 5342 B13R1.42 CONC(=O)CCc1ccccc1 Amb10705059 [0,1,0,0,0,1|0,0,0]=2 5343 B13R1.42 CONC(=O)NCc1c[n]ccc1 Amb25256484 [0,1,0,0,0,1|1,0,0]=3 5344 B13R1.42 CONC(=O)NCc1cccc[n]1 Amb25343526 [0,1,0,0,0,1|1,0,0]=3 5345 B13R1.42 CONC(=O)NCc1ccccc1 Amb16969954 [0,1,0,0,0,1|0,0,0]=2 5346 B13R1.42 CONC(=O)OCc1ccccc1 Amb16969956 [0,1,0,0,0,1|0,0,0]=2 5347 B13R1.42 CONC(=O)\C=C\c1cc[n]cc1 Amb24450719 [0,1,0,0,0,1|1,0,1]=4 5348 B13R1.42 CSCC(=O)C#Cc1ccccc1 Amb24440307 [0,1,0,0,0,1|0,1,1]=4 5349 B13R1.42 CSCC(=O)NCc1ccccc1 Amb19382179 [0,1,0,0,0,1|0,1,0]=3 5350 B13R1.42 CSCC(=O)NCc1ccccn1 Amb13956778 [0,1,0,0,0,1|1,1,0]=4 5351 B13R1.42 CSCC(=O)NCc1cccnc1 Amb13956796 [0,1,0,0,0,1|1,1,0]=4 5352 B13R1.42 CSCC(=O)NNc1ccccc1 Amb25145264 [0,1,0,0,0,1|1,1,0]=4 5353 B13R1.42 C\C(\CNc1ccccc1)=C\SC Amb24710304 [0,1,0,0,0,1|1,1,0]=4 5354 B13R1.42 C\C(\COC)=N/Nc1ccccc1 Amb25706754 [0,1,0,0,0,1|2,0,0]=4 5355 B13R1.42 C\C=C/C(=O)NCc1ccccc1 Amb24432668 [0,1,0,0,0,1|1,0,0]=3 5356 B13R1.42 C\C=C/C(=O)\C=C\c1ccccc1 Amb25093685 [0,1,0,0,0,1|1,0,1]=4 5357 B13R1.42 C\C=C\C(=O)NCc1ccccc1 Amb1196143 [0,1,0,0,0,1|1,0,0]=3 5358 B13R1.42 C\C=C\C(=O)OCc1ccccc1 Amb10572342 [0,1,0,0,0,1|1,0,0]=3 5359 B13R1.42 ClCCC(=O)NCc1ccccc1 Amb1931859 [0,1,0,0,0,1|1,0,0]=3 5360 B13R1.42 ClCCC(=O)NCc1ccccn1 Amb1141475 [0,1,0,0,0,1|2,0,0]=4 5361 B13R1.42 N#CCC(=O)COc1ccccc1 Amb17233063 [0,1,0,0,0,1|1,0,1]=4 5362 B13R1.42 N#CNC(=O)CCc1ccccc1 Amb25180730 [0,1,0,0,0,1|1,0,1]=4 5363 B13R1.42 N#CNC(=O)CNc1ccccc1 Amb24621413 [0,1,0,0,0,1|1,0,1]=4 5364 B13R1.42 N#CNC(=O)CSc1ccccc1 Amb24453480 [0,1,0,0,0,1|1,0,1]=4 5365 B13R1.42 N#CNC(=O)NCc1ccccc1 Amb25158282 [0,1,0,0,0,1|1,0,1]=4 5366 B13R1.42 N#CNC(=O)OCc1ccccc1 Amb25700802 [0,1,0,0,0,1|1,0,1]=4 5367 B13R1.42 NCCC(=O)NCc1cc[n]cc1 Amb21959083 [0,1,0,0,0,1|2,0,0]=4 5368 B13R1.42 NCCC(=O)NCc1cccc[n]1 Amb21959067 [0,1,0,0,0,1|2,0,0]=4 5369 B13R1.42 NCCC(=O)NCc1ccccc1 Amb15740949 [0,1,0,0,0,1|1,0,0]=3 5370 B13R1.42 NCCC(=O)NCc1ccccn1 Amb1125075 [0,1,0,0,0,1|2,0,0]=4 5371 B13R1.42 NCCC(=O)NCc1cccnc1 Amb10610041 [0,1,0,0,0,1|2,0,0]=4 5372 B13R1.42 NCCC(=O)NCc1cccnc1 Amb10610056 [0,1,0,0,0,1|2,0,0]=4 5373 B13R1.42 NCCC(=O)OCc1ccccc1 Amb15690782 [0,1,0,0,0,1|1,0,0]=3 5374 B13R1.42 NCCC(=O)OCc1ccccc1 Amb20626398 [0,1,0,0,0,1|1,0,0]=3 5375 B13R1.42 NCNC(=O)OCc1ccccc1 Amb10558226 [0,1,0,0,0,1|1,0,0]=3 5376 B13R1.42 NNCC(=O)OCc1ccccc1 Amb25855211 [0,1,0,0,0,1|2,0,0]=4 5377 B13R1.42 NOCC(=O)NCc1ccccc1 Amb25127330 [0,1,0,0,0,1|1,0,0]=3 5378 B13R1.42 NOCC(=O)OCc1ccccc1 Amb25815887 [0,1,0,0,0,1|1,0,0]=3 5379 B13R1.42 O/C=C/C(=O)CCc1ccccc1 Amb17777852 [0,1,0,0,0,1|1,0,1]=4 5380 B13R1.42 O=C(CC=O)OCc1ccccc1 Amb18128117 [0,1,0,0,0,1|1,0,1]=4 5381 B13R1.42 O=C(CCBr)C#Cc1ccccc1 Amb24379645 [0,1,0,0,0,1|1,0,1]=4 5382 B13R1.42 O=C(CCBr)OCc1ccccc1 Amb22232000 [0,1,0,0,0,1|1,0,0]=3 5383 B13R1.42 O=C(CCCl)C#Cc1ccccc1 Amb24431018 [0,1,0,0,0,1|1,0,1]=4 5384 B13R1.42 O=C(CCF)OCc1ccccc1 Amb22497154 [0,1,0,0,0,1|1,0,0]=3 5385 B13R1.42 O=C(CCS)OCc1ccccc1 Amb24495479 [0,1,0,0,0,1|1,0,0]=3 5386 B13R1.42 O=C(CCc1ccccc1)NC=O Amb25267494 [0,1,0,0,0,1|1,0,1]=4 5387 B13R1.42 O=C(CSc1ccccc1)NC=O Amb24096614 [0,1,0,0,0,1|1,0,1]=4 5388 B13R1.42 O=C(N=C=S)OCc1ccccc1 Amb19878044 [0,1,0,0,0,1|1,0,1]=4 5389 B13R1.42 O=C(NCCl)OCc1ccccc1 Amb25783886 [0,1,0,0,0,1|1,0,0]=3 5390 B13R1.42 O=C(NCc1ccccc1)OCCl Amb24635651 [0,1,0,0,0,1|0,0,0]=2 5391 B13R1.42 O=C(NCc1ccccc1)OCF Amb25090863 [0,1,0,0,0,1|0,0,0]=2 5392 B13R1.42 O=C=NC(=O)CCc1ccccc1 Amb17233062 [0,1,0,0,0,1|1,0,1]=4 5393 B13R1.42 O=C=NC(=O)COc1ccccc1 Amb17233239 [0,1,0,0,0,1|1,0,1]=4 5394 B13R1.42 OCCC(=O)NCc1ccccc1 Amb17335299 [0,1,0,0,0,1|1,0,0]=3 5395 B13R1.42 OCCC(=O)NCc1ccccn1 Amb17335412 [0,1,0,0,0,1|2,0,0]=4 5396 B13R1.42 OCCC(=O)NCc1cccnc1 Amb17335413 [0,1,0,0,0,1|2,0,0]=4 5397 B13R1.42 OCCC(=O)NCc1ccncc1 Amb17335414 [0,1,0,0,0,1|2,0,0]=4 5398 B13R1.42 OCCC(=O)OCc1ccccc1 Amb17609079 [0,1,0,0,0,1|1,0,0]=3 5399 B13R1.42 OCNC(=O)OCc1ccccc1 Amb10066979 [0,1,0,0,0,1|1,0,0]=3 5400 B13R1.42 S=C=NC(=O)COc1ccccc1 Amb1115672 [0,1,0,0,0,1|1,0,1]=4 5401 B13R1.42 [N-]=[N+]=NC(=O)NCc1ccccc1 Amb24753861 [0,1,0,0,0,1|2,0,0]=4 5402 B13R1.42 [N-]=[N+]=NC(=O)OCc1ccccc1 Amb25269579 [0,1,0,0,0,1|2,0,0]=4 5403 B13R1.42 [O-]/C=C/C(=O)CCc1ccccc1 Amb17777853 [0,1,0,0,0,1|1,0,1]=4 5404 B13R1.135 BrCC(=O)N(Cc1ccccc1)C Amb17332398 [0,1,0,0,0,1|2,0,0]=4 5405 B13R1.135 C=CC(=O)C(Cc1ccccc1)O Amb10562284 [0,1,0,0,0,1|1,0,1]=4 5406 B13R1.135 CC(Cc1ccccc1)C(=O)C#N Amb24492792 [0,1,0,0,0,1|2,0,0]=4 5407 B13R1.135 CC(Cc1ccccc1)C(=O)NN Amb24501376 [0,1,0,0,0,1|2,0,0]=4 5408 B13R1.135 CC(OC)C(C)Nc1ccccc1 Amb24355037 [0,1,0,0,0,1|1,0,1]=4 5409 B13R1.135 CCC(=N)N(C)Cc1ccccc1 Amb25319137 [0,1,0,0,0,1|2,0,0]=4 5410 B13R1.135 CCC(=O)C(=O)Nc1ccccc1 Amb25770102 [0,1,0,0,0,1|1,0,1]=4 5411 B13R1.135 CCC(=O)C(Cc1ccccc1)C Amb17233202 [0,1,0,0,0,1|1,0,0]=3 5412 B13R1.135 CCC(=O)\C(=C/c1ccccc1)\C Amb10565329 [0,1,0,0,0,1|1,0,1]=4 5413 B13R1.135 CCC(=O)\C(\F)=C\c1ccccc1 Amb25706957 [0,1,0,0,0,1|1,0,1]=4 5414 B13R1.135 CN(Cc1ccc[n]c1)C(=O)NC Amb25106777 [0,1,0,0,0,1|2,0,0]=4 5415 B13R1.135 CN(Cc1ccccc1)C(=N)NC Amb18804661 [0,1,0,0,0,1|2,0,0]=4 5416 B13R1.135 CN(Cc1ccccc1)C(=O)C=O Amb24490334 [0,1,0,0,0,1|2,0,0]=4 5417 B13R1.135 CN(Cc1ccccc1)C(=O)CN Amb21958324 [0,1,0,0,0,1|2,0,0]=4 5418 B13R1.135 CN(Cc1ccccc1)C(=S)NC Amb25211263 [0,1,0,0,0,1|1,1,0]=4 5419 B13R1.135 CN(OC)C(=O)Cc1ccccc1 Amb20673721 [0,1,0,0,0,1|2,0,0]=4 5420 B13R1.135 CNC(=O)C(=O)Cc1ccccc1 Amb17400596 [0,1,0,0,0,1|1,0,0]=3 5421 B13R1.135 CNC(=O)C(=O)Nc1ccccc1 Amb1798389 [0,1,0,0,0,1|1,0,1]=4 5422 B13R1.135 CNC(=O)C(C)Nc1cc[n]cc1 Amb18978321 [0,1,0,0,0,1|2,0,0]=4 5423 B13R1.135 CNC(=O)C(C)Nc1cccc[n]1 Amb18978306 [0,1,0,0,0,1|2,0,0]=4 5424 B13R1.135 CNC(=O)C(C)Oc1cccc[n]1 Amb25261720 [0,1,0,0,0,1|2,0,0]=4 5425 B13R1.135 CNC(=O)C(Cl)Cc1ccccc1 Amb19083267 [0,1,0,0,0,1|1,0,0]=3 5426 B13R1.135 CNC(=O)C(F)Cc1ccccc1 Amb24343289 [0,1,0,0,0,1|1,0,0]=3 5427 B13R1.135 CNC(=O)C(N)Cc1ccccc1 Amb21958546 [0,1,0,0,0,1|1,0,0]=3 5428 B13R1.135 CNC(=O)C(Sc1ccccn1)C Amb10679142 [0,1,0,0,0,1|2,0,0]=4 5429 B13R1.135 CNC(=O)[C@@H](C)Cc1ccccc1 Amb25271724 [0,1,0,0,0,1|1,0,0]=3 5430 B13R1.135 CNC(=O)[C@@H](Cc1ccccc1)N Amb10608885 [0,1,0,0,0,1|1,0,0]=3 5431 B13R1.135 CNC(=O)[C@@H](Cl)Cc1ccccc1 Amb25774522 [0,1,0,0,0,1|1,0,0]=3 5432 B13R1.135 CNC(=O)[C@@H](O)Cc1ccccc1 Amb25212856 [0,1,0,0,0,1|1,0,0]=3 5433 B13R1.135 CNC(=O)[C@H](C)Nc1ccccc1 Amb25268956 [0,1,0,0,0,1|1,0,0]=3 5434 B13R1.135 CNC(=O)[C@H](Cc1ccccc1)N Amb10878601 [0,1,0,0,0,1|1,0,0]=3 5435 B13R1.135 CNC(=O)[C@H](Cc1ccccc1)N Amb15740701 [0,1,0,0,0,1|1,0,0]=3 5436 B13R1.135 CNC(=O)\C(\S)=C/c1ccccc1 Amb24341194 [0,1,0,0,0,1|1,0,1]=4 5437 B13R1.135 CNC(=S)C(C)Cc1ccccc1 Amb24710289 [0,1,0,0,0,1|1,1,0]=4 5438 B13R1.135 CNC(=S)N(N)Cc1ccccc1 Amb25784598 [0,1,0,0,0,1|1,1,0]=4 5439 B13R1.135 COC(=C)C(=O)Nc1ccccc1 Amb25752695 [0,1,0,0,0,1|1,0,1]=4 5440 B13R1.135 COC(=O)C(=O)Cc1ccccc1 Amb17138843 [0,1,0,0,0,1|0,0,0]=2 5441 B13R1.135 COC(=O)C(=O)Cc1ccccn1 Amb17138896 [0,1,0,0,0,1|1,0,0]=3 5442 B13R1.135 COC(=O)C(=O)Cc1cccnc1 Amb17138897 [0,1,0,0,0,1|1,0,0]=3 5443 B13R1.135 COC(=O)C(=O)Cc1ccncc1 Amb17138898 [0,1,0,0,0,1|1,0,0]=3 5444 B13R1.135 COC(=O)C(=O)Nc1c[n]ccc1 Amb24427786 [0,1,0,0,0,1|1,0,1]=4 5445 B13R1.135 COC(=O)C(=O)Nc1ccccc1 Amb24529368 [0,1,0,0,0,1|0,0,1]=3 5446 B13R1.135 COC(=O)C(C)Nc1c[n]c[n]c1 Amb18270274 [0,1,0,0,0,1|2,0,0]=4 5447 B13R1.135 COC(=O)C(C)Nc1cc[n]c[n]1 Amb18305877 [0,1,0,0,0,1|2,0,0]=4 5448 B13R1.135 COC(=O)C(C)Nc1ccc[n][n]1 Amb18312790 [0,1,0,0,0,1|2,0,0]=4 5449 B13R1.135 COC(=O)C(C)Nc1ccc[n]c1 Amb18270387 [0,1,0,0,0,1|1,0,0]=3 5450 B13R1.135 COC(=O)C(Cc1ccccc1)Cl Amb17204377 [0,1,0,0,0,1|0,0,0]=2 5451 B13R1.135 COC(=O)C(Cc1ccccc1)N Amb1779248 [0,1,0,0,0,1|0,0,0]=2 5452 B13R1.135 COC(=O)C(Cc1ccccc1)O Amb17138951 [0,1,0,0,0,1|0,0,0]=2 5453 B13R1.135 COC(=O)C(Cc1ccccn1)O Amb17138998 [0,1,0,0,0,1|1,0,0]=3 5454 B13R1.135 COC(=O)C(Cc1cccnc1)O Amb17138999 [0,1,0,0,0,1|1,0,0]=3 5455 B13R1.135 COC(=O)C(Cc1ccncc1)O Amb17139000 [0,1,0,0,0,1|1,0,0]=3 5456 B13R1.135 COC(=O)C(N)Cc1ccccc1 Amb22489492 [0,1,0,0,0,1|0,0,0]=2 5457 B13R1.135 COC(=O)[C@@H](Cc1cccnc1)N Amb15691971 [0,1,0,0,0,1|1,0,0]=3 5458 B13R1.135 COC(=O)[C@@H](N)Cc1ccc[n]c1 Amb22756662 [0,1,0,0,0,1|1,0,0]=3 5459 B13R1.135 COC(=O)[C@@H](N)Cc1cccc[n]1 Amb22745828 [0,1,0,0,0,1|1,0,0]=3 5460 B13R1.135 COC(=O)[C@H](C)Nc1ccccc1 Amb25732039 [0,1,0,0,0,1|0,0,0]=2 5461 B13R1.135 COC(=O)\C(\Br)=C\c1ccccc1 Amb24331619 [0,1,0,0,0,1|0,0,1]=3 5462 B13R1.135 COC(=O)\C(\F)=C\c1ccccc1 Amb25706644 [0,1,0,0,0,1|0,0,1]=3 5463 B13R1.135 C[C@@H](Cc1ccccc1)C(=O)NO Amb24408073 [0,1,0,0,0,1|2,0,0]=4 5464 B13R1.135 C[C@H](Cc1ccccc1)C(=O)C#C Amb24379008 [0,1,0,0,0,1|1,0,1]=4 5465 B13R1.135 C[C@H](Cc1ccccc1)C(=O)NO Amb25370073 [0,1,0,0,0,1|2,0,0]=4 5466 B13R1.135 C\C(=C/C)\C(=O)Cc1ccccc1 Amb24721728 [0,1,0,0,0,1|2,0,0]=4 5467 B13R1.135 C\C(=C/C)\[C@H](C)Nc1ccccc1 Amb25180843 [0,1,0,0,0,1|2,0,0]=4 5468 B13R1.135 C\C(=C\C)\C(=O)Cc1ccccc1 Amb25245373 [0,1,0,0,0,1|2,0,0]=4 5469 B13R1.135 C\C(=C\C)\C(C)Nc1ccccc1 Amb24743269 [0,1,0,0,0,1|2,0,0]=4 5470 B13R1.135 C\C=C(/Cl)\C(C)Nc1ccccc1 Amb24595467 [0,1,0,0,0,1|2,0,0]=4 5471 B13R1.135 C\C=C(\Cl)/C(C)Nc1ccccc1 Amb24519547 [0,1,0,0,0,1|2,0,0]=4 5472 B13R1.135 ClCC(=O)C(Oc1ccccc1)C Amb17139731 [0,1,0,0,0,1|2,0,0]=4 5473 B13R1.135 ClCC(=O)N(Cc1ccccc1)C Amb1204773 [0,1,0,0,0,1|2,0,0]=4 5474 B13R1.135 NC(Cc1ccccc1)C(=O)NO Amb22349822 [0,1,0,0,0,1|2,0,0]=4 5475 B13R1.135 NNC(=O)C(Cc1ccccc1)N Amb16231875 [0,1,0,0,0,1|2,0,0]=4 5476 B13R1.135 NNC(=O)C(O)Cc1ccccc1 Amb25129792 [0,1,0,0,0,1|2,0,0]=4 5477 B13R1.135 NNC(=O)C(Oc1ccccc1)C Amb2553856 [0,1,0,0,0,1|2,0,0]=4 5478 B13R1.135 NNC(=O)C(S)Cc1ccccc1 Amb24501331 [0,1,0,0,0,1|2,0,0]=4 5479 B13R1.135 NNC(=O)[C@@H](N)Cc1ccccc1 Amb22800040 [0,1,0,0,0,1|2,0,0]=4 5480 B13R1.135 N[C@@H](Cc1ccccc1)C(=O)NO Amb25268143 [0,1,0,0,0,1|2,0,0]=4 5481 B13R1.135 N[C@H](Cc1ccccc1)C(=O)CCl Amb20243107 [0,1,0,0,0,1|2,0,0]=4 5482 B13R1.135 ON(Cc1ccccc1)C(=O)CCl Amb25053857 [0,1,0,0,0,1|2,0,0]=4 5483 B13R1.135 ONC(=O)C(O)Cc1ccccc1 Amb25752983 [0,1,0,0,0,1|2,0,0]=4 5484 B13R1.254 CCS(=O)(=O)CNc1ccccc1 Amb24648823 [0,1,0,0,0,1|2,0,0]=4 5485 B13R1.254 CCS(=O)(=O)NCc1ccccc1 Amb17791027 [0,1,0,0,0,1|2,0,0]=4 5486 B13R1.254 CNS(=O)(=O)NCc1ccccc1 Amb16951866 [0,1,0,0,0,1|2,0,0]=4 5487 B13R1.254 COC(C)(C)CNc1ccccc1 Amb24440309 [0,1,0,0,0,1|1,0,1]=4 5488 B13R1.254 CO[Si](C)(C)CNc1ccccc1 Amb24578795 [0,1,0,0,0,1|1,1,0]=4 5489 B13R1.351 CC(=C)C(=C)CNc1ccccc1 Amb24664158 [0,1,0,0,0,1|2,0,0]=4 5490 B13R1.351 CC(=C)C(=O)\C=C\c1ccccc1 Amb24357139 [0,1,0,0,0,1|1,0,1]=4 5491 B13R1.351 CC(=C)C(=S)NCc1ccccc1 Amb24366057 [0,1,0,0,0,1|1,1,0]=4 5492 B13R1.351 CC(=O)C(=O)CNc1ccccc1 Amb25123358 [0,1,0,0,0,1|1,0,0]=3 5493 B13R1.351 CC(=O)C(=O)NCc1ccccn1 Amb17400654 [0,1,0,0,0,1|2,0,0]=4 5494 B13R1.351 CC(=O)C(=O)NCc1cccnc1 Amb17400655 [0,1,0,0,0,1|2,0,0]=4 5495 B13R1.351 CC(=O)C(=O)NNc1ccccc1 Amb25128271 [0,1,0,0,0,1|2,0,0]=4 5496 B13R1.351 CC(=O)C(=O)OCc1ccccc1 Amb24740169 [0,1,0,0,0,1|1,0,0]=3 5497 B13R1.351 CC(=O)C(=O)\C=C\c1ccccc1 Amb24697906 [0,1,0,0,0,1|1,0,1]=4 5498 B13R1.351 CC(Br)C(=O)OCc1ccccc1 Amb22054568 [0,1,0,0,0,1|1,0,0]=3 5499 B13R1.351 CC(C(=O)NCc1ccccc1)C Amb1806323 [0,1,0,0,0,1|1,0,0]=3 5500 B13R1.351 CC(C(=O)NCc1ccccc1)Cl Amb1208021 [0,1,0,0,0,1|1,0,0]=3 5501 B13R1.351 CC(C(=O)NCc1ccccc1)N Amb10610119 [0,1,0,0,0,1|1,0,0]=3 5502 B13R1.351 CC(C(=O)NCc1ccccc1)O Amb10766141 [0,1,0,0,0,1|1,0,0]=3 5503 B13R1.351 CC(C(=O)NCc1ccncc1)Br Amb17330605 [0,1,0,0,0,1|2,0,0]=4 5504 B13R1.351 CC(C(=O)NCc1ccncc1)O Amb17400770 [0,1,0,0,0,1|2,0,0]=4 5505 B13R1.351 CC(C(=O)OCc1ccccc1)N Amb17335303 [0,1,0,0,0,1|1,0,0]=3 5506 B13R1.351 CC(C)=C(C)CNc1ccccc1 Amb25191847 [0,1,0,0,0,1|2,0,0]=4 5507 B13R1.351 CC(C)C(=O)NOc1ccccc1 Amb24421311 [0,1,0,0,0,1|2,0,0]=4 5508 B13R1.351 CC(C)C(=O)\C=C/c1ccccc1 Amb24730292 [0,1,0,0,0,1|1,0,1]=4 5509 B13R1.351 CC(C)C(=O)\C=C\c1ccccc1 Amb22343050 [0,1,0,0,0,1|1,0,1]=4 5510 B13R1.351 CC(Cl)C(=O)C#Cc1ccccc1 Amb25227422 [0,1,0,0,0,1|1,0,1]=4 5511 B13R1.351 CC(N)C(=O)NCc1cc[n]cc1 Amb21959081 [0,1,0,0,0,1|2,0,0]=4 5512 B13R1.351 CC(N)C(=O)NCc1ccc[n]c1 Amb21959051 [0,1,0,0,0,1|2,0,0]=4 5513 B13R1.351 CC(N)C(=O)NCc1cccc[n]1 Amb21959065 [0,1,0,0,0,1|2,0,0]=4 5514 B13R1.351 CC(N)C(=O)NNc1ccccc1 Amb24490065 [0,1,0,0,0,1|2,0,0]=4 5515 B13R1.351 CC(N)C(=O)OCc1ccccc1 Amb22233549 [0,1,0,0,0,1|1,0,0]=3 5516 B13R1.351 CC(N)C(=O)\C=C\c1ccccc1 Amb25122759 [0,1,0,0,0,1|1,0,1]=4 5517 B13R1.351 CC(O)C(=O)O[Hg]c1ccccc1 Amb22345872 [0,1,0,0,0,1|2,0,0]=4 5518 B13R1.351 CC(O)C(=O)\C=C\c1ccccc1 Amb24534525 [0,1,0,0,0,1|1,0,1]=4 5519 B13R1.351 CC(S)C(=O)NCc1cc[n]cc1 Amb25769231 [0,1,0,0,0,1|2,0,0]=4 5520 B13R1.351 CC(S)C(=O)NCc1ccc[n]c1 Amb25333004 [0,1,0,0,0,1|2,0,0]=4 5521 B13R1.351 CC(S)C(=O)OCc1ccccc1 Amb25058345 [0,1,0,0,0,1|1,0,0]=3 5522 B13R1.351 CN(C(=O)C#Cc1ccccc1)C Amb2106663 [0,1,0,0,0,1|1,0,1]=4 5523 B13R1.351 CN(C(=S)NCc1ccccc1)C Amb1207999 [0,1,0,0,0,1|1,1,0]=4 5524 B13R1.351 CN(C(=S)NCc1ccccc1)C Amb13951091 [0,1,0,0,0,1|1,1,0]=4 5525 B13R1.351 CN(C(=S)NCc1ccccc1)N Amb1104580 [0,1,0,0,0,1|1,1,0]=4 5526 B13R1.351 CN(C)C(=O)NCc1cccc[n]1 Amb25820141 [0,1,0,0,0,1|2,0,0]=4 5527 B13R1.351 CN(C)C(=O)NNc1ccccc1 Amb24689139 [0,1,0,0,0,1|2,0,0]=4 5528 B13R1.351 CN(C)C(=[NH2+])SCc1ccccc1 Amb22465210 [0,1,0,0,0,1|2,0,0]=4 5529 B13R1.351 CN(N)C(=O)OCc1ccccc1 Amb19959276 [0,1,0,0,0,1|1,0,0]=3 5530 B13R1.351 CN(O)C(=O)NCc1ccccc1 Amb24595889 [0,1,0,0,0,1|1,0,0]=3 5531 B13R1.351 CN(O)C(=O)NNc1ccccc1 Amb25350874 [0,1,0,0,0,1|2,0,0]=4 5532 B13R1.351 C[C@@H](C(=O)OCc1ccccc1)N Amb2404812 [0,1,0,0,0,1|1,0,0]=3 5533 B13R1.351 C[C@@H](Cl)C(=O)NCc1ccccc1 Amb25188021 [0,1,0,0,0,1|1,0,0]=3 5534 B13R1.351 C[C@@H](N)C(=O)NCc1cc[n]cc1 Amb18527903 [0,1,0,0,0,1|2,0,0]=4 5535 B13R1.351 C[C@@H](N)C(=O)NCc1ccc[n]c1 Amb18527902 [0,1,0,0,0,1|2,0,0]=4 5536 B13R1.351 C[C@@H](N)C(=O)NCc1cccc[n]1 Amb18527901 [0,1,0,0,0,1|2,0,0]=4 5537 B13R1.351 C[C@@H](N)C(=O)NCc1ccccc1 Amb18014651 [0,1,0,0,0,1|1,0,0]=3 5538 B13R1.351 C[C@@H](N)C(=O)NNc1ccccc1 Amb25029960 [0,1,0,0,0,1|2,0,0]=4 5539 B13R1.351 C[C@@H](N)C(=O)\C=C\c1ccccc1 Amb24512077 [0,1,0,0,0,1|1,0,1]=4 5540 B13R1.351 C[C@@H](O)C(=O)NCc1cc[n]cc1 Amb24459060 [0,1,0,0,0,1|2,0,0]=4 5541 B13R1.351 C[C@@H](O)C(=O)NCc1ccc[n]c1 Amb25749540 [0,1,0,0,0,1|2,0,0]=4 5542 B13R1.351 C[C@@H](O)C(=O)OCc1ccccc1 Amb22801052 [0,1,0,0,0,1|1,0,0]=3 5543 B13R1.351 C[C@@H](O)C(=O)\C=C\c1ccccc1 Amb25766283 [0,1,0,0,0,1|1,0,1]=4 5544 B13R1.351 C[C@H](C(=O)OCc1ccccc1)N Amb16183910 [0,1,0,0,0,1|1,0,0]=3 5545 B13R1.351 C[C@H](C(=O)OCc1ccccc1)N Amb17607755 [0,1,0,0,0,1|1,0,0]=3 5546 B13R1.351 C[C@H](N)C(=O)NNc1ccccc1 Amb24710147 [0,1,0,0,0,1|2,0,0]=4 5547 B13R1.351 C[C@H](N)C(=O)\C=C\c1ccccc1 Amb25200964 [0,1,0,0,0,1|1,0,1]=4 5548 B13R1.351 C[C@H](O)C(=O)NCc1ccc[n]c1 Amb25066064 [0,1,0,0,0,1|2,0,0]=4 5549 B13R1.351 C[C@H](O)C(=O)NCc1ccccc1 Amb24452587 [0,1,0,0,0,1|1,0,0]=3 5550 B13R1.351 C[C@H](O)C(=O)NNc1ccccc1 Amb24351965 [0,1,0,0,0,1|2,0,0]=4 5551 B13R1.351 C\C(=C/Cc1ccccc1)\C(C)=O Amb24529690 [0,1,0,0,0,1|2,0,0]=4 5552 B13R1.351 C\C(=C/Cc1ccccc1)\C(C)N Amb24381566 [0,1,0,0,0,1|2,0,0]=4 5553 B13R1.351 C\C(=N/Cc1ccccc1)\C(C)=O Amb25130600 [0,1,0,0,0,1|2,0,0]=4 5554 B13R1.351 FC(C(=O)OCc1ccccc1)Cl Amb10841341 [0,1,0,0,0,1|2,0,0]=4 5555 B13R1.351 NC(=O)C(=O)CCc1ccccc1 Amb24273105 [0,1,0,0,0,1|2,0,0]=4 5556 B13R1.351 NC(=O)C(=O)NCc1ccccc1 Amb25858184 [0,1,0,0,0,1|2,0,0]=4 5557 B13R1.351 NC(=S)C(=O)OCc1ccccc1 Amb25836805 [0,1,0,0,0,1|2,0,0]=4 5558 B13R1.351 O=C(C(=C)C)OCc1ccccc1 Amb10807491 [0,1,0,0,0,1|1,0,0]=3 5559 B13R1.351 O=C(C(=O)C)C#Cc1ccccc1 Amb10562238 [0,1,0,0,0,1|1,0,1]=4 5560 B13R1.351 O=C(C(=O)C)NCc1ccccc1 Amb17400597 [0,1,0,0,0,1|1,0,0]=3 5561 B13R1.351 O=C(C(=O)C)NCc1ccncc1 Amb17400656 [0,1,0,0,0,1|2,0,0]=4 5562 B13R1.351 O=C(C(Br)C)NCc1ccccn1 Amb17323765 [0,1,0,0,0,1|2,0,0]=4 5563 B13R1.351 O=C(C(Br)C)NCc1cccnc1 Amb17327908 [0,1,0,0,0,1|2,0,0]=4 5564 B13R1.351 O=C(C(C)C)NCc1cccnc1 Amb1197112 [0,1,0,0,0,1|2,0,0]=4 5565 B13R1.351 O=C(C(Cl)C)NCc1ccccn1 Amb1141726 [0,1,0,0,0,1|2,0,0]=4 5566 B13R1.351 O=C(C(O)C)NCc1ccccn1 Amb17400768 [0,1,0,0,0,1|2,0,0]=4 5567 B13R1.351 O=C(C(O)C)NCc1cccnc1 Amb17400769 [0,1,0,0,0,1|2,0,0]=4 5568 B13R1.351 O=C(N(C)C)NCc1cccnc1 Amb2572903 [0,1,0,0,0,1|2,0,0]=4 5569 B13R1.351 O=C(NCc1ccccc1)C(F)Cl Amb25289199 [0,1,0,0,0,1|2,0,0]=4 5570 B13R1.351 O=C(OCc1ccccc1)C(=O)Cl Amb24687217 [0,1,0,0,0,1|2,0,0]=4 5571 B13R1.351 O=C(OCc1ccccc1)C(F)F Amb25163661 [0,1,0,0,0,1|2,0,0]=4 5572 B13R1.351 O=C([C@H]([NH3+])C)OCc1ccccc1 Amb10807781 [0,1,0,0,0,1|1,0,0]=3 5573 B13R1.351 OC(=O)C(=O)OCc1ccccc1 Amb18128558 [0,1,0,0,0,1|2,0,0]=4 5574 B13R1.417 CCC(C=O)OCc1ccccc1 Amb18128222 [0,1,0,0,0,1|1,0,1]=4 5575 B13R1.417 CC\C(\C=O)=C/Nc1ccccc1 Amb18127492 [0,1,0,0,0,1|1,0,1]=4 5576 B13R1.417 CC\C(\C=O)=C\Nc1ccccc1 Amb24728250 [0,1,0,0,0,1|1,0,1]=4 5577 B13R1.417 CC\C(\C=O)=N\Nc1ccccc1 Amb25695960 [0,1,0,0,0,1|2,0,0]=4 5578 B13R1.417 CNC(COc1ccccc1)=NN Amb18178703 [0,1,0,0,0,1|2,0,0]=4 5579 B13R1.417 CNC(NC)=NCc1ccccc1 Amb24074079 [0,1,0,0,0,1|2,0,0]=4 5580 B13R1.417 CNC(NCc1ccccc1)=NC Amb20627624 [0,1,0,0,0,1|2,0,0]=4 5581 B13R1.417 CN\C(=N\Cc1ccccc1)\SC Amb24552832 [0,1,0,0,0,1|1,1,0]=4 5582 B13R1.417 CN\C(\CCc1ccccc1)=N/C Amb25155427 [0,1,0,0,0,1|2,0,0]=4 5583 B13R1.417 CN\C(\CCc1ccccc1)=N/N Amb18178423 [0,1,0,0,0,1|2,0,0]=4 5584 B13R1.417 COC(=CCc1ccccc1)OC Amb22546894 [0,1,0,0,0,1|0,0,1]=3 5585 B13R1.417 COC(COc1ccccc1)OC Amb22348055 [0,1,0,0,0,1|0,0,2]=4 5586 B13R1.417 CON(CO)OCc1ccccc1 Amb25788076 [0,1,0,0,0,1|1,0,1]=4 5587 B13R1.417 CO\C(\C=O)=C\Nc1ccccc1 Amb24564475 [0,1,0,0,0,1|0,0,1]=3 5588 B13R1.417 CO\C(\NCc1ccccc1)=N\O Amb25261904 [0,1,0,0,0,1|0,0,1]=3 5589 B13R1.417 CO\C(\NN)=N\Nc1ccccc1 Amb25090460 [0,1,0,0,0,1|2,0,0]=4 5590 B13R1.417 C\C=C(\C=O)/C=C/c1ccccc1 Amb18647674 [0,1,0,0,0,1|1,0,1]=4 5591 B13R1.417 C\N=C(/NCc1ccccc1)\OC Amb25799514 [0,1,0,0,0,1|1,0,0]=3 5592 B13R1.417 C\N=C(\NN)/SCc1ccccc1 Amb18130227 [0,1,0,0,0,1|2,0,0]=4 5593 B13R1.417 O\C=C(/C=O)\OCc1ccccc1 Amb24654970 [0,1,0,0,0,1|2,0,0]=4 5594 B13R1.528 BrCC(=O)NCc1ccccc1C Amb17333157 [0,1,0,0,0,1|2,0,0]=4 5595 B13R1.528 BrCC(=O)NCc1ccccc1Cl Amb17331123 [0,1,0,0,0,1|2,0,0]=4 5596 B13R1.528 BrCC(=O)NCc1ccccc1F Amb17331512 [0,1,0,0,0,1|2,0,0]=4 5597 B13R1.528 BrCC(=O)NCc1ccccc1O Amb17323766 [0,1,0,0,0,1|2,0,0]=4 5598 B13R1.528 C#CC(=O)CSc1ccccc1Br Amb25681699 [0,1,0,0,0,1|1,0,1]=4 5599 B13R1.528 C#CC(=O)CSc1ccccc1F Amb25111845 [0,1,0,0,0,1|1,0,1]=4 5600 B13R1.528 C#CC(=O)NCc1ccccc1Br Amb25853750 [0,1,0,0,0,1|1,0,1]=4 5601 B13R1.528 C#CC(=O)NCc1ccccc1Cl Amb25821246 [0,1,0,0,0,1|1,0,1]=4 5602 B13R1.528 C#CC(=O)NCc1ccccc1F Amb25683308 [0,1,0,0,0,1|1,0,1]=4 5603 B13R1.528 C#CC(=O)NCc1ccccc1O Amb24711089 [0,1,0,0,0,1|1,0,1]=4 5604 B13R1.528 C=CC(=O)NCc1ccccc1Br Amb25734591 [0,1,0,0,0,1|1,0,1]=4 5605 B13R1.528 C=CC(=O)NCc1ccccc1I Amb24360596 [0,1,0,0,0,1|1,0,1]=4 5606 B13R1.528 C=CC(=O)NCc1ccccc1O Amb25686595 [0,1,0,0,0,1|1,0,1]=4 5607 B13R1.528 CCC(=C)CNc1ccccc1Br Amb25049049 [0,1,0,0,0,1|2,0,0]=4 5608 B13R1.528 CCC(=C)CNc1ccccc1F Amb25191993 [0,1,0,0,0,1|2,0,0]=4 5609 B13R1.528 CCC(=N)NCc1ccccc1Br Amb25189943 [0,1,0,0,0,1|2,0,0]=4 5610 B13R1.528 CCC(=O)COc1ccccc1N Amb22010341 [0,1,0,0,0,1|1,0,0]=3 5611 B13R1.528 CCC(=O)NCc1ccc[n]c1F Amb25051201 [0,1,0,0,0,1|2,0,0]=4 5612 B13R1.528 CCC(=O)NCc1ccccc1Br Amb2085745 [0,1,0,0,0,1|1,0,0]=3 5613 B13R1.528 CCC(=O)NCc1ccccc1C Amb10672025 [0,1,0,0,0,1|1,0,0]=3 5614 B13R1.528 CCC(=O)NCc1ccccc1F Amb2020111 [0,1,0,0,0,1|1,0,0]=3 5615 B13R1.528 CCC(=O)NCc1ccccc1N Amb18984726 [0,1,0,0,0,1|1,0,0]=3 5616 B13R1.528 CCC(=O)NNc1ccccc1Cl Amb24502719 [0,1,0,0,0,1|2,0,0]=4 5617 B13R1.528 CCC(=O)NNc1ccccc1F Amb24673307 [0,1,0,0,0,1|2,0,0]=4 5618 B13R1.528 CCC(=O)NNc1ccccc1N Amb18128462 [0,1,0,0,0,1|2,0,0]=4 5619 B13R1.528 CCC(=O)\C=C\c1ccccc1F Amb24534515 [0,1,0,0,0,1|1,0,1]=4 5620 B13R1.528 CCC(=O)\C=C\c1ccccc1O Amb16206172 [0,1,0,0,0,1|1,0,1]=4 5621 B13R1.528 CCC(=O)\N=C\c1ccccc1O Amb24072989 [0,1,0,0,0,1|1,0,1]=4 5622 B13R1.528 CNC(=N)CSc1ccccc1Br Amb24437090 [0,1,0,0,0,1|2,0,0]=4 5623 B13R1.528 CNC(=N)CSc1ccccc1Cl Amb24415119 [0,1,0,0,0,1|2,0,0]=4 5624 B13R1.528 CNC(=N)NCc1ccccc1Br Amb25069918 [0,1,0,0,0,1|2,0,0]=4 5625 B13R1.528 CNC(=N)NCc1ccccc1Cl Amb18325452 [0,1,0,0,0,1|2,0,0]=4 5626 B13R1.528 CNC(=N)NCc1ccccc1F Amb18185012 [0,1,0,0,0,1|2,0,0]=4 5627 B13R1.528 CNC(=N)NCc1ccccc1O Amb25281440 [0,1,0,0,0,1|2,0,0]=4 5628 B13R1.528 CNC(=O)C#Cc1ccccc1O Amb25725955 [0,1,0,0,0,1|1,0,1]=4 5629 B13R1.528 CNC(=O)C=Cc1ccccc1F Amb20635245 [0,1,0,0,0,1|1,0,1]=4 5630 B13R1.528 CNC(=O)CCc1ccccc1Br Amb22098933 [0,1,0,0,0,1|1,0,0]=3 5631 B13R1.528 CNC(=O)CCc1ccccc1Cl Amb13957943 [0,1,0,0,0,1|1,0,0]=3 5632 B13R1.528 CNC(=O)CCc1ccccc1F Amb23163929 [0,1,0,0,0,1|1,0,0]=3 5633 B13R1.528 CNC(=O)CNc1[n]cccc1Br Amb18292758 [0,1,0,0,0,1|2,0,0]=4 5634 B13R1.528 CNC(=O)CNc1[n]cccc1F Amb18996011 [0,1,0,0,0,1|2,0,0]=4 5635 B13R1.528 CNC(=O)CNc1c[n]ccc1N Amb25266516 [0,1,0,0,0,1|2,0,0]=4 5636 B13R1.528 CNC(=O)COC1=CC=CNC1=O Amb18034643 [0,1,0,0,0,1|2,0,0]=4 5637 B13R1.528 CNC(=O)COc1ccc[n]c1Cl Amb25292048 [0,1,0,0,0,1|2,0,0]=4 5638 B13R1.528 CNC(=O)COc1cccc[n+]1[O-] Amb24416588 [0,1,0,0,0,1|2,0,0]=4 5639 B13R1.528 CNC(=O)COc1ccccc1Br Amb1174422 [0,1,0,0,0,1|1,0,0]=3 5640 B13R1.528 CNC(=O)COc1ccccc1C Amb2089063 [0,1,0,0,0,1|1,0,0]=3 5641 B13R1.528 CNC(=O)COc1ccccc1F Amb2131087 [0,1,0,0,0,1|1,0,0]=3 5642 B13R1.528 CNC(=O)COc1ccccc1I Amb24343727 [0,1,0,0,0,1|1,0,0]=3 5643 B13R1.528 CNC(=O)COc1ccccc1N Amb1121495 [0,1,0,0,0,1|1,0,0]=3 5644 B13R1.528 CNC(=O)COc1ccccc1O Amb1199497 [0,1,0,0,0,1|1,0,0]=3 5645 B13R1.528 CNC(=O)COc1cccnc1Br Amb11622994 [0,1,0,0,0,1|2,0,0]=4 5646 B13R1.528 CNC(=O)CSc1c[n]ccc1N Amb25852330 [0,1,0,0,0,1|2,0,0]=4 5647 B13R1.528 CNC(=O)CSc1ccccc1Br Amb11254390 [0,1,0,0,0,1|1,0,0]=3 5648 B13R1.528 CNC(=O)CSc1ccccc1O Amb18318226 [0,1,0,0,0,1|1,0,0]=3 5649 B13R1.528 CNC(=O)CSc1ncccc1Cl Amb16143365 [0,1,0,0,0,1|2,0,0]=4 5650 B13R1.528 CNC(=O)NCc1[n]cccc1F Amb24688859 [0,1,0,0,0,1|2,0,0]=4 5651 B13R1.528 CNC(=O)NCc1ccccc1Cl Amb2132766 [0,1,0,0,0,1|1,0,0]=3 5652 B13R1.528 CNC(=O)NCc1ccccc1F Amb22584226 [0,1,0,0,0,1|1,0,0]=3 5653 B13R1.528 CNC(=O)NNc1ccccc1Cl Amb25668564 [0,1,0,0,0,1|2,0,0]=4 5654 B13R1.528 CNC(=O)NNc1ccccc1F Amb25761192 [0,1,0,0,0,1|2,0,0]=4 5655 B13R1.528 CNC(=O)OCc1[n]cccc1O Amb24375395 [0,1,0,0,0,1|2,0,0]=4 5656 B13R1.528 CNC(=O)OCc1ccccc1Br Amb25239936 [0,1,0,0,0,1|1,0,0]=3 5657 B13R1.528 CNC(=O)SCc1ccccc1Cl Amb25095777 [0,1,0,0,0,1|1,0,0]=3 5658 B13R1.528 CNC(=O)\C=C\c1ccccc1Br Amb11217679 [0,1,0,0,0,1|1,0,1]=4 5659 B13R1.528 CNC(=S)NCc1ccccc1F Amb25155511 [0,1,0,0,0,1|1,1,0]=4 5660 B13R1.528 CNC(=S)OCc1ccccc1Cl Amb24443779 [0,1,0,0,0,1|1,1,0]=4 5661 B13R1.528 COC(=N)CCc1ccccc1Br Amb18071214 [0,1,0,0,0,1|1,0,0]=3 5662 B13R1.528 COC(=N)CCc1ccccc1Cl Amb18066439 [0,1,0,0,0,1|1,0,0]=3 5663 B13R1.528 COC(=N)CCc1ccccc1F Amb18066000 [0,1,0,0,0,1|1,0,0]=3 5664 B13R1.528 COC(=N)COc1ccccc1Br Amb18577242 [0,1,0,0,0,1|1,0,0]=3 5665 B13R1.528 COC(=N)COc1ccccc1Cl Amb18066507 [0,1,0,0,0,1|1,0,0]=3 5666 B13R1.528 COC(=N)COc1ccccc1F Amb18066092 [0,1,0,0,0,1|1,0,0]=3 5667 B13R1.528 COC(=O)C#CC1=CNC=CC1=O Amb24473412 [0,1,0,0,0,1|1,0,1]=4 5668 B13R1.528 COC(=O)C#Cc1cc[n]cc1Cl Amb25713101 [0,1,0,0,0,1|1,0,1]=4 5669 B13R1.528 COC(=O)C=Cc1ccccc1O Amb10605440 [0,1,0,0,0,1|0,0,1]=3 5670 B13R1.528 COC(=O)CCC1=CN=CNC1=O Amb23248036 [0,1,0,0,0,1|2,0,0]=4 5671 B13R1.528 COC(=O)CCc1ccccc1Br Amb10604254 [0,1,0,0,0,1|0,0,0]=2 5672 B13R1.528 COC(=O)CCc1ccccc1C Amb17400660 [0,1,0,0,0,1|0,0,0]=2 5673 B13R1.528 COC(=O)CCc1ccccc1Cl Amb17402275 [0,1,0,0,0,1|0,0,0]=2 5674 B13R1.528 COC(=O)CCc1ccccc1F Amb17400908 [0,1,0,0,0,1|0,0,0]=2 5675 B13R1.528 COC(=O)CNC1=NC=CNC1=O Amb25809743 [0,1,0,0,0,1|2,0,0]=4 5676 B13R1.528 COC(=O)CNc1[n]cc[n]c1Cl Amb25158253 [0,1,0,0,0,1|2,0,0]=4 5677 B13R1.528 COC(=O)CNc1[n]cc[n]c1N Amb25251012 [0,1,0,0,0,1|2,0,0]=4 5678 B13R1.528 COC(=O)CNc1[n]cccc1F Amb18314018 [0,1,0,0,0,1|1,0,0]=3 5679 B13R1.528 COC(=O)CNc1cc[n]cc1Br Amb25820167 [0,1,0,0,0,1|1,0,0]=3 5680 B13R1.528 COC(=O)CNc1cc[n]cc1Cl Amb24378605 [0,1,0,0,0,1|1,0,0]=3 5681 B13R1.528 COC(=O)CNc1ccc[n]c1N Amb24472644 [0,1,0,0,0,1|1,0,0]=3 5682 B13R1.528 COC(=O)CNc1ccccc1Cl Amb24099081 [0,1,0,0,0,1|0,0,0]=2 5683 B13R1.528 COC(=O)CNc1ccccc1O Amb25360835 [0,1,0,0,0,1|0,0,0]=2 5684 B13R1.528 COC(=O)COc1[n]cccc1O Amb24095895 [0,1,0,0,0,1|1,0,0]=3 5685 B13R1.528 COC(=O)COc1ccccc1N Amb1119918 [0,1,0,0,0,1|0,0,0]=2 5686 B13R1.528 COC(=O)CSc1[n]cccc1O Amb24095896 [0,1,0,0,0,1|1,0,0]=3 5687 B13R1.528 COC(=O)CSc1ccccc1O Amb19044958 [0,1,0,0,0,1|0,0,0]=2 5688 B13R1.528 COC(=O)CSc1ncccc1Cl Amb11262003 [0,1,0,0,0,1|1,0,0]=3 5689 B13R1.528 COC(=O)NCc1ccc[n]c1F Amb25069490 [0,1,0,0,0,1|1,0,0]=3 5690 B13R1.528 COC(=O)NCc1ccccc1Br Amb24643282 [0,1,0,0,0,1|0,0,0]=2 5691 B13R1.528 COC(=O)NCc1ccccc1Cl Amb22469956 [0,1,0,0,0,1|0,0,0]=2 5692 B13R1.528 COC(=O)NCc1ccccc1F Amb2020112 [0,1,0,0,0,1|0,0,0]=2 5693 B13R1.528 COC(=O)NNc1ccccc1Cl Amb24510177 [0,1,0,0,0,1|1,0,0]=3 5694 B13R1.528 COC(=O)NNc1ccccc1F Amb24612816 [0,1,0,0,0,1|1,0,0]=3 5695 B13R1.528 COC(=O)\C=C\c1[n]cccc1N Amb24740155 [0,1,0,0,0,1|1,0,1]=4 5696 B13R1.528 COC(=O)\C=C\c1cc[n]cc1F Amb24623916 [0,1,0,0,0,1|1,0,1]=4 5697 B13R1.528 COC(=O)\C=C\c1ccc[n]c1Br Amb22584147 [0,1,0,0,0,1|1,0,1]=4 5698 B13R1.528 COC(=O)\C=C\c1ccccc1Br Amb22491743 [0,1,0,0,0,1|0,0,1]=3 5699 B13R1.528 COC(=O)\C=C\c1ccccc1Cl Amb10808396 [0,1,0,0,0,1|0,0,1]=3 5700 B13R1.528 COC(=O)\C=C\c1ccccc1F Amb2432760 [0,1,0,0,0,1|0,0,1]=3 5701 B13R1.528 COC(=O)\C=C\c1ccccc1I Amb25275412 [0,1,0,0,0,1|0,0,1]=3 5702 B13R1.528 COC(=O)\C=C\c1ccccc1N Amb18127873 [0,1,0,0,0,1|0,0,1]=3 5703 B13R1.528 COC(=O)\C=C\c1cnccc1Cl Amb13890041 [0,1,0,0,0,1|1,0,1]=4 5704 B13R1.528 COC(C)CNc1ccccc1I Amb25121004 [0,1,0,0,0,1|1,0,1]=4 5705 B13R1.528 CSC(=S)NCc1ccccc1F Amb25324533 [0,1,0,0,0,1|0,2,0]=4 5706 B13R1.528 CS\C(\N)=N\Cc1ccccc1Cl Amb25778116 [0,1,0,0,0,1|1,1,0]=4 5707 B13R1.528 CS\C(\N)=N\Cc1ccccc1F Amb25295330 [0,1,0,0,0,1|1,1,0]=4 5708 B13R1.528 C\C(\CC)=C/Cc1ccccc1N Amb24756421 [0,1,0,0,0,1|2,0,0]=4 5709 B13R1.528 C\C(\CCc1ccccc1O)=C/C Amb24647804 [0,1,0,0,0,1|2,0,0]=4 5710 B13R1.528 C\C(\CCc1ccccc1O)=C\C Amb25271017 [0,1,0,0,0,1|2,0,0]=4 5711 B13R1.528 C\N=C(\N)/SCc1ccccc1F Amb24408231 [0,1,0,0,0,1|2,0,0]=4 5712 B13R1.528 Cc1[n]cccc1C#CC(=O)OC Amb24601387 [0,1,0,0,0,1|1,0,1]=4 5713 B13R1.528 Cc1[n]cccc1OCC(=O)NC Amb24720641 [0,1,0,0,0,1|2,0,0]=4 5714 B13R1.528 Cc1[n]cccc1\C=C\C(=O)OC Amb23586024 [0,1,0,0,0,1|1,0,1]=4 5715 B13R1.528 Cc1c[n]ccc1NCC(=O)NC Amb24713705 [0,1,0,0,0,1|2,0,0]=4 5716 B13R1.528 Cc1cc[n]cc1C#CC(=O)OC Amb24425458 [0,1,0,0,0,1|1,0,1]=4 5717 B13R1.528 Cc1cc[n]cc1CNC(=O)NC Amb25693757 [0,1,0,0,0,1|2,0,0]=4 5718 B13R1.528 Cc1cc[n]cc1\C=C\C(=O)OC Amb24726967 [0,1,0,0,0,1|1,0,1]=4 5719 B13R1.528 Cc1ccc[n]c1C#CC(=O)OC Amb24561521 [0,1,0,0,0,1|1,0,1]=4 5720 B13R1.528 Cc1ccc[n]c1NCC(=O)NC Amb18296065 [0,1,0,0,0,1|2,0,0]=4 5721 B13R1.528 Cc1ccc[n]c1NCC(=O)OC Amb18809312 [0,1,0,0,0,1|1,0,0]=3 5722 B13R1.528 Cc1ccc[n]c1SCC(=O)NC Amb25769175 [0,1,0,0,0,1|2,0,0]=4 5723 B13R1.528 Cc1ccccc1CCC(=N)OC Amb18065690 [0,1,0,0,0,1|1,0,0]=3 5724 B13R1.528 Cc1ccccc1CCC(=O)C#C Amb25134938 [0,1,0,0,0,1|1,0,1]=4 5725 B13R1.528 Cc1ccccc1CCC(=O)CN Amb18564059 [0,1,0,0,0,1|2,0,0]=4 5726 B13R1.528 Cc1ccccc1CCC(=O)CO Amb18065752 [0,1,0,0,0,1|2,0,0]=4 5727 B13R1.528 Cc1ccccc1CCC(=O)NO Amb18804872 [0,1,0,0,0,1|2,0,0]=4 5728 B13R1.528 Cc1ccccc1CNC(=N)NC Amb18804664 [0,1,0,0,0,1|2,0,0]=4 5729 B13R1.528 Cc1ccccc1CNC(=O)C#C Amb25032976 [0,1,0,0,0,1|1,0,1]=4 5730 B13R1.528 Cc1ccccc1CNC(=O)NN Amb18796130 [0,1,0,0,0,1|2,0,0]=4 5731 B13R1.528 Cc1ccccc1CSC(=O)NN Amb24650452 [0,1,0,0,0,1|2,0,0]=4 5732 B13R1.528 Cc1ccccc1NCC(=C)CC Amb24427099 [0,1,0,0,0,1|2,0,0]=4 5733 B13R1.528 Cc1ccccc1NCC(=O)NO Amb24489108 [0,1,0,0,0,1|2,0,0]=4 5734 B13R1.528 Cc1ccccc1NCC(C)OC Amb25840805 [0,1,0,0,0,1|1,0,1]=4 5735 B13R1.528 Cc1ccccc1OCC(=N)OC Amb18065837 [0,1,0,0,0,1|1,0,0]=3 5736 B13R1.528 Cc1ccccc1OCC(=O)CO Amb18065910 [0,1,0,0,0,1|2,0,0]=4 5737 B13R1.528 Cc1ccccc1OCC(=O)NO Amb25093365 [0,1,0,0,0,1|2,0,0]=4 5738 B13R1.528 Cc1ccccc1SCC(=O)C#C Amb24560799 [0,1,0,0,0,1|1,0,1]=4 5739 B13R1.528 Cc1ccccc1\C=C/C(=O)CC Amb25318845 [0,1,0,0,0,1|1,0,1]=4 5740 B13R1.528 Cc1ccccc1\C=C\C(=O)NC Amb25821660 [0,1,0,0,0,1|1,0,1]=4 5741 B13R1.528 ClCC(=O)CCc1ccccc1C Amb17139632 [0,1,0,0,0,1|2,0,0]=4 5742 B13R1.528 ClCC(=O)CCc1ccccc1Cl Amb17141004 [0,1,0,0,0,1|2,0,0]=4 5743 B13R1.528 ClCC(=O)CCc1ccccc1F Amb17139826 [0,1,0,0,0,1|2,0,0]=4 5744 B13R1.528 ClCC(=O)COc1ccccc1Br Amb17164620 [0,1,0,0,0,1|2,0,0]=4 5745 B13R1.528 ClCC(=O)COc1ccccc1C Amb17139728 [0,1,0,0,0,1|2,0,0]=4 5746 B13R1.528 ClCC(=O)COc1ccccc1Cl Amb17141140 [0,1,0,0,0,1|2,0,0]=4 5747 B13R1.528 ClCC(=O)COc1ccccc1F Amb17139897 [0,1,0,0,0,1|2,0,0]=4 5748 B13R1.528 ClCC(=O)NCc1ccccc1Br Amb10075557 [0,1,0,0,0,1|2,0,0]=4 5749 B13R1.528 ClCC(=O)NCc1ccccc1C Amb1229844 [0,1,0,0,0,1|2,0,0]=4 5750 B13R1.528 ClCC(=O)NCc1ccccc1Cl Amb1207239 [0,1,0,0,0,1|2,0,0]=4 5751 B13R1.528 ClCC(=O)NCc1ccccc1F Amb1995069 [0,1,0,0,0,1|2,0,0]=4 5752 B13R1.528 ClCC(=O)NCc1ccccc1O Amb17331367 [0,1,0,0,0,1|2,0,0]=4 5753 B13R1.528 NCC(=O)CCc1ccccc1Br Amb18156124 [0,1,0,0,0,1|2,0,0]=4 5754 B13R1.528 NCC(=O)CCc1ccccc1Cl Amb18066458 [0,1,0,0,0,1|2,0,0]=4 5755 B13R1.528 NCC(=O)COc1ccccc1Br Amb18155770 [0,1,0,0,0,1|2,0,0]=4 5756 B13R1.528 NCC(=O)NCc1ccccc1Br Amb18977751 [0,1,0,0,0,1|2,0,0]=4 5757 B13R1.528 NCC(=O)NCc1ccccc1I Amb21861634 [0,1,0,0,0,1|2,0,0]=4 5758 B13R1.528 NCC(=O)OCc1ccccc1C Amb17335304 [0,1,0,0,0,1|2,0,0]=4 5759 B13R1.528 NCC(=O)OCc1ccccc1Cl Amb17337475 [0,1,0,0,0,1|2,0,0]=4 5760 B13R1.528 NCC(=O)OCc1ccccc1Cl Amb19373854 [0,1,0,0,0,1|2,0,0]=4 5761 B13R1.528 NCC(=O)OCc1ccccc1F Amb17335595 [0,1,0,0,0,1|2,0,0]=4 5762 B13R1.528 NNC(=O)CCc1ccccc1Br Amb24729756 [0,1,0,0,0,1|2,0,0]=4 5763 B13R1.528 NNC(=O)CCc1ccccc1O Amb1625126 [0,1,0,0,0,1|2,0,0]=4 5764 B13R1.528 NNC(=O)CNc1ccccc1Br Amb25762434 [0,1,0,0,0,1|2,0,0]=4 5765 B13R1.528 NNC(=O)CNc1ccccc1Cl Amb24676530 [0,1,0,0,0,1|2,0,0]=4 5766 B13R1.528 NNC(=O)CNc1ccccc1F Amb1104545 [0,1,0,0,0,1|2,0,0]=4 5767 B13R1.528 NNC(=O)CNc1ccccc1I Amb24414458 [0,1,0,0,0,1|2,0,0]=4 5768 B13R1.528 NNC(=O)CSc1ccccc1F Amb2336529 [0,1,0,0,0,1|2,0,0]=4 5769 B13R1.528 NNC(=O)CSc1ccccc1N Amb17305609 [0,1,0,0,0,1|2,0,0]=4 5770 B13R1.528 NNC(=O)CSc1ccccc1O Amb22059272 [0,1,0,0,0,1|2,0,0]=4 5771 B13R1.528 NNC(=O)NCc1ccccc1Br Amb25716117 [0,1,0,0,0,1|2,0,0]=4 5772 B13R1.528 Nc1ccccc1COC(=O)CCl Amb19516414 [0,1,0,0,0,1|2,0,0]=4 5773 B13R1.528 O=C(CCl)CCc1ccccc1Br Amb22375373 [0,1,0,0,0,1|2,0,0]=4 5774 B13R1.528 O=C(CCl)NCc1ccccc1I Amb21861571 [0,1,0,0,0,1|2,0,0]=4 5775 B13R1.528 O=C(CF)NCc1ccccc1Cl Amb25691399 [0,1,0,0,0,1|2,0,0]=4 5776 B13R1.528 O=C(CI)NCc1ccccc1Cl Amb25678349 [0,1,0,0,0,1|2,0,0]=4 5777 B13R1.528 OCC(=O)CCc1ccccc1Br Amb18576942 [0,1,0,0,0,1|2,0,0]=4 5778 B13R1.528 OCC(=O)CCc1ccccc1Cl Amb18066485 [0,1,0,0,0,1|2,0,0]=4 5779 B13R1.528 OCC(=O)CCc1ccccc1F Amb18564200 [0,1,0,0,0,1|2,0,0]=4 5780 B13R1.528 OCC(=O)COc1ccccc1Br Amb18072010 [0,1,0,0,0,1|2,0,0]=4 5781 B13R1.528 OCC(=O)COc1ccccc1Cl Amb18566284 [0,1,0,0,0,1|2,0,0]=4 5782 B13R1.528 OCC(=O)COc1ccccc1F Amb18564273 [0,1,0,0,0,1|2,0,0]=4 5783 B13R1.528 OCC(=O)NCc1ccccc1C Amb17400714 [0,1,0,0,0,1|2,0,0]=4 5784 B13R1.528 ONC(=O)CCc1ccccc1F Amb25762731 [0,1,0,0,0,1|2,0,0]=4 5785 B13R1.528 ONC(=O)COc1ccccc1Br Amb25854806 [0,1,0,0,0,1|2,0,0]=4 5786 B13R1.528 ONC(=O)COc1ccccc1Cl Amb22465743 [0,1,0,0,0,1|2,0,0]=4 5787 B13R1.528 ONC(=O)COc1ccccc1O Amb1332070 [0,1,0,0,0,1|2,0,0]=4 5788 B13R1.528 ONC(=O)CSc1ccccc1Cl Amb25122486 [0,1,0,0,0,1|2,0,0]=4 5789 B13R1.528 ONC(=O)CSc1ccccc1F Amb25852477 [0,1,0,0,0,1|2,0,0]=4 5790 B13R1.528 Oc1ccccc1CNC(=O)CO Amb24734648 [0,1,0,0,0,1|2,0,0]=4 5791 B13R1.1575 CCOC(=O)NC1=CCC=CC=C1 Amb25034337 [0,1,0,0,0,1|1,0,0]=3 5792 B13R1.6192 CC(C)C(=O)CC1C=CC=CC=C1 Amb24341396 [0,1,0,0,0,1|1,0,1]=4 5793 B13R1.19 BrCCC(=O)Nc1ccc(cc1)C Amb17325059 [0,2,0,0,0,0|2,0,0]=4 5794 B13R1.19 BrCCC(=O)Nc1ccc(cc1)Cl Amb17324293 [0,2,0,0,0,0|2,0,0]=4 5795 B13R1.19 BrCCC(=O)Nc1ccc(cc1)F Amb17331898 [0,2,0,0,0,0|2,0,0]=4 5796 B13R1.19 BrCCC(=O)Nc1ccc(cc1)O Amb17332019 [0,2,0,0,0,0|2,0,0]=4 5797 B13R1.19 C#CCC(=O)Cc1ccc(Br)cc1 Amb25677889 [0,2,0,0,0,0|1,0,1]=4 5798 B13R1.19 C#CCC(=O)Cc1ccc(Cl)cc1 Amb19079203 [0,2,0,0,0,0|1,0,1]=4 5799 B13R1.19 C#CCC(=O)Cc1ccc(F)cc1 Amb18185970 [0,2,0,0,0,0|1,0,1]=4 5800 B13R1.19 C#CCC(=O)Cc1ccc(N)cc1 Amb25378438 [0,2,0,0,0,0|1,0,1]=4 5801 B13R1.19 C=NOC(=O)Nc1ccc(Cl)cc1 Amb24570200 [0,2,0,0,0,0|1,0,1]=4 5802 B13R1.19 CC#CC(=O)Nc1ccc(Cl)cc1 Amb22462112 [0,2,0,0,0,0|2,0,0]=4 5803 B13R1.19 CC#CC(=O)Nc1ccc(F)cc1 Amb25115581 [0,2,0,0,0,0|2,0,0]=4 5804 B13R1.19 CC#CC(=O)Nc1ccc(O)cc1 Amb25285960 [0,2,0,0,0,0|2,0,0]=4 5805 B13R1.19 CC#CC(=O)Oc1ccc(F)cc1 Amb25333147 [0,2,0,0,0,0|2,0,0]=4 5806 B13R1.19 CC=CC(=O)Nc1ccc(Cl)cc1 Amb22466818 [0,2,0,0,0,0|2,0,0]=4 5807 B13R1.19 CCCC(=O)Cc1ccc(cc1)C Amb17138797 [0,2,0,0,0,0|1,0,0]=3 5808 B13R1.19 CCCC(=O)Cc1ccc(cc1)Cl Amb17139628 [0,2,0,0,0,0|1,0,0]=3 5809 B13R1.19 CCCC(=O)Cc1ccc(cc1)F Amb17138963 [0,2,0,0,0,0|1,0,0]=3 5810 B13R1.19 CCCC(=O)N=C1C=CC(=O)C=C1 Amb24492406 [0,2,0,0,0,0|2,0,0]=4 5811 B13R1.19 CCCC(=O)Nc1ccc(cc1)Br Amb1195957 [0,2,0,0,0,0|2,0,0]=4 5812 B13R1.19 CCCC(=O)Nc1ccc(cc1)N Amb1790767 [0,2,0,0,0,0|2,0,0]=4 5813 B13R1.19 CCNC(=N)Cc1ccc(Cl)cc1 Amb25120194 [0,2,0,0,0,0|2,0,0]=4 5814 B13R1.19 CCNC(=O)CN1C=CC(=O)C=C1 Amb25142335 [0,2,0,0,0,0|2,0,0]=4 5815 B13R1.19 CCNC(=O)Cc1ccc(Br)c[n]1 Amb23586126 [0,2,0,0,0,0|2,0,0]=4 5816 B13R1.19 CCNC(=O)Cc1ccc(Cl)[n]c1 Amb24362448 [0,2,0,0,0,0|2,0,0]=4 5817 B13R1.19 CCNC(=O)Cc1ccc(Cl)c[n]1 Amb25345609 [0,2,0,0,0,0|2,0,0]=4 5818 B13R1.19 CCNC(=O)Cc1ccc(S)cc1 Amb25358208 [0,2,0,0,0,0|1,0,0]=3 5819 B13R1.19 CCNC(=O)Cc1ccc(cc1)N Amb1112064 [0,2,0,0,0,0|1,0,0]=3 5820 B13R1.19 CCNC(=O)Nc1ccc(cc1)C Amb1240612 [0,2,0,0,0,0|2,0,0]=4 5821 B13R1.19 CCNC(=O)Nc1ccc(cc1)Cl Amb1233667 [0,2,0,0,0,0|2,0,0]=4 5822 B13R1.19 CCNC(=O)Oc1ccc(Br)cc1 Amb25681097 [0,2,0,0,0,0|2,0,0]=4 5823 B13R1.19 CCNC(=O)Oc1ccc(Cl)cc1 Amb22466857 [0,2,0,0,0,0|2,0,0]=4 5824 B13R1.19 CCNC(=O)Oc1ccc(F)cc1 Amb24588134 [0,2,0,0,0,0|2,0,0]=4 5825 B13R1.19 CCNC(=O)Oc1ccc(I)cc1 Amb24414718 [0,2,0,0,0,0|2,0,0]=4 5826 B13R1.19 CCNC(=O)Sc1ccc(Cl)cc1 Amb24534155 [0,2,0,0,0,0|2,0,0]=4 5827 B13R1.19 CCOC(=N)Cc1ccc(Br)cc1 Amb20673163 [0,2,0,0,0,0|1,0,0]=3 5828 B13R1.19 CCOC(=N)Cc1ccc(Br)cc1 Amb24089938 [0,2,0,0,0,0|1,0,0]=3 5829 B13R1.19 CCOC(=N)Cc1ccc(Cl)cc1 Amb18321860 [0,2,0,0,0,0|1,0,0]=3 5830 B13R1.19 CCOC(=N)Cc1ccc(Cl)cc1 Amb20673154 [0,2,0,0,0,0|1,0,0]=3 5831 B13R1.19 CCOC(=N)Cc1ccc(F)cc1 Amb20673149 [0,2,0,0,0,0|1,0,0]=3 5832 B13R1.19 CCOC(=O)C[n+]1ccc(cc1)C Amb10554031 [0,2,0,0,0,0|1,0,0]=3 5833 B13R1.19 CCOC(=O)Cc1[n]cc(F)c[n]1 Amb21857271 [0,2,0,0,0,0|2,0,0]=4 5834 B13R1.19 CCOC(=O)Cc1c[n]c(Br)[n]c1 Amb23439669 [0,2,0,0,0,0|2,0,0]=4 5835 B13R1.19 CCOC(=O)Cc1c[n]c(Cl)[n]c1 Amb23439853 [0,2,0,0,0,0|2,0,0]=4 5836 B13R1.19 CCOC(=O)Cc1cc[n+](cc1)C Amb10553743 [0,2,0,0,0,0|1,0,0]=3 5837 B13R1.19 CCOC(=O)Cc1ccc(Br)[n]c1 Amb23452632 [0,2,0,0,0,0|1,0,0]=3 5838 B13R1.19 CCOC(=O)Cc1ccc(Br)c[n]1 Amb21963596 [0,2,0,0,0,0|1,0,0]=3 5839 B13R1.19 CCOC(=O)Cc1ccc(Cl)[n][n]1 Amb22499434 [0,2,0,0,0,0|2,0,0]=4 5840 B13R1.19 CCOC(=O)Cc1ccc(Cl)[n]c1 Amb19515857 [0,2,0,0,0,0|1,0,0]=3 5841 B13R1.19 CCOC(=O)Cc1ccc(Cl)c[n]1 Amb23402253 [0,2,0,0,0,0|1,0,0]=3 5842 B13R1.19 CCOC(=O)Cc1ccc(I)c[n]1 Amb24183400 [0,2,0,0,0,0|1,0,0]=3 5843 B13R1.19 CCOC(=O)Cc1ccc(N)[n]c1 Amb22899575 [0,2,0,0,0,0|1,0,0]=3 5844 B13R1.19 CCOC(=O)Cc1ccc(N)c[n]1 Amb22234417 [0,2,0,0,0,0|1,0,0]=3 5845 B13R1.19 CCOC(=O)Cc1ccc(N)cc1 Amb22234960 [0,2,0,0,0,0|0,0,0]=2 5846 B13R1.19 CCOC(=O)Cc1ccc(O)c[n]1 Amb22405966 [0,2,0,0,0,0|1,0,0]=3 5847 B13R1.19 CCOC(=O)Cc1ccc(cc1)I Amb16230826 [0,2,0,0,0,0|0,0,0]=2 5848 B13R1.19 CCOC(=O)Cc1ncc(cn1)Br Amb10603178 [0,2,0,0,0,0|2,0,0]=4 5849 B13R1.19 CCOC(=O)NC1=CNC(=O)C=C1 Amb25753387 [0,2,0,0,0,0|2,0,0]=4 5850 B13R1.19 CCOC(=O)Nc1ccc(F)[n]c1 Amb25114046 [0,2,0,0,0,0|2,0,0]=4 5851 B13R1.19 CCOC(=O)Nc1ccc(F)c[n]1 Amb24362486 [0,2,0,0,0,0|2,0,0]=4 5852 B13R1.19 CCOC(=O)Nc1ccc(I)c[n]1 Amb25134763 [0,2,0,0,0,0|2,0,0]=4 5853 B13R1.19 CCOC(=O)Nc1ccc(N)[n]c1 Amb18999686 [0,2,0,0,0,0|2,0,0]=4 5854 B13R1.19 CCOC(=O)Nc1ccc(N)c[n]1 Amb18128861 [0,2,0,0,0,0|2,0,0]=4 5855 B13R1.19 CCOC(=O)Nc1ccc(S)cc1 Amb25062910 [0,2,0,0,0,0|1,0,0]=3 5856 B13R1.19 CCOC(=O)Nc1ccc(cc1)C Amb2500803 [0,2,0,0,0,0|1,0,0]=3 5857 B13R1.19 CCOC(=O)Nc1ccc(cc1)Cl Amb1625034 [0,2,0,0,0,0|1,0,0]=3 5858 B13R1.19 CCOC(=O)Nc1ccc(cc1)F Amb1095971 [0,2,0,0,0,0|1,0,0]=3 5859 B13R1.19 CCOC(=O)Nc1ccc(cc1)I Amb1538826 [0,2,0,0,0,0|1,0,0]=3 5860 B13R1.19 CCOC(=O)Nc1ccc(nc1)Br Amb16982207 [0,2,0,0,0,0|2,0,0]=4 5861 B13R1.19 CCOC(=S)Nc1ccc(Cl)cc1 Amb25309515 [0,2,0,0,0,0|1,1,0]=4 5862 B13R1.19 CCOC(=S)Nc1ccc(F)cc1 Amb25759074 [0,2,0,0,0,0|1,1,0]=4 5863 B13R1.19 CCSC(=O)Nc1ccc(Cl)cc1 Amb22446313 [0,2,0,0,0,0|1,1,0]=4 5864 B13R1.19 CCSC(=O)Nc1ccc(F)cc1 Amb25249741 [0,2,0,0,0,0|1,1,0]=4 5865 B13R1.19 CNCC(=O)Nc1ccc(F)cc1 Amb19372369 [0,2,0,0,0,0|2,0,0]=4 5866 B13R1.19 CNCC(=O)Nc1ccc(N)cc1 Amb24749388 [0,2,0,0,0,0|2,0,0]=4 5867 B13R1.19 CNCC(=O)Nc1ccc(cc1)C Amb1105856 [0,2,0,0,0,0|2,0,0]=4 5868 B13R1.19 CNCC(=O)Nc1ccc(cc1)Cl Amb2276036 [0,2,0,0,0,0|2,0,0]=4 5869 B13R1.19 CNCC(=O)Nc1ccc(cc1)Cl Amb2370653 [0,2,0,0,0,0|2,0,0]=4 5870 B13R1.19 CNCC(=O)Nc1ccc(cc1)F Amb2370688 [0,2,0,0,0,0|2,0,0]=4 5871 B13R1.19 CNCC(=O)Nc1ccc(cc1)O Amb13951398 [0,2,0,0,0,0|2,0,0]=4 5872 B13R1.19 COCC(=O)Nc1ccc(F)[n]c1 Amb24429392 [0,2,0,0,0,0|2,0,0]=4 5873 B13R1.19 COCC(=O)Nc1ccc(F)c[n]1 Amb18443220 [0,2,0,0,0,0|2,0,0]=4 5874 B13R1.19 COCC(=O)Nc1ccc(N)[n]c1 Amb18999670 [0,2,0,0,0,0|2,0,0]=4 5875 B13R1.19 COCC(=O)Nc1ccc(N)c[n]1 Amb18290910 [0,2,0,0,0,0|2,0,0]=4 5876 B13R1.19 COCC(=O)Nc1ccc(cc1)Br Amb1884869 [0,2,0,0,0,0|1,0,0]=3 5877 B13R1.19 COCC(=O)Nc1ccc(cc1)Cl Amb1775119 [0,2,0,0,0,0|1,0,0]=3 5878 B13R1.19 COCC(=O)Nc1ccc(cc1)N Amb1118735 [0,2,0,0,0,0|1,0,0]=3 5879 B13R1.19 COCC(=O)Nc1ccc(cc1)N Amb13949207 [0,2,0,0,0,0|1,0,0]=3 5880 B13R1.19 CONC(=O)Cc1ccc(Cl)[n]c1 Amb24335477 [0,2,0,0,0,0|1,0,0]=3 5881 B13R1.19 CONC(=O)Cc1ccc(Cl)c[n]1 Amb25332938 [0,2,0,0,0,0|1,0,0]=3 5882 B13R1.19 CONC(=O)Cc1ccc(I)cc1 Amb24592331 [0,2,0,0,0,0|0,0,0]=2 5883 B13R1.19 CONC(=O)Cc1ccc(cc1)Br Amb16072995 [0,2,0,0,0,0|0,0,0]=2 5884 B13R1.19 CONC(=O)Cc1ccc(cc1)Cl Amb16969926 [0,2,0,0,0,0|0,0,0]=2 5885 B13R1.19 CONC(=O)Cc1ccc(cc1)F Amb16969925 [0,2,0,0,0,0|0,0,0]=2 5886 B13R1.19 CONC(=O)Nc1c[n]c(Br)cc1 Amb25740234 [0,2,0,0,0,0|2,0,0]=4 5887 B13R1.19 CONC(=O)Nc1c[n]c(Cl)cc1 Amb24529791 [0,2,0,0,0,0|2,0,0]=4 5888 B13R1.19 CONC(=O)Nc1ccc(cc1)Cl Amb16980467 [0,2,0,0,0,0|1,0,0]=3 5889 B13R1.19 CONC(=S)Nc1ccc(Br)cc1 Amb22486744 [0,2,0,0,0,0|1,1,0]=4 5890 B13R1.19 CO\N=C(\N)/Cc1ccc(Cl)cc1 Amb24335159 [0,2,0,0,0,0|1,0,0]=3 5891 B13R1.19 CSCC(=O)Nc1ccc(F)cc1 Amb24459101 [0,2,0,0,0,0|1,1,0]=4 5892 B13R1.19 CSCC(=O)Nc1ccc(N)cc1 Amb18971638 [0,2,0,0,0,0|1,1,0]=4 5893 B13R1.19 CSCC(=O)Nc1ccc(cc1)Cl Amb15701919 [0,2,0,0,0,0|1,1,0]=4 5894 B13R1.19 CSCC(=O)Oc1ccc(Br)cc1 Amb20685496 [0,2,0,0,0,0|1,1,0]=4 5895 B13R1.19 C\C(\Cc1ccc(Br)cc1)=N\OC Amb24407424 [0,2,0,0,0,0|1,0,0]=3 5896 B13R1.19 C\C=C\C(=O)Cc1ccc(Br)cc1 Amb24367570 [0,2,0,0,0,0|1,0,0]=3 5897 B13R1.19 C\C=C\C(=O)Cc1ccc(Cl)cc1 Amb25704097 [0,2,0,0,0,0|1,0,0]=3 5898 B13R1.19 C\C=C\C(=O)Cc1ccc(F)cc1 Amb25728225 [0,2,0,0,0,0|1,0,0]=3 5899 B13R1.19 C\C=C\C(=O)Nc1ccc(Cl)cc1 Amb22478485 [0,2,0,0,0,0|2,0,0]=4 5900 B13R1.19 C\C=C\C(=O)Nc1ccc(N)cc1 Amb24375849 [0,2,0,0,0,0|2,0,0]=4 5901 B13R1.19 C\C=C\C(=O)Nc1ccc(O)cc1 Amb25156905 [0,2,0,0,0,0|2,0,0]=4 5902 B13R1.19 C\C=C\C(=O)Oc1ccc(Br)cc1 Amb25356972 [0,2,0,0,0,0|2,0,0]=4 5903 B13R1.19 C\C=C\C(=O)Oc1ccc(F)cc1 Amb24703921 [0,2,0,0,0,0|2,0,0]=4 5904 B13R1.19 C\C=C\C(=O)Oc1ccc(I)cc1 Amb24732795 [0,2,0,0,0,0|2,0,0]=4 5905 B13R1.19 Cc1ccc(CC(=N)NCC)cc1 Amb25854695 [0,2,0,0,0,0|2,0,0]=4 5906 B13R1.19 Cc1ccc(CC(=N)OCC)cc1 Amb20673135 [0,2,0,0,0,0|1,0,0]=3 5907 B13R1.19 Cc1ccc(CC(=O)CC#C)cc1 Amb18802902 [0,2,0,0,0,0|1,0,1]=4 5908 B13R1.19 Cc1ccc(CC(=O)N=[N+]=[N-])cc1 Amb24559790 [0,2,0,0,0,0|2,0,0]=4 5909 B13R1.19 Cc1ccc(CC(=O)OCC)c[n]1 Amb22899586 [0,2,0,0,0,0|1,0,0]=3 5910 B13R1.19 Cc1ccc(C\C(\C)=C/CCl)cc1 Amb24373171 [0,2,0,0,0,0|2,0,0]=4 5911 B13R1.19 Cc1ccc(C\C(\Cl)=C\CCl)cc1 Amb25835561 [0,2,0,0,0,0|2,0,0]=4 5912 B13R1.19 Cc1ccc(NC(=O)COC)[n]c1 Amb24509953 [0,2,0,0,0,0|2,0,0]=4 5913 B13R1.19 Cc1ccc(c[n]1)NC(=O)OCC Amb24103504 [0,2,0,0,0,0|2,0,0]=4 5914 B13R1.19 Cc1ccc(cc1)NC(=O)NCO Amb25054096 [0,2,0,0,0,0|2,0,0]=4 5915 B13R1.19 Cc1ccc(cc1)NC(=O)SCC Amb24383156 [0,2,0,0,0,0|1,1,0]=4 5916 B13R1.19 Cc1ccc(cc1)NC(=O)\C=C\C Amb22366072 [0,2,0,0,0,0|2,0,0]=4 5917 B13R1.19 Cc1ccc(cc1)NC(=S)NOC Amb25752656 [0,2,0,0,0,0|1,1,0]=4 5918 B13R1.19 Cc1ccc(cc1)NC(=S)OCC Amb24308972 [0,2,0,0,0,0|1,1,0]=4 5919 B13R1.19 Cc1ccc(cc1)OC(=O)C#CC Amb25832612 [0,2,0,0,0,0|2,0,0]=4 5920 B13R1.19 Cc1ccc(cc1)OC(=O)NCC Amb22359936 [0,2,0,0,0,0|2,0,0]=4 5921 B13R1.19 Cc1ccc(cc1)OC(=O)\C=C\C Amb22734867 [0,2,0,0,0,0|2,0,0]=4 5922 B13R1.19 Cc1ccc(cc1)SC(=O)NCC Amb24585739 [0,2,0,0,0,0|2,0,0]=4 5923 B13R1.19 ClCCC(=O)Nc1ccc(cc1)Cl Amb1130646 [0,2,0,0,0,0|2,0,0]=4 5924 B13R1.19 ClCCC(=O)Nc1ccc(cc1)F Amb1134991 [0,2,0,0,0,0|2,0,0]=4 5925 B13R1.19 N#CCC(=O)Cc1ccc(Cl)cc1 Amb18035967 [0,2,0,0,0,0|1,0,1]=4 5926 B13R1.19 N#CCC(=O)Cc1ccc(cc1)Br Amb17254036 [0,2,0,0,0,0|1,0,1]=4 5927 B13R1.19 N#CCC(=O)Cc1ccc(cc1)C Amb17232944 [0,2,0,0,0,0|1,0,1]=4 5928 B13R1.19 N#CCC(=O)Cc1ccc(cc1)F Amb17233247 [0,2,0,0,0,0|1,0,1]=4 5929 B13R1.19 N#CNC(=O)Cc1ccc(Cl)cc1 Amb24720783 [0,2,0,0,0,0|1,0,1]=4 5930 B13R1.19 N#CNC(=O)Cc1ccc(F)cc1 Amb25062178 [0,2,0,0,0,0|1,0,1]=4 5931 B13R1.19 NCCC(=O)Nc1ccc(cc1)Br Amb10609613 [0,2,0,0,0,0|2,0,0]=4 5932 B13R1.19 NCCC(=O)Nc1ccc(cc1)C Amb1132101 [0,2,0,0,0,0|2,0,0]=4 5933 B13R1.19 NCCC(=O)Nc1ccc(cc1)C Amb13949218 [0,2,0,0,0,0|2,0,0]=4 5934 B13R1.19 NCCC(=O)Nc1ccc(cc1)Cl Amb15740945 [0,2,0,0,0,0|2,0,0]=4 5935 B13R1.19 NCCC(=O)Nc1ccc(cc1)F Amb1137438 [0,2,0,0,0,0|2,0,0]=4 5936 B13R1.19 NCCC(=O)Nc1ccc(cc1)F Amb17622065 [0,2,0,0,0,0|2,0,0]=4 5937 B13R1.19 NCCC(=O)Oc1ccc(cc1)Br Amb17349677 [0,2,0,0,0,0|2,0,0]=4 5938 B13R1.19 NCCC(=O)Oc1ccc(cc1)C Amb17335316 [0,2,0,0,0,0|2,0,0]=4 5939 B13R1.19 NCCC(=O)Oc1ccc(cc1)Cl Amb17337486 [0,2,0,0,0,0|2,0,0]=4 5940 B13R1.19 NCCC(=O)Oc1ccc(cc1)F Amb17335605 [0,2,0,0,0,0|2,0,0]=4 5941 B13R1.19 NOCC(=O)Nc1ccc(cc1)Cl Amb2439924 [0,2,0,0,0,0|2,0,0]=4 5942 B13R1.19 Nc1ccc(CC(=O)NC#N)cc1 Amb25266218 [0,2,0,0,0,0|1,0,1]=4 5943 B13R1.19 Nc1ccc(cc1)NC(=O)CCN Amb24717984 [0,2,0,0,0,0|2,0,0]=4 5944 B13R1.19 O=C(CCBr)Nc1ccc(I)cc1 Amb25778088 [0,2,0,0,0,0|2,0,0]=4 5945 B13R1.19 O=C(CCCl)Oc1ccc(Cl)cc1 Amb22499422 [0,2,0,0,0,0|2,0,0]=4 5946 B13R1.19 O=C(Cc1ccc(Br)cc1)N=C=O Amb25038857 [0,2,0,0,0,0|1,0,1]=4 5947 B13R1.19 O=C(NCS)Oc1ccc(F)cc1 Amb25752655 [0,2,0,0,0,0|2,0,0]=4 5948 B13R1.19 O=C=NC(=O)Cc1ccc(cc1)Cl Amb17236305 [0,2,0,0,0,0|1,0,1]=4 5949 B13R1.19 O=C=NC(=O)Cc1ccc(cc1)F Amb17233509 [0,2,0,0,0,0|1,0,1]=4 5950 B13R1.19 OCCC(=O)Nc1ccc(cc1)Br Amb17349664 [0,2,0,0,0,0|2,0,0]=4 5951 B13R1.19 OCCC(=O)Nc1ccc(cc1)Cl Amb17337474 [0,2,0,0,0,0|2,0,0]=4 5952 B13R1.19 OCCC(=O)Nc1ccc(cc1)F Amb17335594 [0,2,0,0,0,0|2,0,0]=4 5953 B13R1.19 OCCS(=O)Cc1ccc(I)cc1 Amb24271438 [0,2,0,0,0,0|2,0,0]=4 5954 B13R1.19 OCNC(=O)Nc1ccc(Cl)cc1 Amb25249714 [0,2,0,0,0,0|2,0,0]=4 5955 B13R1.19 Oc1ccc(cc1)NC(=O)CCS Amb25854965 [0,2,0,0,0,0|2,0,0]=4 5956 B13R1.19 SCCC(=O)Nc1ccc(cc1)Br Amb17305728 [0,2,0,0,0,0|2,0,0]=4 5957 B13R1.19 SCCC(=O)Nc1ccc(cc1)Cl Amb17305726 [0,2,0,0,0,0|2,0,0]=4 5958 B13R1.19 SCCC(=O)Nc1ccc(cc1)F Amb17305727 [0,2,0,0,0,0|2,0,0]=4 5959 B13R1.19 [N-]=[N+]=NC(=O)Cc1ccc(F)cc1 Amb25137249 [0,2,0,0,0,0|2,0,0]=4 5960 B13R1.20 BrCCC(=O)Nc1cccc(c1)Cl Amb17328448 [0,2,0,0,0,0|2,0,0]=4 5961 B13R1.20 BrCCC(=O)Nc1cccc(c1)F Amb17323635 [0,2,0,0,0,0|2,0,0]=4 5962 B13R1.20 BrCCC(=O)Nc1cccc(c1)O Amb17324280 [0,2,0,0,0,0|2,0,0]=4 5963 B13R1.20 C#CCC(=O)Cc1cccc(Br)c1 Amb25090029 [0,2,0,0,0,0|1,0,1]=4 5964 B13R1.20 C#CCC(=O)Cc1cccc(Cl)c1 Amb19079202 [0,2,0,0,0,0|1,0,1]=4 5965 B13R1.20 C#CCC(=O)Cc1cccc(F)c1 Amb18808840 [0,2,0,0,0,0|1,0,1]=4 5966 B13R1.20 C#CCC(=O)Cc1cccc(N)c1 Amb25843109 [0,2,0,0,0,0|1,0,1]=4 5967 B13R1.20 CC#CC(=O)Nc1cc(Cl)ccc1 Amb22462111 [0,2,0,0,0,0|2,0,0]=4 5968 B13R1.20 CC#CC(=O)Nc1cc(F)ccc1 Amb24583999 [0,2,0,0,0,0|2,0,0]=4 5969 B13R1.20 CC#CC(=O)Nc1cc(I)ccc1 Amb24460603 [0,2,0,0,0,0|2,0,0]=4 5970 B13R1.20 CC#CC(=O)Nc1cc(O)ccc1 Amb24645586 [0,2,0,0,0,0|2,0,0]=4 5971 B13R1.20 CC#CC(=O)Oc1cc(Br)ccc1 Amb24393733 [0,2,0,0,0,0|2,0,0]=4 5972 B13R1.20 CCCC(=O)Cc1cccc(c1)C Amb17138796 [0,2,0,0,0,0|1,0,0]=3 5973 B13R1.20 CCCC(=O)Cc1cccc(c1)Cl Amb17139627 [0,2,0,0,0,0|1,0,0]=3 5974 B13R1.20 CCCC(=O)Cc1cccc(c1)F Amb17138962 [0,2,0,0,0,0|1,0,0]=3 5975 B13R1.20 CCCC(=O)Nc1cccc(c1)N Amb10609260 [0,2,0,0,0,0|2,0,0]=4 5976 B13R1.20 CCCC(=O)Nc1cccc(c1)N Amb1798141 [0,2,0,0,0,0|2,0,0]=4 5977 B13R1.20 CCNC(=N)Cc1cc(Br)ccc1 Amb25057852 [0,2,0,0,0,0|2,0,0]=4 5978 B13R1.20 CCNC(=N)Cc1cc(F)ccc1 Amb24465561 [0,2,0,0,0,0|2,0,0]=4 5979 B13R1.20 CCNC(=O)Cc1cc(Br)ccc1 Amb23111024 [0,2,0,0,0,0|1,0,0]=3 5980 B13R1.20 CCNC(=O)Cc1cc(Cl)ccc1 Amb23086727 [0,2,0,0,0,0|1,0,0]=3 5981 B13R1.20 CCNC(=O)Cc1cc(I)ccc1 Amb25832331 [0,2,0,0,0,0|1,0,0]=3 5982 B13R1.20 CCNC(=O)Cc1cc(O)ccc1 Amb18178662 [0,2,0,0,0,0|1,0,0]=3 5983 B13R1.20 CCNC(=O)Nc1cccc(c1)C Amb1233666 [0,2,0,0,0,0|2,0,0]=4 5984 B13R1.20 CCNC(=O)Nc1cccc(c1)Cl Amb1234227 [0,2,0,0,0,0|2,0,0]=4 5985 B13R1.20 CCNC(=O)Oc1cccc(Br)c1 Amb25057413 [0,2,0,0,0,0|2,0,0]=4 5986 B13R1.20 CCNC(=O)Oc1cccc(Cl)c1 Amb25802684 [0,2,0,0,0,0|2,0,0]=4 5987 B13R1.20 CCOC(=N)Cc1cc(Cl)ccc1 Amb20673155 [0,2,0,0,0,0|1,0,0]=3 5988 B13R1.20 CCOC(=O)Cc1c[n]cc(Cl)[n]1 Amb24087729 [0,2,0,0,0,0|2,0,0]=4 5989 B13R1.20 CCOC(=O)Cc1c[n]cc(N)[n]1 Amb24087728 [0,2,0,0,0,0|2,0,0]=4 5990 B13R1.20 CCOC(=O)Cc1cc(Br)c[n]c1 Amb21857707 [0,2,0,0,0,0|1,0,0]=3 5991 B13R1.20 CCOC(=O)Cc1cc(F)c[n]c1 Amb19068169 [0,2,0,0,0,0|1,0,0]=3 5992 B13R1.20 CCOC(=O)Cc1cc(I)ccc1 Amb23402106 [0,2,0,0,0,0|0,0,0]=2 5993 B13R1.20 CCOC(=O)Cc1cc[n]c(N)[n]1 Amb22899362 [0,2,0,0,0,0|2,0,0]=4 5994 B13R1.20 CCOC(=O)Cc1ccc[n+](c1)[O-] Amb10553693 [0,2,0,0,0,0|1,0,0]=3 5995 B13R1.20 CCOC(=O)Cc1cccc(Br)[n]1 Amb22001965 [0,2,0,0,0,0|1,0,0]=3 5996 B13R1.20 CCOC(=O)Cc1cccc(Cl)[n]1 Amb22490590 [0,2,0,0,0,0|1,0,0]=3 5997 B13R1.20 CCOC(=O)Cc1cccc(c1)Br Amb17349305 [0,2,0,0,0,0|0,0,0]=2 5998 B13R1.20 CCOC(=O)Cc1cccc(c1)O Amb17614082 [0,2,0,0,0,0|0,0,0]=2 5999 B13R1.20 CCOC(=O)Cc1cccc(n1)C Amb15692898 [0,2,0,0,0,0|1,0,0]=3 6000 B13R1.20 CCOC(=O)Nc1c[n+]([O-])ccc1 Amb24310155 [0,2,0,0,0,0|2,0,0]=4 6001 B13R1.20 CCOC(=O)Nc1c[n]cc(Cl)c1 Amb24490168 [0,2,0,0,0,0|2,0,0]=4 6002 B13R1.20 CCOC(=O)Nc1cc[n]c(Br)c1 Amb24470608 [0,2,0,0,0,0|2,0,0]=4 6003 B13R1.20 CCOC(=O)Nc1cc[n]c(Cl)c1 Amb22462755 [0,2,0,0,0,0|2,0,0]=4 6004 B13R1.20 CCOC(=O)Nc1cc[n]c(N)c1 Amb24737296 [0,2,0,0,0,0|2,0,0]=4 6005 B13R1.20 CCOC(=O)Nc1ccc[n+](c1)C Amb10553788 [0,2,0,0,0,0|2,0,0]=4 6006 B13R1.20 CCOC(=O)Nc1cccc(F)[n]1 Amb24330398 [0,2,0,0,0,0|2,0,0]=4 6007 B13R1.20 CCOC(=O)Nc1cccc(F)c1 Amb17786024 [0,2,0,0,0,0|1,0,0]=3 6008 B13R1.20 CCOC(=O)Nc1cccc(I)c1 Amb24400790 [0,2,0,0,0,0|1,0,0]=3 6009 B13R1.20 CCOC(=O)Nc1cccc(c1)N Amb13949212 [0,2,0,0,0,0|1,0,0]=3 6010 B13R1.20 CCOC(=O)Nc1cccc(n1)C Amb10553731 [0,2,0,0,0,0|2,0,0]=4 6011 B13R1.20 CCOC(=O)Nc1nccc(c1)C Amb10553730 [0,2,0,0,0,0|2,0,0]=4 6012 B13R1.20 CCSC(=O)Nc1cccc(O)c1 Amb24724710 [0,2,0,0,0,0|1,1,0]=4 6013 B13R1.20 CNCC(=O)Nc1cc(O)ccc1 Amb18290512 [0,2,0,0,0,0|2,0,0]=4 6014 B13R1.20 CNCC(=O)Nc1cccc(c1)F Amb2277698 [0,2,0,0,0,0|2,0,0]=4 6015 B13R1.20 CNCC(=O)Nc1cccc(c1)F Amb2370682 [0,2,0,0,0,0|2,0,0]=4 6016 B13R1.20 CNNC(=O)Nc1cc(F)ccc1 Amb25695436 [0,2,0,0,0,0|2,0,0]=4 6017 B13R1.20 COCC(=O)Nc1c[n]cc(Br)c1 Amb24715405 [0,2,0,0,0,0|2,0,0]=4 6018 B13R1.20 COCC(=O)Nc1c[n]cc(F)c1 Amb25045091 [0,2,0,0,0,0|2,0,0]=4 6019 B13R1.20 COCC(=O)Nc1cc(O)cc[n]1 Amb25034549 [0,2,0,0,0,0|2,0,0]=4 6020 B13R1.20 COCC(=O)Nc1cc[n]c(Br)c1 Amb24548788 [0,2,0,0,0,0|2,0,0]=4 6021 B13R1.20 COCC(=O)Nc1cc[n]c(Cl)c1 Amb24409418 [0,2,0,0,0,0|2,0,0]=4 6022 B13R1.20 COCC(=O)Nc1cccc(Cl)[n]1 Amb24599939 [0,2,0,0,0,0|2,0,0]=4 6023 B13R1.20 COCC(=O)Nc1cccc(c1)I Amb1882946 [0,2,0,0,0,0|1,0,0]=3 6024 B13R1.20 COCC(=O)Nc1cccc(c1)N Amb1112513 [0,2,0,0,0,0|1,0,0]=3 6025 B13R1.20 COCC(=O)Nc1cccc(c1)N Amb17622107 [0,2,0,0,0,0|1,0,0]=3 6026 B13R1.20 COCC(=O)Nc1cccc(n1)Br Amb11411769 [0,2,0,0,0,0|2,0,0]=4 6027 B13R1.20 CONC(=O)Cc1cccc(I)c1 Amb24363298 [0,2,0,0,0,0|0,0,0]=2 6028 B13R1.20 CONC(=O)Cc1cccc(O)c1 Amb25060914 [0,2,0,0,0,0|0,0,0]=2 6029 B13R1.20 CONC(=O)Cc1cccc(c1)F Amb10704852 [0,2,0,0,0,0|0,0,0]=2 6030 B13R1.20 CONC(=O)Nc1cc(Br)ccc1 Amb24719165 [0,2,0,0,0,0|1,0,0]=3 6031 B13R1.20 CONC(=O)Nc1cc(Cl)[n]cc1 Amb22455000 [0,2,0,0,0,0|2,0,0]=4 6032 B13R1.20 CONC(=O)Nc1cccc(F)[n]1 Amb25344439 [0,2,0,0,0,0|2,0,0]=4 6033 B13R1.20 CONC(=O)Nc1cccc(c1)Cl Amb16969938 [0,2,0,0,0,0|1,0,0]=3 6034 B13R1.20 CONC(=S)Nc1cc(Cl)ccc1 Amb25727807 [0,2,0,0,0,0|1,1,0]=4 6035 B13R1.20 CO\N=C(\N)/Cc1cccc(Br)c1 Amb24335160 [0,2,0,0,0,0|1,0,0]=3 6036 B13R1.20 CO\N=C(\N)/Cc1cccc(Cl)c1 Amb24335161 [0,2,0,0,0,0|1,0,0]=3 6037 B13R1.20 CSCC(=O)Nc1cccc(F)c1 Amb19382420 [0,2,0,0,0,0|1,1,0]=4 6038 B13R1.20 CSCC(=O)Nc1cccc(N)c1 Amb18971630 [0,2,0,0,0,0|1,1,0]=4 6039 B13R1.20 CSCC(=O)Nc1cccc(c1)Cl Amb15701918 [0,2,0,0,0,0|1,1,0]=4 6040 B13R1.20 C\C=C\C(=O)Cc1c[n]cc(Br)c1 Amb24401246 [0,2,0,0,0,0|2,0,0]=4 6041 B13R1.20 C\C=C\C(=O)Cc1cc[n]c(N)c1 Amb24496416 [0,2,0,0,0,0|2,0,0]=4 6042 B13R1.20 C\C=C\C(=O)Cc1cccc(Cl)c1 Amb24496476 [0,2,0,0,0,0|1,0,0]=3 6043 B13R1.20 C\C=C\C(=O)Cc1cccc(F)c1 Amb24496477 [0,2,0,0,0,0|1,0,0]=3 6044 B13R1.20 C\C=C\C(=O)Oc1cccc(F)c1 Amb24393532 [0,2,0,0,0,0|2,0,0]=4 6045 B13R1.20 C\C=C\C(=O)Oc1cccc(I)c1 Amb24703922 [0,2,0,0,0,0|2,0,0]=4 6046 B13R1.20 C\C=C\C(=O)Oc1cccc(O)c1 Amb24745741 [0,2,0,0,0,0|2,0,0]=4 6047 B13R1.20 Cc1c[n]cc(CC(=O)NCC)c1 Amb25846053 [0,2,0,0,0,0|2,0,0]=4 6048 B13R1.20 Cc1c[n]cc(CC(=O)NOC)c1 Amb25285097 [0,2,0,0,0,0|1,0,0]=3 6049 B13R1.20 Cc1c[n]cc(c1)NC(=O)NOC Amb24672326 [0,2,0,0,0,0|2,0,0]=4 6050 B13R1.20 Cc1cc(CC(=N)OCC)ccc1 Amb20673148 [0,2,0,0,0,0|1,0,0]=3 6051 B13R1.20 Cc1cc(CC(=O)CC#C)ccc1 Amb18185729 [0,2,0,0,0,0|1,0,1]=4 6052 B13R1.20 Cc1cc(CC(=O)N=C=O)ccc1 Amb25156953 [0,2,0,0,0,0|1,0,1]=4 6053 B13R1.20 Cc1cc(CC(=O)N=C=S)ccc1 Amb18327865 [0,2,0,0,0,0|1,0,1]=4 6054 B13R1.20 Cc1cc(CC(=O)N=[N+]=[N-])ccc1 Amb25835135 [0,2,0,0,0,0|2,0,0]=4 6055 B13R1.20 Cc1cc(CC(=O)NC=O)ccc1 Amb25702358 [0,2,0,0,0,0|1,0,1]=4 6056 B13R1.20 Cc1cc(C\C(\N)=N/OC)ccc1 Amb25702573 [0,2,0,0,0,0|1,0,0]=3 6057 B13R1.20 Cc1cc(cc[n]1)NC(=O)OCC Amb24721987 [0,2,0,0,0,0|2,0,0]=4 6058 B13R1.20 Cc1cc(ccc1)NC(=O)CCBr Amb19748477 [0,2,0,0,0,0|2,0,0]=4 6059 B13R1.20 Cc1cc(ccc1)NC(=O)CNC Amb21959010 [0,2,0,0,0,0|2,0,0]=4 6060 B13R1.20 Cc1cc(ccc1)NC(=O)NNC Amb24374004 [0,2,0,0,0,0|2,0,0]=4 6061 B13R1.20 Cc1cc(ccc1)NC(=O)ON=C Amb24631799 [0,2,0,0,0,0|1,0,1]=4 6062 B13R1.20 Cc1cc(ccc1)NC(=S)OCC Amb24308973 [0,2,0,0,0,0|1,1,0]=4 6063 B13R1.20 Cc1cc(ccc1)OC(=O)CCC Amb24063564 [0,2,0,0,0,0|2,0,0]=4 6064 B13R1.20 Cc1cc(ccc1)OC(=O)NCC Amb24490235 [0,2,0,0,0,0|2,0,0]=4 6065 B13R1.20 Cc1cc(ccc1)OC(=O)NCO Amb25082891 [0,2,0,0,0,0|2,0,0]=4 6066 B13R1.20 Cc1cc(ccc1)OC(=O)\C=C\C Amb25787919 [0,2,0,0,0,0|2,0,0]=4 6067 B13R1.20 Cc1cc(ccc1)SC(=O)NCC Amb22486823 [0,2,0,0,0,0|2,0,0]=4 6068 B13R1.20 Cc1cc[n]c(c1)NC(=O)NOC Amb25306024 [0,2,0,0,0,0|2,0,0]=4 6069 B13R1.20 Cc1cccc(CC(=O)OCC)[n]1 Amb24081752 [0,2,0,0,0,0|1,0,0]=3 6070 B13R1.20 ClCCC(=O)Nc1cccc(c1)Br Amb1126487 [0,2,0,0,0,0|2,0,0]=4 6071 B13R1.20 ClCCC(=O)Nc1cccc(c1)C Amb1126815 [0,2,0,0,0,0|2,0,0]=4 6072 B13R1.20 ClCCC(=O)Nc1cccc(c1)O Amb10608630 [0,2,0,0,0,0|2,0,0]=4 6073 B13R1.20 N#CCC(=O)Cc1cccc(c1)Br Amb17254034 [0,2,0,0,0,0|1,0,1]=4 6074 B13R1.20 N#CCC(=O)Cc1cccc(c1)C Amb17232942 [0,2,0,0,0,0|1,0,1]=4 6075 B13R1.20 N#CCC(=O)Cc1cccc(c1)Cl Amb17235849 [0,2,0,0,0,0|1,0,1]=4 6076 B13R1.20 N#CNC(=O)Cc1cccc(Br)c1 Amb24570136 [0,2,0,0,0,0|1,0,1]=4 6077 B13R1.20 N#CNC(=O)Cc1cccc(O)c1 Amb25116113 [0,2,0,0,0,0|1,0,1]=4 6078 B13R1.20 NCCC(=O)Nc1cc(O)ccc1 Amb18290511 [0,2,0,0,0,0|2,0,0]=4 6079 B13R1.20 NCCC(=O)Nc1cccc(c1)C Amb1138768 [0,2,0,0,0,0|2,0,0]=4 6080 B13R1.20 NCCC(=O)Nc1cccc(c1)C Amb17622066 [0,2,0,0,0,0|2,0,0]=4 6081 B13R1.20 NCCC(=O)Nc1cccc(c1)Cl Amb15740944 [0,2,0,0,0,0|2,0,0]=4 6082 B13R1.20 NCCC(=O)Nc1cccc(c1)F Amb1102412 [0,2,0,0,0,0|2,0,0]=4 6083 B13R1.20 NCCC(=O)Nc1cccc(c1)F Amb13949209 [0,2,0,0,0,0|2,0,0]=4 6084 B13R1.20 NCCC(=O)Oc1cccc(c1)Br Amb17349675 [0,2,0,0,0,0|2,0,0]=4 6085 B13R1.20 NCCC(=O)Oc1cccc(c1)C Amb17335314 [0,2,0,0,0,0|2,0,0]=4 6086 B13R1.20 NCCC(=O)Oc1cccc(c1)Cl Amb17337484 [0,2,0,0,0,0|2,0,0]=4 6087 B13R1.20 NCCC(=O)Oc1cccc(c1)F Amb17335603 [0,2,0,0,0,0|2,0,0]=4 6088 B13R1.20 O=C(CCBr)Nc1cc(Br)ccc1 Amb25364215 [0,2,0,0,0,0|2,0,0]=4 6089 B13R1.20 O=C(CCS)Nc1cc(I)ccc1 Amb24603317 [0,2,0,0,0,0|2,0,0]=4 6090 B13R1.20 O=C(Cc1cccc(Br)c1)N=C=S Amb25700204 [0,2,0,0,0,0|1,0,1]=4 6091 B13R1.20 O=C(Cc1cccc(Cl)c1)N=C=O Amb25354165 [0,2,0,0,0,0|1,0,1]=4 6092 B13R1.20 O=C(Cc1cccc(Cl)c1)NC=O Amb24490431 [0,2,0,0,0,0|1,0,1]=4 6093 B13R1.20 O=C(Cc1cccc(F)c1)N=C=O Amb25755756 [0,2,0,0,0,0|1,0,1]=4 6094 B13R1.20 O=C(Cc1cccc(F)c1)NC=O Amb24490166 [0,2,0,0,0,0|1,0,1]=4 6095 B13R1.20 OCCC(=O)Nc1cccc(c1)Br Amb17349666 [0,2,0,0,0,0|2,0,0]=4 6096 B13R1.20 OCCC(=O)Nc1cccc(c1)C Amb17335301 [0,2,0,0,0,0|2,0,0]=4 6097 B13R1.20 SCCC(=O)Nc1cccc(c1)C Amb17305730 [0,2,0,0,0,0|2,0,0]=4 6098 B13R1.44 C#CCNC(=O)Cc1ccc[n]c1 Amb18183829 [0,2,0,0,0,0|2,0,0]=4 6099 B13R1.44 C#CCNC(=O)Cc1cccc[n]1 Amb18795264 [0,2,0,0,0,0|2,0,0]=4 6100 B13R1.44 C#CCNC(=O)Cc1ccccc1 Amb18185767 [0,2,0,0,0,0|1,0,0]=3 6101 B13R1.44 C#CCNC(=O)Oc1ccccc1 Amb18808641 [0,2,0,0,0,0|2,0,0]=4 6102 B13R1.44 C#CCOC(=O)Nc1ccccc1 Amb2505044 [0,2,0,0,0,0|1,0,0]=3 6103 B13R1.44 C#C\C=C\C(=O)Cc1ccccc1 Amb25264868 [0,2,0,0,0,0|1,0,1]=4 6104 B13R1.44 C=CC#CC(=O)Cc1ccccc1 Amb25717715 [0,2,0,0,0,0|1,0,1]=4 6105 B13R1.44 C=CCCC(=O)Nc1ccccc1 Amb20655805 [0,2,0,0,0,0|2,0,0]=4 6106 B13R1.44 C=CCNC(=O)Nc1ccccc1 Amb1233611 [0,2,0,0,0,0|2,0,0]=4 6107 B13R1.44 C=CCOC(=O)Cc1ccccc1 Amb22230218 [0,2,0,0,0,0|0,0,0]=2 6108 B13R1.44 C=CCOC(=O)Nc1ccc[n]c1 Amb25854033 [0,2,0,0,0,0|2,0,0]=4 6109 B13R1.44 C=CCOC(=O)Nc1cccc[n]1 Amb25721848 [0,2,0,0,0,0|2,0,0]=4 6110 B13R1.44 C=CCOC(=O)Nc1ccccc1 Amb24365247 [0,2,0,0,0,0|1,0,0]=3 6111 B13R1.44 C=CCOC(=O)Oc1ccccc1 Amb22360640 [0,2,0,0,0,0|1,0,0]=3 6112 B13R1.44 C=CCSC(=O)Nc1ccccc1 Amb24728386 [0,2,0,0,0,0|1,1,0]=4 6113 B13R1.44 C=CC\N=C(\N)/Cc1ccccc1 Amb23569055 [0,2,0,0,0,0|2,0,0]=4 6114 B13R1.44 CC#CCC(=O)Cc1c[n]ccc1 Amb18807797 [0,2,0,0,0,0|2,0,0]=4 6115 B13R1.44 CC#CCC(=O)Cc1cc[n]cc1 Amb18807798 [0,2,0,0,0,0|2,0,0]=4 6116 B13R1.44 CC#CCC(=O)Cc1cccc[n]1 Amb18183757 [0,2,0,0,0,0|2,0,0]=4 6117 B13R1.44 CC#CCC(=O)Cc1ccccc1 Amb18183692 [0,2,0,0,0,0|1,0,0]=3 6118 B13R1.44 CC(\C=N\OC)=Cc1ccccc1 Amb24335529 [0,2,0,0,0,0|1,0,1]=4 6119 B13R1.44 CCC#CC(=O)Cc1ccccc1 Amb25834345 [0,2,0,0,0,0|1,0,0]=3 6120 B13R1.44 CCCNC(=O)Nc1ccccc1 Amb1233730 [0,2,0,0,0,0|2,0,0]=4 6121 B13R1.44 CCCOC(=O)Nc1c[n]ccc1 Amb25237614 [0,2,0,0,0,0|2,0,0]=4 6122 B13R1.44 CCCOC(=O)Nc1cc[n]cc1 Amb25334198 [0,2,0,0,0,0|2,0,0]=4 6123 B13R1.44 CCC\N=C(\N)/Cc1ccccc1 Amb23569054 [0,2,0,0,0,0|2,0,0]=4 6124 B13R1.44 CCOCC(=O)Cc1cccc[n]1 Amb22754014 [0,2,0,0,0,0|1,0,0]=3 6125 B13R1.44 CCONC(=N)Nc1ccccc1 Amb25804276 [0,2,0,0,0,0|2,0,0]=4 6126 B13R1.44 CCONC(=O)Nc1c[n]ccc1 Amb24422225 [0,2,0,0,0,0|2,0,0]=4 6127 B13R1.44 CCONC(=S)Nc1ccccc1 Amb25733078 [0,2,0,0,0,0|1,1,0]=4 6128 B13R1.44 CCSSC(=O)Nc1ccccc1 Amb25289236 [0,2,0,0,0,0|1,1,0]=4 6129 B13R1.44 CNCCC(=O)Nc1ccccc1 Amb15740952 [0,2,0,0,0,0|2,0,0]=4 6130 B13R1.44 COCCC(=O)Nc1cc[n]cc1 Amb25807306 [0,2,0,0,0,0|2,0,0]=4 6131 B13R1.44 COCCC(=O)Nc1ccc[n]c1 Amb25370207 [0,2,0,0,0,0|2,0,0]=4 6132 B13R1.44 COCCC(=O)Nc1cccc[n]1 Amb24510311 [0,2,0,0,0,0|2,0,0]=4 6133 B13R1.44 COCCC(=O)Nc1ccccc1 Amb24493758 [0,2,0,0,0,0|1,0,0]=3 6134 B13R1.44 COCNC(=O)Nc1cc[n]cc1 Amb24640396 [0,2,0,0,0,0|2,0,0]=4 6135 B13R1.44 COCNC(=S)Nc1ccccc1 Amb25223180 [0,2,0,0,0,0|1,1,0]=4 6136 B13R1.44 CONCC(=O)Nc1c[n]ccc1 Amb24591758 [0,2,0,0,0,0|2,0,0]=4 6137 B13R1.44 CONCC(=O)Nc1ccccc1 Amb25039334 [0,2,0,0,0,0|1,0,0]=3 6138 B13R1.44 CO\N=C\C(Br)=Cc1ccccc1 Amb24529797 [0,2,0,0,0,0|1,0,1]=4 6139 B13R1.44 CO\N=C\C(Cl)=Cc1ccccc1 Amb24748007 [0,2,0,0,0,0|1,0,1]=4 6140 B13R1.44 CSCNC(=O)Nc1ccccc1 Amb24741724 [0,2,0,0,0,0|1,1,0]=4 6141 B13R1.44 C\C=C\NC(=O)Nc1ccccc1 Amb24654984 [0,2,0,0,0,0|2,0,0]=4 6142 B13R1.44 C\C=N\NC(=O)Nc1ccccc1 Amb24417963 [0,2,0,0,0,0|2,0,0]=4 6143 B13R1.44 C\C=N\OC(=O)Nc1ccccc1 Amb24505322 [0,2,0,0,0,0|1,0,0]=3 6144 B13R1.44 C\N=C\NC(=O)Nc1ccccc1 Amb24728367 [0,2,0,0,0,0|2,0,0]=4 6145 B13R1.44 ClCCCC(=O)Nc1ccccc1 Amb1125144 [0,2,0,0,0,0|2,0,0]=4 6146 B13R1.44 ClCCNC(=O)Cc1ccccc1 Amb2429404 [0,2,0,0,0,0|1,0,0]=3 6147 B13R1.44 ClCCOC(=O)Nc1cccnc1 Amb13952803 [0,2,0,0,0,0|2,0,0]=4 6148 B13R1.44 N#CCCC(=O)Nc1ccccc1 Amb17334976 [0,2,0,0,0,0|2,0,0]=4 6149 B13R1.44 N#CCCC(=O)Oc1ccccc1 Amb17335036 [0,2,0,0,0,0|2,0,0]=4 6150 B13R1.44 N#CCNC(=O)Cc1cc[n]cc1 Amb24676309 [0,2,0,0,0,0|2,0,0]=4 6151 B13R1.44 N#CCNC(=O)Cc1ccc[n]c1 Amb24464474 [0,2,0,0,0,0|2,0,0]=4 6152 B13R1.44 N#CCNC(=O)Oc1ccccc1 Amb18180566 [0,2,0,0,0,0|2,0,0]=4 6153 B13R1.44 N#CCNC(=S)Cc1ccccc1 Amb24728278 [0,2,0,0,0,0|1,1,0]=4 6154 B13R1.44 NCCCC(=O)Nc1ccccc1 Amb13952779 [0,2,0,0,0,0|2,0,0]=4 6155 B13R1.44 NCCNC(=O)Nc1ccccc1 Amb10808639 [0,2,0,0,0,0|2,0,0]=4 6156 B13R1.44 NCCNC(=O)Nc1ccccc1 Amb15741119 [0,2,0,0,0,0|2,0,0]=4 6157 B13R1.44 NCCOC(=O)Nc1ccccc1 Amb25856964 [0,2,0,0,0,0|1,0,0]=3 6158 B13R1.44 NC\C=C\C(=O)Nc1ccccc1 Amb25697858 [0,2,0,0,0,0|2,0,0]=4 6159 B13R1.44 O=C(CCC=O)Nc1ccccc1 Amb25163545 [0,2,0,0,0,0|2,0,0]=4 6160 B13R1.44 O=C(CCCS)Nc1ccccc1 Amb25234554 [0,2,0,0,0,0|2,0,0]=4 6161 B13R1.44 O=C(Cc1ccccc1)OCCBr Amb24065428 [0,2,0,0,0,0|0,0,0]=2 6162 B13R1.44 O=C(Cc1ccccc1)OCCCl Amb24065572 [0,2,0,0,0,0|0,0,0]=2 6163 B13R1.44 O=C(NCCF)Oc1ccccc1 Amb24096857 [0,2,0,0,0,0|2,0,0]=4 6164 B13R1.44 O=C(Nc1cc[n]cc1)OCCF Amb25685862 [0,2,0,0,0,0|2,0,0]=4 6165 B13R1.44 O=C(Nc1ccc[n]c1)OCCF Amb25694770 [0,2,0,0,0,0|2,0,0]=4 6166 B13R1.44 O=C(Nc1ccccc1)NCCF Amb25289085 [0,2,0,0,0,0|2,0,0]=4 6167 B13R1.44 O=C(Nc1ccccc1)OCCBr Amb22346582 [0,2,0,0,0,0|1,0,0]=3 6168 B13R1.44 O=C(Nc1ccccc1)OCCCl Amb22369350 [0,2,0,0,0,0|1,0,0]=3 6169 B13R1.44 O=CCNC(=O)Cc1ccccc1 Amb17102089 [0,2,0,0,0,0|1,0,0]=3 6170 B13R1.44 O=CNNC(=O)Cc1ccccc1 Amb2582679 [0,2,0,0,0,0|1,0,1]=4 6171 B13R1.44 OCC#CC(=O)Cc1ccccc1 Amb24584488 [0,2,0,0,0,0|1,0,0]=3 6172 B13R1.44 OCCCC(=O)Nc1ccccc1 Amb17233533 [0,2,0,0,0,0|2,0,0]=4 6173 B13R1.44 OCCNC(=O)Cc1ccccc1 Amb2437031 [0,2,0,0,0,0|1,0,0]=3 6174 B13R1.44 OCCOC(=O)Nc1c[n]ccc1 Amb24489996 [0,2,0,0,0,0|2,0,0]=4 6175 B13R1.44 OCCOC(=O)Nc1cc[n]cc1 Amb25100115 [0,2,0,0,0,0|2,0,0]=4 6176 B13R1.44 OCCSC(=O)Nc1ccccc1 Amb22466796 [0,2,0,0,0,0|1,1,0]=4 6177 B13R1.44 OC\C=C\C(=O)Nc1ccccc1 Amb24727001 [0,2,0,0,0,0|2,0,0]=4 6178 B13R1.47 BrCCC(=O)N(c1ccccc1)C Amb17324151 [0,2,0,0,0,0|2,0,0]=4 6179 B13R1.47 C#CCC(=O)C(N)c1ccccc1 Amb25849120 [0,2,0,0,0,0|1,0,1]=4 6180 B13R1.47 C#CCC(=O)[C@H](N)c1ccccc1 Amb24761241 [0,2,0,0,0,0|1,0,1]=4 6181 B13R1.47 CC(C(=O)N=C=S)c1ccccc1 Amb25158608 [0,2,0,0,0,0|1,0,1]=4 6182 B13R1.47 CC(C(=O)N=[N+]=[N-])c1ccccc1 Amb24356648 [0,2,0,0,0,0|2,0,0]=4 6183 B13R1.47 CC(C(=O)NC#N)c1ccccc1 Amb24680855 [0,2,0,0,0,0|1,0,1]=4 6184 B13R1.47 CC(C(=O)\C=N\N)c1ccccc1 Amb24399076 [0,2,0,0,0,0|2,0,0]=4 6185 B13R1.47 CC=C=C(C(c1ccccc1)O)C Amb17594415 [0,2,0,0,0,0|2,0,0]=4 6186 B13R1.47 CCCC(=O)C(=O)c1ccccc1 Amb17594478 [0,2,0,0,0,0|1,0,1]=4 6187 B13R1.47 CCCC(=O)N(N)c1ccccc1 Amb24096809 [0,2,0,0,0,0|2,0,0]=4 6188 B13R1.47 CCNC(=O)C(=O)c1ccccc1 Amb17335165 [0,2,0,0,0,0|1,0,1]=4 6189 B13R1.47 CCNC(=O)C(Br)c1ccccc1 Amb24534740 [0,2,0,0,0,0|1,0,0]=3 6190 B13R1.47 CCNC(=O)C(C)c1ccccc1 Amb24490195 [0,2,0,0,0,0|1,0,0]=3 6191 B13R1.47 CCNC(=O)C(Cl)c1ccc[n]c1 Amb18332182 [0,2,0,0,0,0|2,0,0]=4 6192 B13R1.47 CCNC(=O)C(N)c1cc[n]cc1 Amb24361723 [0,2,0,0,0,0|2,0,0]=4 6193 B13R1.47 CCNC(=O)C(N)c1ccc[n]c1 Amb24623445 [0,2,0,0,0,0|2,0,0]=4 6194 B13R1.47 CCNC(=O)C(O)c1ccc[n]c1 Amb24347416 [0,2,0,0,0,0|2,0,0]=4 6195 B13R1.47 CCNC(=O)C(c1ccccc1)O Amb17400707 [0,2,0,0,0,0|1,0,0]=3 6196 B13R1.47 CCNC(=O)N(N)c1ccccc1 Amb24490460 [0,2,0,0,0,0|2,0,0]=4 6197 B13R1.47 CCNC(=O)[C@@H](O)c1ccccc1 Amb24358180 [0,2,0,0,0,0|1,0,0]=3 6198 B13R1.47 CCNC(=O)[C@H](C)c1ccccc1 Amb25780108 [0,2,0,0,0,0|1,0,0]=3 6199 B13R1.47 CCNC(=O)[C@H](O)c1ccccc1 Amb24468904 [0,2,0,0,0,0|1,0,0]=3 6200 B13R1.47 CCNC(=O)[C@H](c1ccccc1)N Amb17233443 [0,2,0,0,0,0|1,0,0]=3 6201 B13R1.47 CCOC(=O)C(=C)c1ccccc1 Amb10602132 [0,2,0,0,0,0|0,0,1]=3 6202 B13R1.47 CCOC(=O)C(=O)c1c[n]ccc1 Amb19957923 [0,2,0,0,0,0|1,0,1]=4 6203 B13R1.47 CCOC(=O)C(=O)c1ccccc1 Amb1216483 [0,2,0,0,0,0|0,0,1]=3 6204 B13R1.47 CCOC(=O)C(Br)c1cc[n]cc1 Amb24309216 [0,2,0,0,0,0|1,0,0]=3 6205 B13R1.47 CCOC(=O)C(Br)c1cccc[n]1 Amb24066454 [0,2,0,0,0,0|1,0,0]=3 6206 B13R1.47 CCOC(=O)C(Cl)[N]1=CC=CC=C1 Amb17772423 [0,2,0,0,0,0|1,0,0]=3 6207 B13R1.47 CCOC(=O)C(N)c1c[n]cc[n]1 Amb23401467 [0,2,0,0,0,0|2,0,0]=4 6208 B13R1.47 CCOC(=O)C(N)c1ccc[n]c1 Amb19003474 [0,2,0,0,0,0|1,0,0]=3 6209 B13R1.47 CCOC(=O)C(N)c1ccc[n]c1 Amb23401703 [0,2,0,0,0,0|1,0,0]=3 6210 B13R1.47 CCOC(=O)C(N)c1ccccn1 Amb17935885 [0,2,0,0,0,0|1,0,0]=3 6211 B13R1.47 CCOC(=O)C(N)c1ccncc1 Amb17935886 [0,2,0,0,0,0|1,0,0]=3 6212 B13R1.47 CCOC(=O)C(O)c1ccc[n]c1 Amb18186776 [0,2,0,0,0,0|1,0,0]=3 6213 B13R1.47 CCOC(=O)C(O)c1ccc[n]c1 Amb19351688 [0,2,0,0,0,0|1,0,0]=3 6214 B13R1.47 CCOC(=O)C([n+]1ccccc1)C Amb10554473 [0,2,0,0,0,0|1,0,0]=3 6215 B13R1.47 CCOC(=O)C(c1ccccc1)Cl Amb1647396 [0,2,0,0,0,0|0,0,0]=2 6216 B13R1.47 CCOC(=O)C(c1ccccc1)[NH3+] Amb1865585 [0,2,0,0,0,0|0,0,0]=2 6217 B13R1.47 CCOC(=O)[C@@H](N)c1ccccc1 Amb17678824 [0,2,0,0,0,0|0,0,0]=2 6218 B13R1.47 CCOC(=O)[C@H](N)c1ccccc1 Amb19889826 [0,2,0,0,0,0|0,0,0]=2 6219 B13R1.47 CCOC(=O)[C@H](c1ccccc1)N Amb10844947 [0,2,0,0,0,0|0,0,0]=2 6220 B13R1.47 CN(C(=O)NCC)c1ccccc1 Amb25237616 [0,2,0,0,0,0|2,0,0]=4 6221 B13R1.47 CN(C(=O)OCC)c1cccc[n]1 Amb24095648 [0,2,0,0,0,0|2,0,0]=4 6222 B13R1.47 CONC(=O)C(C)c1ccc[n]c1 Amb24350036 [0,2,0,0,0,0|1,0,0]=3 6223 B13R1.47 CONC(=O)C(O)c1ccc[n]c1 Amb24618683 [0,2,0,0,0,0|1,0,0]=3 6224 B13R1.47 CONC(=O)C(O)c1ccccc1 Amb24739076 [0,2,0,0,0,0|0,0,0]=2 6225 B13R1.47 CONC(=O)[C@H](C)c1ccccc1 Amb24660692 [0,2,0,0,0,0|0,0,0]=2 6226 B13R1.47 CONC(=O)[C@H](O)c1ccccc1 Amb24335120 [0,2,0,0,0,0|0,0,0]=2 6227 B13R1.47 C\C(=C/CC)\C(O)c1ccccc1 Amb22546638 [0,2,0,0,0,0|2,0,0]=4 6228 B13R1.47 C\C(=C/CO)\C(O)c1ccccc1 Amb22547006 [0,2,0,0,0,0|2,0,0]=4 6229 B13R1.47 C\C(=C\CO)\C(O)c1ccccc1 Amb22547016 [0,2,0,0,0,0|2,0,0]=4 6230 B13R1.47 C\C(=N\OC)\C(C)c1ccccc1 Amb25822107 [0,2,0,0,0,0|1,0,0]=3 6231 B13R1.47 C\C(=N\OC)\C(O)c1ccccc1 Amb24371301 [0,2,0,0,0,0|1,0,0]=3 6232 B13R1.47 C\C(=N\OC)\[C@H](O)c1ccccc1 Amb25788901 [0,2,0,0,0,0|1,0,0]=3 6233 B13R1.47 C\C=C\C(=O)C(=C)c1ccccc1 Amb25190287 [0,2,0,0,0,0|1,0,1]=4 6234 B13R1.47 C\C=C\C(=O)C(C)c1ccccc1 Amb24529691 [0,2,0,0,0,0|1,0,0]=3 6235 B13R1.47 C\C=C\C(=O)C(O)c1ccccc1 Amb25179529 [0,2,0,0,0,0|1,0,0]=3 6236 B13R1.47 C\C=C\C(=O)[C@@H](O)c1ccccc1 Amb24577753 [0,2,0,0,0,0|1,0,0]=3 6237 B13R1.47 ClCCC(=O)N(c1ccccc1)C Amb1141646 [0,2,0,0,0,0|2,0,0]=4 6238 B13R1.47 N#CNC(=O)C(O)c1ccccc1 Amb24449276 [0,2,0,0,0,0|1,0,1]=4 6239 B13R1.47 NCCC(=O)N(c1ccccc1)C Amb1134878 [0,2,0,0,0,0|2,0,0]=4 6240 B13R1.47 OCCC(=O)N(c1ccccc1)C Amb17335302 [0,2,0,0,0,0|2,0,0]=4 6241 B13R1.47 [C-]#[N+]CC(=O)C(C)c1ccccc1 Amb24357188 [0,2,0,0,0,0|1,0,1]=4 6242 B13R1.79 CCCN(Cc1ccccc1)C=O Amb25251924 [0,2,0,0,0,0|2,0,0]=4 6243 B13R1.79 CCCN(Cc1ccccc1)OC Amb25098386 [0,2,0,0,0,0|2,0,0]=4 6244 B13R1.79 CCN(CC=O)Cc1ccccc1 Amb18186091 [0,2,0,0,0,0|2,0,0]=4 6245 B13R1.79 CCN\C(=N\c1ccccc1)\OC Amb25731849 [0,2,0,0,0,0|2,0,0]=4 6246 B13R1.79 CCN\C(\Cc1ccccc1)=N/N Amb18178429 [0,2,0,0,0,0|2,0,0]=4 6247 B13R1.79 CCOC(Nc1ccccc1)=S=O Amb24490202 [0,2,0,0,0,0|1,0,0]=3 6248 B13R1.79 CCO\C(=N\c1ccccc1)\S[Na] Amb22443641 [0,2,0,0,0,0|1,1,0]=4 6249 B13R1.79 CCO\C(\C=O)=C/c1ccccc1 Amb22546895 [0,2,0,0,0,0|0,0,1]=3 6250 B13R1.79 CCO\C(\NC)=N\c1ccccc1 Amb24374042 [0,2,0,0,0,0|2,0,0]=4 6251 B13R1.79 CC\C(\Cc1ccccc1)=C\C#N Amb25683666 [0,2,0,0,0,0|2,0,0]=4 6252 B13R1.79 CN\C(\Cc1ccccc1)=N\C#N Amb25180845 [0,2,0,0,0,0|2,0,0]=4 6253 B13R1.79 COC\C(=C/c1ccccc1)\C#N Amb10605337 [0,2,0,0,0,0|1,0,1]=4 6254 B13R1.79 COC\C(\Nc1ccccc1)=N/N Amb18178693 [0,2,0,0,0,0|2,0,0]=4 6255 B13R1.79 CON(CC#N)Cc1ccccc1 Amb25097479 [0,2,0,0,0,0|2,0,0]=4 6256 B13R1.79 CON(CCO)Cc1ccccc1 Amb25819964 [0,2,0,0,0,0|1,0,1]=4 6257 B13R1.79 CO\C(\NC#N)=N\c1ccccc1 Amb25090873 [0,2,0,0,0,0|2,0,0]=4 6258 B13R1.79 CO\N=C(/C#N)\Nc1ccccc1 Amb25825213 [0,2,0,0,0,0|2,0,0]=4 6259 B13R1.79 CSC\C(=C/c1ccccc1)\C=O Amb16232251 [0,2,0,0,0,0|0,1,1]=4 6260 B13R1.79 OCCN(Cc1ccccc1)C=O Amb18796127 [0,2,0,0,0,0|2,0,0]=4 6261 B13R1.348 CC(=C)CC(=O)Nc1ccccc1 Amb24759109 [0,2,0,0,0,0|2,0,0]=4 6262 B13R1.348 CC(=C)OC(=O)Nc1ccccc1 Amb25121132 [0,2,0,0,0,0|1,0,0]=3 6263 B13R1.348 CC(=N)NC(=O)Oc1ccccc1 Amb25288293 [0,2,0,0,0,0|2,0,0]=4 6264 B13R1.348 CC(=O)/C=C(\C)Cc1ccccc1 Amb17778969 [0,2,0,0,0,0|2,0,0]=4 6265 B13R1.348 CC(=O)CC(=O)Cc1cccc[n]1 Amb24076575 [0,2,0,0,0,0|2,0,0]=4 6266 B13R1.348 CC(=O)CC(=O)Oc1ccccc1 Amb22586480 [0,2,0,0,0,0|2,0,0]=4 6267 B13R1.348 CC(=O)NC(=O)Cc1ccccc1 Amb24073557 [0,2,0,0,0,0|1,0,0]=3 6268 B13R1.348 CC(=O)NC(=S)Cc1ccccc1 Amb25689518 [0,2,0,0,0,0|1,1,0]=4 6269 B13R1.348 CC(=O)OC(C)Cc1ccccc1 Amb24323251 [0,2,0,0,0,0|1,0,1]=4 6270 B13R1.348 CC(=O)SC(=O)Nc1ccccc1 Amb24396677 [0,2,0,0,0,0|1,1,0]=4 6271 B13R1.348 CC(=O)\C=C(\N)/Cc1ccccc1 Amb24739677 [0,2,0,0,0,0|2,0,0]=4 6272 B13R1.348 CC(=S)NC(=O)Cc1ccccc1 Amb25835179 [0,2,0,0,0,0|1,0,0]=3 6273 B13R1.348 CC(=S)NC(=O)Nc1ccccc1 Amb25104910 [0,2,0,0,0,0|2,0,0]=4 6274 B13R1.348 CC(C)=CC(=O)Cc1cc[n]cc1 Amb24455336 [0,2,0,0,0,0|2,0,0]=4 6275 B13R1.348 CC(C)NC(=O)Cc1ccc[n]c1 Amb25307733 [0,2,0,0,0,0|2,0,0]=4 6276 B13R1.348 CC(C)NC(=O)Cc1cccc[n]1 Amb25221330 [0,2,0,0,0,0|2,0,0]=4 6277 B13R1.348 CC(C)OC(=O)Nc1ccc[n]c1 Amb24668962 [0,2,0,0,0,0|2,0,0]=4 6278 B13R1.348 CC(C)\N=C(\N)/Cc1ccccc1 Amb23569053 [0,2,0,0,0,0|2,0,0]=4 6279 B13R1.348 CC(CC(=O)Cc1ccccc1)C Amb15690932 [0,2,0,0,0,0|1,0,0]=3 6280 B13R1.348 CC(Cl)CC(=O)Nc1ccccc1 Amb17836214 [0,2,0,0,0,0|2,0,0]=4 6281 B13R1.348 CC(Cl)OC(=O)Oc1ccccc1 Amb22054620 [0,2,0,0,0,0|1,0,0]=3 6282 B13R1.348 CC(N)CC(=O)Nc1ccccc1 Amb18968728 [0,2,0,0,0,0|2,0,0]=4 6283 B13R1.348 CC(O)CC(=O)Sc1ccccc1 Amb20671502 [0,2,0,0,0,0|2,0,0]=4 6284 B13R1.348 CC(O)NC(=O)Cc1ccccc1 Amb25737869 [0,2,0,0,0,0|1,0,0]=3 6285 B13R1.348 CC(OC(=S)Nc1ccccc1)C Amb1625289 [0,2,0,0,0,0|1,1,0]=4 6286 B13R1.348 CN(C)NC(=O)Cc1ccccc1 Amb24350087 [0,2,0,0,0,0|1,0,0]=3 6287 B13R1.348 CN(C)OC(=O)Nc1ccccc1 Amb25293780 [0,2,0,0,0,0|1,0,0]=3 6288 B13R1.348 CN(O)CC(=O)Nc1ccccc1 Amb25790561 [0,2,0,0,0,0|2,0,0]=4 6289 B13R1.348 CS(C)=CC(=O)Cc1ccccc1 Amb18048727 [0,2,0,0,0,0|0,1,0]=3 6290 B13R1.348 C[C@@H](N)CC(=O)Nc1ccccc1 Amb25312054 [0,2,0,0,0,0|2,0,0]=4 6291 B13R1.348 C[C@@H](O)CC(=O)Nc1ccccc1 Amb25075634 [0,2,0,0,0,0|2,0,0]=4 6292 B13R1.348 C[C@H](O)CC(=O)Nc1ccccc1 Amb24452163 [0,2,0,0,0,0|2,0,0]=4 6293 B13R1.348 C\C(\Cc1ccccc1)=C\C(C)O Amb25092323 [0,2,0,0,0,0|2,0,0]=4 6294 B13R1.348 C\C(\Cl)=C\C(=O)Nc1ccccc1 Amb22462104 [0,2,0,0,0,0|2,0,0]=4 6295 B13R1.348 C\C(\N)=C\C(=O)Cc1ccccc1 Amb25767909 [0,2,0,0,0,0|1,0,0]=3 6296 B13R1.348 C\C(\O)=C\C(=O)Cc1ccccc1 Amb24492639 [0,2,0,0,0,0|1,0,0]=3 6297 B13R1.348 NC(=N)NC(=O)Cc1ccccc1 Amb24426154 [0,2,0,0,0,0|1,0,1]=4 6298 B13R1.348 NC(=O)OC(=O)Nc1ccccc1 Amb25350415 [0,2,0,0,0,0|1,0,1]=4 6299 B13R1.348 O=C(C[N+](=O)[O-])Cc1ccccc1 Amb1107860 [0,2,0,0,0,0|2,0,0]=4 6300 B13R1.348 O=C(Cc1ccccc1)CC(=O)C Amb15692856 [0,2,0,0,0,0|1,0,0]=3 6301 B13R1.348 O=C(Nc1ccccc1)CC(=O)C Amb1210069 [0,2,0,0,0,0|2,0,0]=4 6302 B13R1.348 OC(=O)CC(=O)Cc1ccccc1 Amb18128104 [0,2,0,0,0,0|1,0,1]=4 6303 B13R1.470 BrCCC(=O)Nc1ccccc1C Amb17327783 [0,2,0,0,0,0|2,0,0]=4 6304 B13R1.470 BrCCC(=O)Nc1ccccc1Cl Amb17332540 [0,2,0,0,0,0|2,0,0]=4 6305 B13R1.470 BrCCC(=O)Nc1ccccc1O Amb17331112 [0,2,0,0,0,0|2,0,0]=4 6306 B13R1.470 C#CCC(=O)Cc1ccccc1Br Amb25040354 [0,2,0,0,0,0|1,0,1]=4 6307 B13R1.470 C#CCC(=O)Cc1ccccc1Cl Amb19079204 [0,2,0,0,0,0|1,0,1]=4 6308 B13R1.470 C#CCC(=O)Cc1ccccc1F Amb18808841 [0,2,0,0,0,0|1,0,1]=4 6309 B13R1.470 CC#CC(=O)Nc1ccccc1Br Amb24533498 [0,2,0,0,0,0|2,0,0]=4 6310 B13R1.470 CC#CC(=O)Nc1ccccc1Cl Amb25058406 [0,2,0,0,0,0|2,0,0]=4 6311 B13R1.470 CC#CC(=O)Nc1ccccc1N Amb24370425 [0,2,0,0,0,0|2,0,0]=4 6312 B13R1.470 CC=CC(=O)Nc1ccccc1Cl Amb22485115 [0,2,0,0,0,0|2,0,0]=4 6313 B13R1.470 CCCC(=O)Cc1ccccc1C Amb17138794 [0,2,0,0,0,0|1,0,0]=3 6314 B13R1.470 CCCC(=O)Cc1ccccc1Cl Amb17139625 [0,2,0,0,0,0|1,0,0]=3 6315 B13R1.470 CCCC(=O)Cc1ccccc1F Amb17138960 [0,2,0,0,0,0|1,0,0]=3 6316 B13R1.470 CCNC(=N)Cc1ccccc1Br Amb24747330 [0,2,0,0,0,0|2,0,0]=4 6317 B13R1.470 CCNC(=N)Cc1ccccc1Cl Amb24430254 [0,2,0,0,0,0|2,0,0]=4 6318 B13R1.470 CCNC(=N)Cc1ccccc1F Amb25686401 [0,2,0,0,0,0|2,0,0]=4 6319 B13R1.470 CCNC(=O)Cc1ccccc1Br Amb22230625 [0,2,0,0,0,0|1,0,0]=3 6320 B13R1.470 CCNC(=O)Cc1ccccc1Cl Amb23014083 [0,2,0,0,0,0|1,0,0]=3 6321 B13R1.470 CCNC(=O)Cc1ccccc1N Amb1121104 [0,2,0,0,0,0|1,0,0]=3 6322 B13R1.470 CCNC(=O)Cn1ccccc1=O Amb13961279 [0,2,0,0,0,0|2,0,0]=4 6323 B13R1.470 CCNC(=O)Nc1ccccc1C Amb2236972 [0,2,0,0,0,0|2,0,0]=4 6324 B13R1.470 CCNC(=O)Nc1ccccc1F Amb2236700 [0,2,0,0,0,0|2,0,0]=4 6325 B13R1.470 CCNC(=O)Oc1ccccc1Br Amb24414719 [0,2,0,0,0,0|2,0,0]=4 6326 B13R1.470 CCNC(=O)Oc1ccccc1Cl Amb22486818 [0,2,0,0,0,0|2,0,0]=4 6327 B13R1.470 CCNC(=O)Oc1ccccc1F Amb25057414 [0,2,0,0,0,0|2,0,0]=4 6328 B13R1.470 CCNC(=O)Oc1ccccc1O Amb24611188 [0,2,0,0,0,0|2,0,0]=4 6329 B13R1.470 CCOC(=N)Cc1ccccc1Cl Amb19083262 [0,2,0,0,0,0|1,0,0]=3 6330 B13R1.470 CCOC(=N)Cc1ccccc1Cl Amb20673156 [0,2,0,0,0,0|1,0,0]=3 6331 B13R1.470 CCOC(=N)Cc1ccccc1F Amb20673150 [0,2,0,0,0,0|1,0,0]=3 6332 B13R1.470 CCOC(=N)Nc1ccccc1O Amb24557161 [0,2,0,0,0,0|2,0,0]=4 6333 B13R1.470 CCOC(=O)CC1=CN=CNC1=O Amb19516969 [0,2,0,0,0,0|2,0,0]=4 6334 B13R1.470 CCOC(=O)CN1C=CC=CC1=O Amb18186767 [0,2,0,0,0,0|1,0,0]=3 6335 B13R1.470 CCOC(=O)CN1N=CC=CC1=O Amb18181548 [0,2,0,0,0,0|2,0,0]=4 6336 B13R1.470 CCOC(=O)C[n+]1ccccc1C Amb10553985 [0,2,0,0,0,0|1,0,0]=3 6337 B13R1.470 CCOC(=O)Cc1[n]c[n]cc1Br Amb22499191 [0,2,0,0,0,0|2,0,0]=4 6338 B13R1.470 CCOC(=O)Cc1[n]cccc1Br Amb21963898 [0,2,0,0,0,0|1,0,0]=3 6339 B13R1.470 CCOC(=O)Cc1[n]cccc1I Amb22499041 [0,2,0,0,0,0|1,0,0]=3 6340 B13R1.470 CCOC(=O)Cc1[n]cccc1N Amb22295863 [0,2,0,0,0,0|1,0,0]=3 6341 B13R1.470 CCOC(=O)Cc1[n]cccc1O Amb18648470 [0,2,0,0,0,0|1,0,0]=3 6342 B13R1.470 CCOC(=O)Cc1c[n]c[n]c1Cl Amb22494259 [0,2,0,0,0,0|2,0,0]=4 6343 B13R1.470 CCOC(=O)Cc1c[n]c[n]c1O Amb22002045 [0,2,0,0,0,0|2,0,0]=4 6344 B13R1.470 CCOC(=O)Cc1cc[n]cc1Br Amb21962528 [0,2,0,0,0,0|1,0,0]=3 6345 B13R1.470 CCOC(=O)Cc1cc[n]cc1N Amb18128678 [0,2,0,0,0,0|1,0,0]=3 6346 B13R1.470 CCOC(=O)Cc1cc[n]cc1N Amb24086005 [0,2,0,0,0,0|1,0,0]=3 6347 B13R1.470 CCOC(=O)Cc1ccc[n]c1Cl Amb21960759 [0,2,0,0,0,0|1,0,0]=3 6348 B13R1.470 CCOC(=O)Cc1cccc[n+]1C Amb10554009 [0,2,0,0,0,0|1,0,0]=3 6349 B13R1.470 CCOC(=O)Cc1ccccc1I Amb22475916 [0,2,0,0,0,0|0,0,0]=2 6350 B13R1.470 CCOC(=O)Cc1ccccc1O Amb17614081 [0,2,0,0,0,0|0,0,0]=2 6351 B13R1.470 CCOC(=O)Nc1[n]cccc1Br Amb25715056 [0,2,0,0,0,0|2,0,0]=4 6352 B13R1.470 CCOC(=O)Nc1[n]cccc1N Amb18128862 [0,2,0,0,0,0|2,0,0]=4 6353 B13R1.470 CCOC(=O)Nc1c[n]ccc1O Amb18129000 [0,2,0,0,0,0|2,0,0]=4 6354 B13R1.470 CCOC(=O)Nc1cc[n]cc1F Amb24684630 [0,2,0,0,0,0|2,0,0]=4 6355 B13R1.470 CCOC(=O)Nc1cc[n]cc1N Amb19002524 [0,2,0,0,0,0|2,0,0]=4 6356 B13R1.470 CCOC(=O)Nc1cc[n]cc1O Amb25120613 [0,2,0,0,0,0|2,0,0]=4 6357 B13R1.470 CCOC(=O)Nc1ccc[n]c1Br Amb18155630 [0,2,0,0,0,0|2,0,0]=4 6358 B13R1.470 CCOC(=O)Nc1ccc[n]c1N Amb18128863 [0,2,0,0,0,0|2,0,0]=4 6359 B13R1.470 CCOC(=O)Nc1ccc[n]c1O Amb24490364 [0,2,0,0,0,0|2,0,0]=4 6360 B13R1.470 CCOC(=O)Nc1cccc[n+]1[O-] Amb10553013 [0,2,0,0,0,0|2,0,0]=4 6361 B13R1.470 CCOC(=O)Nc1ccccc1O Amb18128818 [0,2,0,0,0,0|1,0,0]=3 6362 B13R1.470 CCOC(=O)Nc1ccccc1S Amb24444867 [0,2,0,0,0,0|1,0,0]=3 6363 B13R1.470 CCOC(=O)Nc1cccnc1Cl Amb17792635 [0,2,0,0,0,0|2,0,0]=4 6364 B13R1.470 CCOC(=O)Nc1ncccc1O Amb15692884 [0,2,0,0,0,0|2,0,0]=4 6365 B13R1.470 CNCC(=O)Nc1ccccc1Br Amb2277697 [0,2,0,0,0,0|2,0,0]=4 6366 B13R1.470 CNCC(=O)Nc1ccccc1Br Amb2370683 [0,2,0,0,0,0|2,0,0]=4 6367 B13R1.470 CNCC(=O)Nc1ccccc1Cl Amb2281752 [0,2,0,0,0,0|2,0,0]=4 6368 B13R1.470 CNCC(=O)Nc1ccccc1Cl Amb2370637 [0,2,0,0,0,0|2,0,0]=4 6369 B13R1.470 COCC(=O)Nc1[n]cccc1Br Amb24383758 [0,2,0,0,0,0|2,0,0]=4 6370 B13R1.470 COCC(=O)Nc1[n]cccc1O Amb25092758 [0,2,0,0,0,0|2,0,0]=4 6371 B13R1.470 COCC(=O)Nc1c[n]ccc1O Amb25728819 [0,2,0,0,0,0|2,0,0]=4 6372 B13R1.470 COCC(=O)Nc1cc[n]cc1I Amb24509990 [0,2,0,0,0,0|2,0,0]=4 6373 B13R1.470 COCC(=O)Nc1cc[n]cc1N Amb19002509 [0,2,0,0,0,0|2,0,0]=4 6374 B13R1.470 COCC(=O)Nc1ccccc1N Amb1121544 [0,2,0,0,0,0|1,0,0]=3 6375 B13R1.470 COCC(=O)Nc1ccccc1N Amb17622091 [0,2,0,0,0,0|1,0,0]=3 6376 B13R1.470 CONC(=O)CN1C=CC=NC1=O Amb25073455 [0,2,0,0,0,0|2,0,0]=4 6377 B13R1.470 CONC(=O)Cc1[n]cccc1F Amb25120678 [0,2,0,0,0,0|1,0,0]=3 6378 B13R1.470 CONC(=O)Cc1ccc[n]c1N Amb25099301 [0,2,0,0,0,0|1,0,0]=3 6379 B13R1.470 CONC(=O)Cc1ccccc1C Amb10694421 [0,2,0,0,0,0|0,0,0]=2 6380 B13R1.470 CONC(=O)Cc1ccccc1Cl Amb10704853 [0,2,0,0,0,0|0,0,0]=2 6381 B13R1.470 CONC(=O)Cc1ccccc1F Amb10704850 [0,2,0,0,0,0|0,0,0]=2 6382 B13R1.470 CONC(=O)Cc1ccccc1I Amb24660656 [0,2,0,0,0,0|0,0,0]=2 6383 B13R1.470 CONC(=O)Cc1ccccc1O Amb24489195 [0,2,0,0,0,0|0,0,0]=2 6384 B13R1.470 CONC(=O)Nc1ccc[n]c1Br Amb24403521 [0,2,0,0,0,0|2,0,0]=4 6385 B13R1.470 CONC(=O)Nc1ccccc1F Amb25153723 [0,2,0,0,0,0|1,0,0]=3 6386 B13R1.470 CONC(=O)Nc1ccccc1I Amb24529694 [0,2,0,0,0,0|1,0,0]=3 6387 B13R1.470 CONC(=O)Nc1ccccc1O Amb24718194 [0,2,0,0,0,0|1,0,0]=3 6388 B13R1.470 CONC(=S)Nc1ccccc1F Amb25185443 [0,2,0,0,0,0|1,1,0]=4 6389 B13R1.470 CSCC(=O)Nc1ccccc1Cl Amb15701901 [0,2,0,0,0,0|1,1,0]=4 6390 B13R1.470 CSCC(=O)Nc1ccccc1I Amb11214963 [0,2,0,0,0,0|1,1,0]=4 6391 B13R1.470 CSCC(=O)Nc1ccccc1O Amb25818151 [0,2,0,0,0,0|1,1,0]=4 6392 B13R1.470 C\C(\Cc1ccccc1F)=C\CN Amb24535386 [0,2,0,0,0,0|2,0,0]=4 6393 B13R1.470 C\C=C\C(=O)Cc1cc[n]cc1Cl Amb25753362 [0,2,0,0,0,0|2,0,0]=4 6394 B13R1.470 C\C=C\C(=O)Cc1ccccc1Br Amb25670609 [0,2,0,0,0,0|1,0,0]=3 6395 B13R1.470 C\C=C\C(=O)Cc1ccccc1Cl Amb24496371 [0,2,0,0,0,0|1,0,0]=3 6396 B13R1.470 C\C=C\C(=O)Cc1ccccc1F Amb24377009 [0,2,0,0,0,0|1,0,0]=3 6397 B13R1.470 C\C=C\C(=O)Nc1ccccc1Cl Amb24688589 [0,2,0,0,0,0|2,0,0]=4 6398 B13R1.470 C\C=C\C(=O)Nc1ccccc1I Amb25695751 [0,2,0,0,0,0|2,0,0]=4 6399 B13R1.470 C\C=C\C(=O)Oc1ccccc1F Amb24502526 [0,2,0,0,0,0|2,0,0]=4 6400 B13R1.470 C\C=C\C(=O)Oc1ccccc1I Amb24502527 [0,2,0,0,0,0|2,0,0]=4 6401 B13R1.470 C\C=C\C(=O)Oc1ccccc1O Amb24583610 [0,2,0,0,0,0|2,0,0]=4 6402 B13R1.470 Cc1[n]cccc1CC(=O)NOC Amb24673286 [0,2,0,0,0,0|1,0,0]=3 6403 B13R1.470 Cc1[n]cccc1CC(=O)OCC Amb24097206 [0,2,0,0,0,0|1,0,0]=3 6404 B13R1.470 Cc1c[n]ccc1CC(=O)NCC Amb25822145 [0,2,0,0,0,0|2,0,0]=4 6405 B13R1.470 Cc1c[n]ccc1CC(=O)OCC Amb22739815 [0,2,0,0,0,0|1,0,0]=3 6406 B13R1.470 Cc1c[n]ccc1NC(=O)COC Amb25071990 [0,2,0,0,0,0|2,0,0]=4 6407 B13R1.470 Cc1c[n]ccc1NC(=O)NOC Amb25317105 [0,2,0,0,0,0|2,0,0]=4 6408 B13R1.470 Cc1cc[n]cc1NC(=O)NOC Amb24335116 [0,2,0,0,0,0|2,0,0]=4 6409 B13R1.470 Cc1cc[n]cc1NC(=O)OCC Amb25372328 [0,2,0,0,0,0|2,0,0]=4 6410 B13R1.470 Cc1ccccc1CC(=N)OCC Amb20673147 [0,2,0,0,0,0|1,0,0]=3 6411 B13R1.470 Cc1ccccc1CC(=O)CC#C Amb18185728 [0,2,0,0,0,0|1,0,1]=4 6412 B13R1.470 Cc1ccccc1CC(=O)N=[N+]=[N-] Amb25702380 [0,2,0,0,0,0|2,0,0]=4 6413 B13R1.470 Cc1ccccc1CC(=O)NC=O Amb25055863 [0,2,0,0,0,0|1,0,1]=4 6414 B13R1.470 Cc1ccccc1C\C(\C)=N/OC Amb25796146 [0,2,0,0,0,0|1,0,0]=3 6415 B13R1.470 Cc1ccccc1NC(=N)OCC Amb25375687 [0,2,0,0,0,0|2,0,0]=4 6416 B13R1.470 Cc1ccccc1NC(=O)CCS Amb24490204 [0,2,0,0,0,0|2,0,0]=4 6417 B13R1.470 Cc1ccccc1NC(=O)CNC Amb21958993 [0,2,0,0,0,0|2,0,0]=4 6418 B13R1.470 Cc1ccccc1NC(=O)CON Amb25807062 [0,2,0,0,0,0|2,0,0]=4 6419 B13R1.470 Cc1ccccc1NC(=O)CSC Amb25766404 [0,2,0,0,0,0|1,1,0]=4 6420 B13R1.470 Cc1ccccc1NC(=O)\C=C\C Amb25098097 [0,2,0,0,0,0|2,0,0]=4 6421 B13R1.470 Cc1ccccc1OC(=O)NCC Amb24490439 [0,2,0,0,0,0|2,0,0]=4 6422 B13R1.470 Cc1ccccc1OC(=O)OCC Amb22733215 [0,2,0,0,0,0|1,0,0]=3 6423 B13R1.470 ClCCC(=O)Nc1ccccc1Br Amb1133055 [0,2,0,0,0,0|2,0,0]=4 6424 B13R1.470 ClCCC(=O)Nc1ccccc1O Amb1928974 [0,2,0,0,0,0|2,0,0]=4 6425 B13R1.470 N#CCC(=O)Cc1ccccc1C Amb17232940 [0,2,0,0,0,0|1,0,1]=4 6426 B13R1.470 N#CCC(=O)Cc1ccccc1Cl Amb17235847 [0,2,0,0,0,0|1,0,1]=4 6427 B13R1.470 N#CCC(=O)Cc1ccccc1F Amb17233245 [0,2,0,0,0,0|1,0,1]=4 6428 B13R1.470 N#CNC(=O)Cc1ccccc1F Amb25180728 [0,2,0,0,0,0|1,0,1]=4 6429 B13R1.470 NCCC(=O)Nc1ccccc1C Amb17622092 [0,2,0,0,0,0|2,0,0]=4 6430 B13R1.470 NCCC(=O)Nc1ccccc1Cl Amb15740943 [0,2,0,0,0,0|2,0,0]=4 6431 B13R1.470 NCCC(=O)Nc1ccccc1F Amb1130030 [0,2,0,0,0,0|2,0,0]=4 6432 B13R1.470 NCCC(=O)Nc1ccccc1F Amb17622104 [0,2,0,0,0,0|2,0,0]=4 6433 B13R1.470 NCCC(=O)Nc1ccccc1O Amb25058089 [0,2,0,0,0,0|2,0,0]=4 6434 B13R1.470 NCCC(=O)Oc1ccccc1Br Amb17349673 [0,2,0,0,0,0|2,0,0]=4 6435 B13R1.470 NCCC(=O)Oc1ccccc1C Amb17335312 [0,2,0,0,0,0|2,0,0]=4 6436 B13R1.470 NCCC(=O)Oc1ccccc1Cl Amb17337482 [0,2,0,0,0,0|2,0,0]=4 6437 B13R1.470 NCCC(=O)Oc1ccccc1F Amb17335601 [0,2,0,0,0,0|2,0,0]=4 6438 B13R1.470 NOCC(=O)Nc1ccccc1F Amb25204019 [0,2,0,0,0,0|2,0,0]=4 6439 B13R1.470 O=C(CCBr)Nc1ccccc1I Amb25105122 [0,2,0,0,0,0|2,0,0]=4 6440 B13R1.470 O=C(CCI)Nc1ccccc1Cl Amb24630912 [0,2,0,0,0,0|2,0,0]=4 6441 B13R1.470 O=C(CCS)Nc1ccccc1F Amb25316210 [0,2,0,0,0,0|2,0,0]=4 6442 B13R1.470 O=C(Cc1ccccc1Br)N=C=O Amb24733601 [0,2,0,0,0,0|1,0,1]=4 6443 B13R1.470 OCCC(=O)Nc1ccccc1Br Amb17349665 [0,2,0,0,0,0|2,0,0]=4 6444 B13R1.470 OCCC(=O)Nc1ccccc1C Amb17335300 [0,2,0,0,0,0|2,0,0]=4 6445 B13R1.470 S=C=NC(=O)Cc1ccccc1F Amb1116608 [0,2,0,0,0,0|1,0,1]=4 6446 B13R1.470 [N-]=[N+]=NC(=O)Cc1ccccc1Cl Amb25350401 [0,2,0,0,0,0|2,0,0]=4 6447 B13R1.1327 CCOP(O)(=O)Cc1ccccc1 Amb22487252 [0,2,0,0,0,0|1,0,0]=3 6448 B13R1.1327 CCO[Si](Cl)(Cl)Cc1ccccc1 Amb22369271 [0,2,0,0,0,0|1,1,0]=4 6449 B13R1.1327 OCCS(=O)(=O)Cc1ccccc1 Amb17502674 [0,2,0,0,0,0|2,0,0]=4 6450 B13R1.21 C=CC(=O)C(c1ccc(cc1)C)O Amb10562283 [0,2,0,0,0,0|1,0,1]=4 6451 B13R1.21 C=CC(=O)C(c1ccc(cc1)Cl)O Amb10562282 [0,2,0,0,0,0|1,0,1]=4 6452 B13R1.21 CC(C(=O)C#C)c1ccc(N)cc1 Amb24641997 [0,2,0,0,0,0|1,0,1]=4 6453 B13R1.21 CC(C(=O)C=C)c1ccc(N)cc1 Amb24547918 [0,2,0,0,0,0|1,0,1]=4 6454 B13R1.21 CC(C(=O)CCl)c1ccc(Cl)cc1 Amb25062469 [0,2,0,0,0,0|2,0,0]=4 6455 B13R1.21 CC(C(=O)NN)c1ccc(O)cc1 Amb25298528 [0,2,0,0,0,0|2,0,0]=4 6456 B13R1.21 CC(OC)C(N)c1ccc(Br)cc1 Amb18155746 [0,2,0,0,0,0|1,0,1]=4 6457 B13R1.21 CC(OC)C(N)c1ccc(Cl)cc1 Amb18187532 [0,2,0,0,0,0|1,0,1]=4 6458 B13R1.21 CCC(=O)C(=O)c1ccc(cc1)Br Amb17410342 [0,2,0,0,0,0|1,0,1]=4 6459 B13R1.21 CCC(=O)C(=O)c1ccc(cc1)C Amb17400549 [0,2,0,0,0,0|1,0,1]=4 6460 B13R1.21 CCC(=O)C(=O)c1ccc(cc1)Cl Amb17402166 [0,2,0,0,0,0|1,0,1]=4 6461 B13R1.21 CCC(=O)C(=O)c1ccc(cc1)F Amb17400753 [0,2,0,0,0,0|1,0,1]=4 6462 B13R1.21 CCC(=O)C(C)N1C=CC(=O)C=C1 Amb24368280 [0,2,0,0,0,0|2,0,0]=4 6463 B13R1.21 CCC(=O)C(C)c1ccc(Cl)cc1 Amb25828661 [0,2,0,0,0,0|1,0,0]=3 6464 B13R1.21 CCC(=O)C(C)c1ccc(F)c[n]1 Amb24432829 [0,2,0,0,0,0|2,0,0]=4 6465 B13R1.21 CCC(=O)C(C)c1ccc(F)cc1 Amb24466369 [0,2,0,0,0,0|1,0,0]=3 6466 B13R1.21 CCC(=O)C(C)c1ccc(N)cc1 Amb24547919 [0,2,0,0,0,0|1,0,0]=3 6467 B13R1.21 CCC(=O)C(C)c1ccc(O)cc1 Amb18648132 [0,2,0,0,0,0|1,0,0]=3 6468 B13R1.21 CCC(=O)C(c1ccc(cc1)Br)Cl Amb17477631 [0,2,0,0,0,0|1,0,0]=3 6469 B13R1.21 CCC(=O)C(c1ccc(cc1)C)Cl Amb17477478 [0,2,0,0,0,0|1,0,0]=3 6470 B13R1.21 CCC(=O)C(c1ccc(cc1)Cl)Cl Amb17477637 [0,2,0,0,0,0|1,0,0]=3 6471 B13R1.21 CCC(=O)C(c1ccc(cc1)F)Cl Amb17477643 [0,2,0,0,0,0|1,0,0]=3 6472 B13R1.21 CCS(=O)C(C)c1ccc(Br)cc1 Amb24510229 [0,2,0,0,0,0|2,0,0]=4 6473 B13R1.21 CCS(=O)C(C)c1ccc(F)cc1 Amb25120620 [0,2,0,0,0,0|2,0,0]=4 6474 B13R1.21 CN(C(=O)NC)c1ccc(Cl)cc1 Amb24064348 [0,2,0,0,0,0|2,0,0]=4 6475 B13R1.21 CN(C(=O)NC)c1ccc(F)cc1 Amb25052943 [0,2,0,0,0,0|2,0,0]=4 6476 B13R1.21 CN(C(=O)NC)c1ccc(N)cc1 Amb25702285 [0,2,0,0,0,0|2,0,0]=4 6477 B13R1.21 CN(C(=O)NC)c1ccc(O)cc1 Amb25829844 [0,2,0,0,0,0|2,0,0]=4 6478 B13R1.21 CN(C(=O)OC)c1ccc(F)cc1 Amb25190372 [0,2,0,0,0,0|1,0,0]=3 6479 B13R1.21 CN(C(=O)OC)c1ccc(I)cc1 Amb25355726 [0,2,0,0,0,0|1,0,0]=3 6480 B13R1.21 CN(OC)C(C)c1ccc(N)cc1 Amb18974002 [0,2,0,0,0,0|2,0,0]=4 6481 B13R1.21 CNC(=O)C(=O)c1ccc(O)cc1 Amb25714583 [0,2,0,0,0,0|1,0,1]=4 6482 B13R1.21 CNC(=O)C(=O)c1ccc(cc1)Br Amb17349001 [0,2,0,0,0,0|1,0,1]=4 6483 B13R1.21 CNC(=O)C(=O)c1ccc(cc1)C Amb17335167 [0,2,0,0,0,0|1,0,1]=4 6484 B13R1.21 CNC(=O)C(=O)c1ccc(cc1)Cl Amb17337245 [0,2,0,0,0,0|1,0,1]=4 6485 B13R1.21 CNC(=O)C(=O)c1ccc(cc1)F Amb17335466 [0,2,0,0,0,0|1,0,1]=4 6486 B13R1.21 CNC(=O)C(C)c1ccc(Br)cc1 Amb24677369 [0,2,0,0,0,0|1,0,0]=3 6487 B13R1.21 CNC(=O)C(C)c1ccc(N)cc1 Amb24415382 [0,2,0,0,0,0|1,0,0]=3 6488 B13R1.21 CNC(=O)C(Cl)c1ccc(Br)c[n]1 Amb24415098 [0,2,0,0,0,0|2,0,0]=4 6489 B13R1.21 CNC(=O)C(Cl)c1ccc(Br)cc1 Amb25782797 [0,2,0,0,0,0|1,0,0]=3 6490 B13R1.21 CNC(=O)C(Cl)c1ccc(Cl)cc1 Amb24439006 [0,2,0,0,0,0|1,0,0]=3 6491 B13R1.21 CNC(=O)C(Cl)c1ccc(I)cc1 Amb25112892 [0,2,0,0,0,0|1,0,0]=3 6492 B13R1.21 CNC(=O)C(N)c1ccc(Br)cc1 Amb25102382 [0,2,0,0,0,0|1,0,0]=3 6493 B13R1.21 CNC(=O)C(O)c1ccc(O)cc1 Amb25292381 [0,2,0,0,0,0|1,0,0]=3 6494 B13R1.21 CNC(=O)C(c1ccc(cc1)C)O Amb17400709 [0,2,0,0,0,0|1,0,0]=3 6495 B13R1.21 CNC(=O)C(c1ccc(cc1)Cl)O Amb17402319 [0,2,0,0,0,0|1,0,0]=3 6496 B13R1.21 CNC(=O)C(c1ccc(cc1)F)O Amb17400966 [0,2,0,0,0,0|1,0,0]=3 6497 B13R1.21 CNC(=O)N(O)c1ccc(Cl)cc1 Amb22433750 [0,2,0,0,0,0|2,0,0]=4 6498 B13R1.21 CNC(=O)[C@@H](N)c1ccc(F)cc1 Amb25764582 [0,2,0,0,0,0|1,0,0]=3 6499 B13R1.21 CNC(=O)[C@@H](N)c1ccc(O)cc1 Amb25138741 [0,2,0,0,0,0|1,0,0]=3 6500 B13R1.21 CNC(=O)[C@H](N)c1ccc(F)cc1 Amb25049377 [0,2,0,0,0,0|1,0,0]=3 6501 B13R1.21 CNC(=O)[C@H](N)c1ccc(O)cc1 Amb25793593 [0,2,0,0,0,0|1,0,0]=3 6502 B13R1.21 COC(=O)C(=C)c1ccc(Br)cc1 Amb25191754 [0,2,0,0,0,0|0,0,1]=3 6503 B13R1.21 COC(=O)C(=C)c1ccc(F)cc1 Amb25268440 [0,2,0,0,0,0|0,0,1]=3 6504 B13R1.21 COC(=O)C(=O)c1ccc(I)cc1 Amb25844137 [0,2,0,0,0,0|0,0,1]=3 6505 B13R1.21 COC(=O)C(=O)c1ccc(O)cc1 Amb18128547 [0,2,0,0,0,0|0,0,1]=3 6506 B13R1.21 COC(=O)C(=O)c1ccc(cc1)Br Amb17349298 [0,2,0,0,0,0|0,0,1]=3 6507 B13R1.21 COC(=O)C(=O)c1ccc(cc1)C Amb17335210 [0,2,0,0,0,0|0,0,1]=3 6508 B13R1.21 COC(=O)C(=O)c1ccc(cc1)Cl Amb10562341 [0,2,0,0,0,0|0,0,1]=3 6509 B13R1.21 COC(=O)C(=O)c1ccc(cc1)F Amb17335522 [0,2,0,0,0,0|0,0,1]=3 6510 B13R1.21 COC(=O)C(Br)c1ccc(Br)cc1 Amb25251647 [0,2,0,0,0,0|0,0,0]=2 6511 B13R1.21 COC(=O)C(Br)c1ccc(Cl)cc1 Amb17678815 [0,2,0,0,0,0|0,0,0]=2 6512 B13R1.21 COC(=O)C(C)c1ccc(Cl)[n]c1 Amb24464615 [0,2,0,0,0,0|1,0,0]=3 6513 B13R1.21 COC(=O)C(C)c1ccc(Cl)cc1 Amb19084562 [0,2,0,0,0,0|0,0,0]=2 6514 B13R1.21 COC(=O)C(C)c1ccc(F)cc1 Amb18185420 [0,2,0,0,0,0|0,0,0]=2 6515 B13R1.21 COC(=O)C(C)c1ccc(I)cc1 Amb25353760 [0,2,0,0,0,0|0,0,0]=2 6516 B13R1.21 COC(=O)C(C)c1ccc(N)cc1 Amb18648244 [0,2,0,0,0,0|0,0,0]=2 6517 B13R1.21 COC(=O)C(C)c1ccc(O)cc1 Amb18128607 [0,2,0,0,0,0|0,0,0]=2 6518 B13R1.21 COC(=O)C(Cl)c1ccc(Br)cc1 Amb18883588 [0,2,0,0,0,0|0,0,0]=2 6519 B13R1.21 COC(=O)C(Cl)c1ccc(Cl)cc1 Amb23596610 [0,2,0,0,0,0|0,0,0]=2 6520 B13R1.21 COC(=O)C(Cl)c1ccc(F)cc1 Amb24116655 [0,2,0,0,0,0|0,0,0]=2 6521 B13R1.21 COC(=O)C(Cl)c1ccc(I)cc1 Amb25778781 [0,2,0,0,0,0|0,0,0]=2 6522 B13R1.21 COC(=O)C(N)c1ccc(Br)c[n]1 Amb24490641 [0,2,0,0,0,0|1,0,0]=3 6523 B13R1.21 COC(=O)C(N)c1ccc(Cl)[n]c1 Amb25034405 [0,2,0,0,0,0|1,0,0]=3 6524 B13R1.21 COC(=O)C(N)c1ccc(Cl)cc1 Amb20623322 [0,2,0,0,0,0|0,0,0]=2 6525 B13R1.21 COC(=O)C(N)c1ccc(O)cc1 Amb22899239 [0,2,0,0,0,0|0,0,0]=2 6526 B13R1.21 COC(=O)C(O)c1ccc(Br)c[n]1 Amb25675246 [0,2,0,0,0,0|1,0,0]=3 6527 B13R1.21 COC(=O)C(O)c1ccc(Br)cc1 Amb23596562 [0,2,0,0,0,0|0,0,0]=2 6528 B13R1.21 COC(=O)C(O)c1ccc(Cl)cc1 Amb18333892 [0,2,0,0,0,0|0,0,0]=2 6529 B13R1.21 COC(=O)C(O)c1ccc(F)cc1 Amb19068667 [0,2,0,0,0,0|0,0,0]=2 6530 B13R1.21 COC(=O)C(O)c1ccc(O)cc1 Amb18187058 [0,2,0,0,0,0|0,0,0]=2 6531 B13R1.21 COC(=O)C(c1ccc(cc1)C)N Amb10879658 [0,2,0,0,0,0|0,0,0]=2 6532 B13R1.21 COC(=O)C(c1ccc(cc1)Cl)N Amb10879655 [0,2,0,0,0,0|0,0,0]=2 6533 B13R1.21 COC(=O)C(c1ccc(cc1)F)N Amb10879652 [0,2,0,0,0,0|0,0,0]=2 6534 B13R1.21 COC(=O)N(C)c1ccc(Br)[n]c1 Amb24747788 [0,2,0,0,0,0|2,0,0]=4 6535 B13R1.21 COC(=O)N(N)c1ccc(Br)cc1 Amb25675676 [0,2,0,0,0,0|1,0,0]=3 6536 B13R1.21 COC(=O)N(N)c1ccc(F)cc1 Amb24554779 [0,2,0,0,0,0|1,0,0]=3 6537 B13R1.21 COC(=O)[C@@H](C)c1ccc(O)cc1 Amb25112603 [0,2,0,0,0,0|0,0,0]=2 6538 B13R1.21 COC(=O)[C@@H](N)c1ccc(Cl)[n]c1 Amb25797507 [0,2,0,0,0,0|1,0,0]=3 6539 B13R1.21 COC(=O)[C@@H](N)c1ccc(Cl)cc1 Amb22744731 [0,2,0,0,0,0|0,0,0]=2 6540 B13R1.21 COC(=O)[C@@H](N)c1ccc(Cl)cc1 Amb22747069 [0,2,0,0,0,0|0,0,0]=2 6541 B13R1.21 COC(=O)[C@@H](N)c1ccc(F)cc1 Amb22744866 [0,2,0,0,0,0|0,0,0]=2 6542 B13R1.21 COC(=O)[C@@H](N)c1ccc(F)cc1 Amb22747858 [0,2,0,0,0,0|0,0,0]=2 6543 B13R1.21 COC(=O)[C@@H](N)c1ccc(O)cc1 Amb22744767 [0,2,0,0,0,0|0,0,0]=2 6544 B13R1.21 COC(=O)[C@@H](O)c1ccc(F)cc1 Amb24182090 [0,2,0,0,0,0|0,0,0]=2 6545 B13R1.21 COC(=O)[C@@H](O)c1ccc(N)cc1 Amb25066970 [0,2,0,0,0,0|0,0,0]=2 6546 B13R1.21 COC(=O)[C@H](C)c1ccc(O)cc1 Amb24633423 [0,2,0,0,0,0|0,0,0]=2 6547 B13R1.21 COC(=O)[C@H](N)c1ccc(Br)[n]c1 Amb24556006 [0,2,0,0,0,0|1,0,0]=3 6548 B13R1.21 COC(=O)[C@H](N)c1ccc(Cl)cc1 Amb19888426 [0,2,0,0,0,0|0,0,0]=2 6549 B13R1.21 COC(=O)[C@H](N)c1ccc(Cl)cc1 Amb24493899 [0,2,0,0,0,0|0,0,0]=2 6550 B13R1.21 COC(=O)[C@H](N)c1ccc(F)cc1 Amb19888397 [0,2,0,0,0,0|0,0,0]=2 6551 B13R1.21 COC(=O)[C@H](N)c1ccc(F)cc1 Amb20241311 [0,2,0,0,0,0|0,0,0]=2 6552 B13R1.21 COC(=O)[C@H](N)c1ccc(I)cc1 Amb25841652 [0,2,0,0,0,0|0,0,0]=2 6553 B13R1.21 COC(=O)[C@H](N)c1ccc(O)cc1 Amb22225383 [0,2,0,0,0,0|0,0,0]=2 6554 B13R1.21 COC(=O)[C@H](O)c1ccc(F)cc1 Amb25308222 [0,2,0,0,0,0|0,0,0]=2 6555 B13R1.21 COC(C(c1ccc(cc1)C)N)C Amb1133669 [0,2,0,0,0,0|1,0,1]=4 6556 B13R1.21 COC(C(c1ccc(cc1)F)N)C Amb1139503 [0,2,0,0,0,0|1,0,1]=4 6557 B13R1.21 C\C(=C\C)\C(O)c1ccc(F)cc1 Amb25769390 [0,2,0,0,0,0|2,0,0]=4 6558 B13R1.21 Cc1ccc(c[n]1)C(N)C(=O)NC Amb25679143 [0,2,0,0,0,0|2,0,0]=4 6559 B13R1.21 Cc1ccc(c[n]1)C(O)C(=O)OC Amb25768729 [0,2,0,0,0,0|1,0,0]=3 6560 B13R1.21 Cc1ccc(cc1)C(C)C(=O)NC Amb24440896 [0,2,0,0,0,0|1,0,0]=3 6561 B13R1.21 Cc1ccc(cc1)C(C)C(=O)OC Amb18184314 [0,2,0,0,0,0|0,0,0]=2 6562 B13R1.21 Cc1ccc(cc1)C(Cl)C(=O)NC Amb18330996 [0,2,0,0,0,0|1,0,0]=3 6563 B13R1.21 Cc1ccc(cc1)C(F)C(=O)C#N Amb24370117 [0,2,0,0,0,0|2,0,0]=4 6564 B13R1.21 Cc1ccc(cc1)C(F)C(=O)CCl Amb24344709 [0,2,0,0,0,0|2,0,0]=4 6565 B13R1.21 Cc1ccc(cc1)C(N)C(=O)NN Amb25821472 [0,2,0,0,0,0|2,0,0]=4 6566 B13R1.21 Cc1ccc(cc1)C(O)C(=O)CO Amb24733233 [0,2,0,0,0,0|2,0,0]=4 6567 B13R1.21 Cc1ccc(cc1)C(O)C(=O)NO Amb24353143 [0,2,0,0,0,0|2,0,0]=4 6568 B13R1.21 Cc1ccc(cc1)C(O)C(=O)OC Amb18809303 [0,2,0,0,0,0|0,0,0]=2 6569 B13R1.21 Cc1ccc(cc1)C(O)C(C)OC Amb18809339 [0,2,0,0,0,0|1,0,1]=4 6570 B13R1.21 Cc1ccc(cc1)N(C)C(=O)CC Amb24676930 [0,2,0,0,0,0|2,0,0]=4 6571 B13R1.21 Cc1ccc(cc1)N(N)C(=O)OC Amb25191506 [0,2,0,0,0,0|1,0,0]=3 6572 B13R1.21 Cc1ccc(cc1)[C@H](O)C(=O)OC Amb24403147 [0,2,0,0,0,0|0,0,0]=2 6573 B13R1.21 NNC(=O)C(O)c1ccc(F)cc1 Amb24428150 [0,2,0,0,0,0|2,0,0]=4 6574 B13R1.21 N[C@H](C(=O)NO)c1ccc(O)cc1 Amb24520703 [0,2,0,0,0,0|2,0,0]=4 6575 B13R1.21 N[C@H](c1ccc(O)cc1)C(=O)N=O Amb25778197 [0,2,0,0,0,0|2,0,0]=4 6576 B13R1.21 O=C(CCl)C(F)c1ccc(Br)cc1 Amb24676657 [0,2,0,0,0,0|2,0,0]=4 6577 B13R1.21 O=C(CCl)C(F)c1ccc(Cl)cc1 Amb24749824 [0,2,0,0,0,0|2,0,0]=4 6578 B13R1.21 OCC(=O)C(O)c1ccc(F)cc1 Amb25333517 [0,2,0,0,0,0|2,0,0]=4 6579 B13R1.21 OCC(=O)[C@@H](O)c1ccc(F)cc1 Amb25831911 [0,2,0,0,0,0|2,0,0]=4 6580 B13R1.21 OCC(=O)[C@H](O)c1ccc(F)cc1 Amb24362831 [0,2,0,0,0,0|2,0,0]=4 6581 B13R1.22 CC(C(=O)NO)c1cccc(Br)c1 Amb25099255 [0,2,0,0,0,0|2,0,0]=4 6582 B13R1.22 CC(C(=O)NO)c1cccc(Cl)c1 Amb24505440 [0,2,0,0,0,0|2,0,0]=4 6583 B13R1.22 CCC(=O)C(=O)c1cccc(Br)c1 Amb25244807 [0,2,0,0,0,0|1,0,1]=4 6584 B13R1.22 CCC(=O)C(C)c1cccc(Cl)c1 Amb25334147 [0,2,0,0,0,0|1,0,0]=3 6585 B13R1.22 CCC(=O)C(C)c1cccc(F)c1 Amb25730418 [0,2,0,0,0,0|1,0,0]=3 6586 B13R1.22 CCC(=O)C(c1cccc(c1)Br)Cl Amb17477632 [0,2,0,0,0,0|1,0,0]=3 6587 B13R1.22 CCC(=O)C(c1cccc(c1)C)Cl Amb17477476 [0,2,0,0,0,0|1,0,0]=3 6588 B13R1.22 CCC(=O)C(c1cccc(c1)Cl)Cl Amb17477638 [0,2,0,0,0,0|1,0,0]=3 6589 B13R1.22 CCS(=O)C(C)c1cccc(Br)c1 Amb25317085 [0,2,0,0,0,0|2,0,0]=4 6590 B13R1.22 CCS(=O)C(C)c1cccc(F)c1 Amb25284042 [0,2,0,0,0,0|2,0,0]=4 6591 B13R1.22 CN(C(=O)CC)c1cccc(F)c1 Amb25065835 [0,2,0,0,0,0|2,0,0]=4 6592 B13R1.22 CN(C(=O)CC)c1cccc(N)c1 Amb18282839 [0,2,0,0,0,0|2,0,0]=4 6593 B13R1.22 CN(C(=O)CC)c1cccc(O)c1 Amb25070360 [0,2,0,0,0,0|2,0,0]=4 6594 B13R1.22 CN(C(=O)NC)c1cccc(N)c1 Amb25052138 [0,2,0,0,0,0|2,0,0]=4 6595 B13R1.22 CN(C(=O)NC)c1cccc(O)c1 Amb24623282 [0,2,0,0,0,0|2,0,0]=4 6596 B13R1.22 CN(C(=O)OC)c1cccc(Br)c1 Amb25097488 [0,2,0,0,0,0|1,0,0]=3 6597 B13R1.22 CN(C(=O)OC)c1cccc(N)c1 Amb18952689 [0,2,0,0,0,0|1,0,0]=3 6598 B13R1.22 CN(C(=O)OC)c1cccc(O)c1 Amb18128823 [0,2,0,0,0,0|1,0,0]=3 6599 B13R1.22 CN(OC)C(C)c1cccc(N)c1 Amb18973985 [0,2,0,0,0,0|2,0,0]=4 6600 B13R1.22 CNC(=O)C(C)c1cccc(Cl)c1 Amb25804173 [0,2,0,0,0,0|1,0,0]=3 6601 B13R1.22 CNC(=O)C(C)c1cccc(N)c1 Amb25071108 [0,2,0,0,0,0|1,0,0]=3 6602 B13R1.22 CNC(=O)C(Cl)c1c[n]cc(Br)c1 Amb25688553 [0,2,0,0,0,0|2,0,0]=4 6603 B13R1.22 CNC(=O)C(Cl)c1cccc(I)c1 Amb24693230 [0,2,0,0,0,0|1,0,0]=3 6604 B13R1.22 CNC(=O)C(N)c1cccc(Cl)c1 Amb25833191 [0,2,0,0,0,0|1,0,0]=3 6605 B13R1.22 CNC(=O)C(N)c1cccc(F)c1 Amb24459874 [0,2,0,0,0,0|1,0,0]=3 6606 B13R1.22 CNC(=O)C(O)c1cccc(Br)c1 Amb24704267 [0,2,0,0,0,0|1,0,0]=3 6607 B13R1.22 CNC(=O)C(O)c1cccc(F)c1 Amb24439436 [0,2,0,0,0,0|1,0,0]=3 6608 B13R1.22 CNC(=O)[C@@H](N)c1cccc(F)c1 Amb25287035 [0,2,0,0,0,0|1,0,0]=3 6609 B13R1.22 COC(=N)C(O)c1cccc(F)c1 Amb25256617 [0,2,0,0,0,0|1,0,0]=3 6610 B13R1.22 COC(=O)C(=C)c1cccc(N)c1 Amb24382552 [0,2,0,0,0,0|0,0,1]=3 6611 B13R1.22 COC(=O)C(=O)c1cccc(Br)c1 Amb22498288 [0,2,0,0,0,0|0,0,1]=3 6612 B13R1.22 COC(=O)C(=O)c1cccc(Cl)c1 Amb22755093 [0,2,0,0,0,0|0,0,1]=3 6613 B13R1.22 COC(=O)C(=O)c1cccc(F)c1 Amb25160749 [0,2,0,0,0,0|0,0,1]=3 6614 B13R1.22 COC(=O)C(=O)c1cccc(I)c1 Amb25738459 [0,2,0,0,0,0|0,0,1]=3 6615 B13R1.22 COC(=O)C(Br)c1cc(Br)ccc1 Amb25375562 [0,2,0,0,0,0|0,0,0]=2 6616 B13R1.22 COC(=O)C(Br)c1cccc(Br)[n]1 Amb25040677 [0,2,0,0,0,0|1,0,0]=3 6617 B13R1.22 COC(=O)C(Br)c1cccc(Cl)c1 Amb18883587 [0,2,0,0,0,0|0,0,0]=2 6618 B13R1.22 COC(=O)C(Br)c1cccc(F)c1 Amb25777163 [0,2,0,0,0,0|0,0,0]=2 6619 B13R1.22 COC(=O)C(C)c1c[n]cc(Br)c1 Amb24341307 [0,2,0,0,0,0|1,0,0]=3 6620 B13R1.22 COC(=O)C(C)c1c[n]cc(F)c1 Amb18325742 [0,2,0,0,0,0|1,0,0]=3 6621 B13R1.22 COC(=O)C(C)c1cc[n]c(Cl)c1 Amb25250741 [0,2,0,0,0,0|1,0,0]=3 6622 B13R1.22 COC(=O)C(C)c1cccc(Br)c1 Amb24183608 [0,2,0,0,0,0|0,0,0]=2 6623 B13R1.22 COC(=O)C(C)c1cccc(Cl)c1 Amb18331146 [0,2,0,0,0,0|0,0,0]=2 6624 B13R1.22 COC(=O)C(C)c1cccc(F)c1 Amb18185421 [0,2,0,0,0,0|0,0,0]=2 6625 B13R1.22 COC(=O)C(C)c1cccc(I)c1 Amb25085006 [0,2,0,0,0,0|0,0,0]=2 6626 B13R1.22 COC(=O)C(C)c1cccc(N)c1 Amb18128401 [0,2,0,0,0,0|0,0,0]=2 6627 B13R1.22 COC(=O)C(Cl)c1c[n]cc(Br)c1 Amb24721123 [0,2,0,0,0,0|1,0,0]=3 6628 B13R1.22 COC(=O)C(Cl)c1cc(Cl)ccc1 Amb19515198 [0,2,0,0,0,0|0,0,0]=2 6629 B13R1.22 COC(=O)C(Cl)c1cccc(Br)c1 Amb23596605 [0,2,0,0,0,0|0,0,0]=2 6630 B13R1.22 COC(=O)C(Cl)c1cccc(F)c1 Amb23596607 [0,2,0,0,0,0|0,0,0]=2 6631 B13R1.22 COC(=O)C(Cl)c1cccc(I)c1 Amb25753288 [0,2,0,0,0,0|0,0,0]=2 6632 B13R1.22 COC(=O)C(F)c1cccc(Br)c1 Amb25121343 [0,2,0,0,0,0|0,0,0]=2 6633 B13R1.22 COC(=O)C(N)c1c[n]cc(Br)c1 Amb24490651 [0,2,0,0,0,0|1,0,0]=3 6634 B13R1.22 COC(=O)C(N)c1cc[n]c(Br)c1 Amb24534665 [0,2,0,0,0,0|1,0,0]=3 6635 B13R1.22 COC(=O)C(N)c1cccc(Br)[n]1 Amb24341299 [0,2,0,0,0,0|1,0,0]=3 6636 B13R1.22 COC(=O)C(N)c1cccc(Cl)[n]1 Amb25711484 [0,2,0,0,0,0|1,0,0]=3 6637 B13R1.22 COC(=O)C(N)c1cccc(N)[n]1 Amb25299406 [0,2,0,0,0,0|1,0,0]=3 6638 B13R1.22 COC(=O)C(N)c1cccc(O)c1 Amb18968190 [0,2,0,0,0,0|0,0,0]=2 6639 B13R1.22 COC(=O)C(O)c1cc(O)ccc1 Amb18187057 [0,2,0,0,0,0|0,0,0]=2 6640 B13R1.22 COC(=O)C(O)c1cccc(Br)c1 Amb23596560 [0,2,0,0,0,0|0,0,0]=2 6641 B13R1.22 COC(=O)C(O)c1cccc(Cl)c1 Amb18333893 [0,2,0,0,0,0|0,0,0]=2 6642 B13R1.22 COC(=O)C(O)c1cccc(F)c1 Amb19074669 [0,2,0,0,0,0|0,0,0]=2 6643 B13R1.22 COC(=O)C(O)c1cccc(I)c1 Amb24410672 [0,2,0,0,0,0|0,0,0]=2 6644 B13R1.22 COC(=O)C(O)c1cccc(N)c1 Amb24092718 [0,2,0,0,0,0|0,0,0]=2 6645 B13R1.22 COC(=O)C(c1cccc(c1)Br)N Amb10975611 [0,2,0,0,0,0|0,0,0]=2 6646 B13R1.22 COC(=O)C(c1cccc(c1)C)N Amb10879657 [0,2,0,0,0,0|0,0,0]=2 6647 B13R1.22 COC(=O)C(c1cccc(c1)C)N Amb17622263 [0,2,0,0,0,0|0,0,0]=2 6648 B13R1.22 COC(=O)C(c1cccc(c1)Cl)N Amb10879654 [0,2,0,0,0,0|0,0,0]=2 6649 B13R1.22 COC(=O)C(c1cccc(c1)F)N Amb10879651 [0,2,0,0,0,0|0,0,0]=2 6650 B13R1.22 COC(=O)[C@@H](C)c1cccc(N)c1 Amb24182085 [0,2,0,0,0,0|0,0,0]=2 6651 B13R1.22 COC(=O)[C@@H](N)c1c[n]cc(Br)c1 Amb25198747 [0,2,0,0,0,0|1,0,0]=3 6652 B13R1.22 COC(=O)[C@@H](N)c1cccc(Br)[n]1 Amb25140249 [0,2,0,0,0,0|1,0,0]=3 6653 B13R1.22 COC(=O)[C@@H](N)c1cccc(Br)c1 Amb25809057 [0,2,0,0,0,0|0,0,0]=2 6654 B13R1.22 COC(=O)[C@@H](N)c1cccc(O)c1 Amb25096387 [0,2,0,0,0,0|0,0,0]=2 6655 B13R1.22 COC(=O)[C@@H](O)c1cccc(Cl)c1 Amb22746478 [0,2,0,0,0,0|0,0,0]=2 6656 B13R1.22 COC(=O)[C@@H](O)c1cccc(F)c1 Amb25343345 [0,2,0,0,0,0|0,0,0]=2 6657 B13R1.22 COC(=O)[C@H](C)c1cccc(O)c1 Amb25371828 [0,2,0,0,0,0|0,0,0]=2 6658 B13R1.22 COC(=O)[C@H](N)c1cccc(Br)c1 Amb25155077 [0,2,0,0,0,0|0,0,0]=2 6659 B13R1.22 COC(=O)[C@H](N)c1cccc(Cl)c1 Amb25844142 [0,2,0,0,0,0|0,0,0]=2 6660 B13R1.22 COC(=O)[C@H](N)c1cccc(F)c1 Amb25831656 [0,2,0,0,0,0|0,0,0]=2 6661 B13R1.22 COC(=O)[C@H](N)c1cccc(I)c1 Amb25775970 [0,2,0,0,0,0|0,0,0]=2 6662 B13R1.22 COC(=O)[C@H](O)c1cccc(F)c1 Amb24534589 [0,2,0,0,0,0|0,0,0]=2 6663 B13R1.22 C\C(=C\C)\C(O)c1cccc(F)c1 Amb25333516 [0,2,0,0,0,0|2,0,0]=4 6664 B13R1.22 Cc1cc(ccc1)C(Br)C(=O)OC Amb18227868 [0,2,0,0,0,0|0,0,0]=2 6665 B13R1.22 Cc1cc(ccc1)C(C)C(=O)OC Amb18804749 [0,2,0,0,0,0|0,0,0]=2 6666 B13R1.22 Cc1cc(ccc1)C(Cl)C(=O)NC Amb19083266 [0,2,0,0,0,0|1,0,0]=3 6667 B13R1.22 Cc1cc(ccc1)C(Cl)C(=O)OC Amb18331144 [0,2,0,0,0,0|0,0,0]=2 6668 B13R1.22 Cc1cc(ccc1)C(O)C(=O)NC Amb25695140 [0,2,0,0,0,0|1,0,0]=3 6669 B13R1.22 Cc1cc(ccc1)C(O)C(=O)OC Amb18186544 [0,2,0,0,0,0|0,0,0]=2 6670 B13R1.22 Cc1cc(ccc1)N(C)C(=O)CC Amb25833076 [0,2,0,0,0,0|2,0,0]=4 6671 B13R1.22 Cc1cc(ccc1)N(C)C(=O)NC Amb24534567 [0,2,0,0,0,0|2,0,0]=4 6672 B13R1.22 Cc1cc(ccc1)[C@@H](N)C(=O)OC Amb24496900 [0,2,0,0,0,0|0,0,0]=2 6673 B13R1.22 Cc1cc(ccc1)[C@@H](O)C(=O)OC Amb24533614 [0,2,0,0,0,0|0,0,0]=2 6674 B13R1.22 Cc1cc(ccc1)[C@H](O)C(=O)OC Amb25065474 [0,2,0,0,0,0|0,0,0]=2 6675 B13R1.22 Cc1cccc([n]1)N(C)C(=O)OC Amb24362347 [0,2,0,0,0,0|2,0,0]=4 6676 B13R1.22 Cc1cccc(c1)C(=O)C(=O)OC Amb22755054 [0,2,0,0,0,0|0,0,1]=3 6677 B13R1.22 Cc1cccc(c1)C(C)S(=O)CC Amb25105579 [0,2,0,0,0,0|2,0,0]=4 6678 B13R1.22 Cc1cccc(c1)C(O)C(C)OC Amb24413096 [0,2,0,0,0,0|1,0,1]=4 6679 B13R1.22 O=C(CCl)C(F)c1cccc(Br)c1 Amb25830014 [0,2,0,0,0,0|2,0,0]=4 6680 B13R1.22 OCC(=O)C(O)c1cccc(F)c1 Amb24495955 [0,2,0,0,0,0|2,0,0]=4 6681 B13R1.22 OCC(=O)[C@@H](O)c1cccc(F)c1 Amb24495956 [0,2,0,0,0,0|2,0,0]=4 6682 B13R1.22 OCC(=O)[C@H](O)c1cccc(F)c1 Amb24412156 [0,2,0,0,0,0|2,0,0]=4 6683 B13R1.22 Oc1cc(ccc1)[C@@H](O)C(=O)CO Amb24344012 [0,2,0,0,0,0|2,0,0]=4 6684 B13R1.22 Oc1cc(ccc1)[C@H](O)C(=O)CO Amb24612648 [0,2,0,0,0,0|2,0,0]=4 6685 B13R1.86 CC(C(C#N)OC)c1ccccc1 Amb24534007 [0,2,0,0,0,0|1,0,1]=4 6686 B13R1.86 CC(C(OC)OC)c1ccccc1 Amb22336595 [0,2,0,0,0,0|0,0,2]=4 6687 B13R1.86 CCC(=C=C)C(O)c1ccccc1 Amb25806685 [0,2,0,0,0,0|2,0,0]=4 6688 B13R1.86 CCC(=C=C)[C@@H](O)c1ccccc1 Amb25058563 [0,2,0,0,0,0|2,0,0]=4 6689 B13R1.86 CCC(=C=C)[C@H](O)c1ccccc1 Amb24495402 [0,2,0,0,0,0|2,0,0]=4 6690 B13R1.86 CCC(C=O)=C(Cl)c1ccccc1 Amb24065131 [0,2,0,0,0,0|1,0,1]=4 6691 B13R1.86 CC\C(=N\O)\C(Cl)c1ccccc1 Amb24652526 [0,2,0,0,0,0|1,0,1]=4 6692 B13R1.86 CC\C(=N\O)\C(O)c1ccccc1 Amb25345110 [0,2,0,0,0,0|1,0,1]=4 6693 B13R1.86 CC\C(\C=O)=C(/Cl)\c1ccccc1 Amb25055867 [0,2,0,0,0,0|1,0,1]=4 6694 B13R1.86 CC\C(\C=O)=C(\N)/c1ccccc1 Amb25178990 [0,2,0,0,0,0|1,0,1]=4 6695 B13R1.86 CN\C(=N\N)\C(C)c1ccccc1 Amb24427117 [0,2,0,0,0,0|2,0,0]=4 6696 B13R1.86 COC(=C=C)C(N)c1ccccc1 Amb24488900 [0,2,0,0,0,0|1,0,0]=3 6697 B13R1.86 C\C(\c1ccccc1)=C(\C=O)/OC Amb25759071 [0,2,0,0,0,0|0,0,1]=3 6698 B13R1.86 C\C(\c1ccccc1)=C(\CC)/C=O Amb18127296 [0,2,0,0,0,0|1,0,1]=4 6699 B13R1.86 C\C=C(\C=C)/C(O)c1ccccc1 Amb24576578 [0,2,0,0,0,0|2,0,0]=4 6700 B13R1.86 C\N=C(/OC)\C(=O)c1ccccc1 Amb25231295 [0,2,0,0,0,0|1,0,1]=4 6701 B13R1.152 CC(=C)C(=C)C(O)c1ccccc1 Amb25781853 [0,2,0,0,0,0|2,0,0]=4 6702 B13R1.152 CC(=C)C(=O)C(N)c1ccccc1 Amb25153483 [0,2,0,0,0,0|1,0,0]=3 6703 B13R1.152 CC(=C)C(=O)C(O)c1ccccc1 Amb25807562 [0,2,0,0,0,0|1,0,0]=3 6704 B13R1.152 CC(=C)C(=O)[C@H](N)c1ccccc1 Amb25155665 [0,2,0,0,0,0|1,0,0]=3 6705 B13R1.152 CC(=O)C(=C)[C@@H](O)c1ccccc1 Amb24370174 [0,2,0,0,0,0|2,0,0]=4 6706 B13R1.152 CC(=O)C(=O)C(=O)c1ccccc1 Amb25092958 [0,2,0,0,0,0|1,0,1]=4 6707 B13R1.152 CC(=O)C(=O)C(C)c1ccccc1 Amb24492525 [0,2,0,0,0,0|1,0,0]=3 6708 B13R1.152 CC(C(=O)C(=O)c1ccccc1)C Amb17400548 [0,2,0,0,0,0|1,0,1]=4 6709 B13R1.152 CC(C(=O)N(c1ccccc1)C)Br Amb17326227 [0,2,0,0,0,0|2,0,0]=4 6710 B13R1.152 CC(C(=O)N(c1ccccc1)C)Cl Amb1208669 [0,2,0,0,0,0|2,0,0]=4 6711 B13R1.152 CC(C(=O)N(c1ccccc1)C)O Amb17400713 [0,2,0,0,0,0|2,0,0]=4 6712 B13R1.152 CC(C)=C(C)C(O)c1ccccc1 Amb24495409 [0,2,0,0,0,0|2,0,0]=4 6713 B13R1.152 CC(C)C(=O)C(=C)c1ccccc1 Amb24448985 [0,2,0,0,0,0|1,0,1]=4 6714 B13R1.152 CC(C)C(=O)C(C)c1cc[n]cc1 Amb24713109 [0,2,0,0,0,0|2,0,0]=4 6715 B13R1.152 CC(C)C(=O)C(C)c1cccc[n]1 Amb24489962 [0,2,0,0,0,0|2,0,0]=4 6716 B13R1.152 CC(C)C(=O)C(C)c1ccccc1 Amb24400185 [0,2,0,0,0,0|1,0,0]=3 6717 B13R1.152 CC(C)C(=O)[C@@H](C)c1ccccc1 Amb24408301 [0,2,0,0,0,0|1,0,0]=3 6718 B13R1.152 CC(C)C(=O)[C@H](N)c1ccccc1 Amb25155664 [0,2,0,0,0,0|1,0,0]=3 6719 B13R1.152 CC(C)C(=O)[C@H](O)c1ccccc1 Amb24690697 [0,2,0,0,0,0|1,0,0]=3 6720 B13R1.152 CC(C)C(=S)C(O)c1ccccc1 Amb25092034 [0,2,0,0,0,0|1,1,0]=4 6721 B13R1.152 CC(c1ccccc1)C(=O)C(O)=O Amb18648106 [0,2,0,0,0,0|2,0,0]=4 6722 B13R1.152 CN(C(=O)C(=O)C)c1ccccc1 Amb2424343 [0,2,0,0,0,0|2,0,0]=4 6723 B13R1.152 CN(C(=O)C(=O)c1ccccc1)C Amb17335166 [0,2,0,0,0,0|1,0,1]=4 6724 B13R1.152 CN(C(=O)N(C)O)c1ccccc1 Amb25354711 [0,2,0,0,0,0|2,0,0]=4 6725 B13R1.152 CN(C(=O)[C@@H](C)N)c1ccccc1 Amb18014671 [0,2,0,0,0,0|2,0,0]=4 6726 B13R1.152 CN(C(=O)[C@H](C)O)c1ccccc1 Amb25853363 [0,2,0,0,0,0|2,0,0]=4 6727 B13R1.152 CN(C)C(=O)C(Cl)c1ccc[n]c1 Amb18332183 [0,2,0,0,0,0|2,0,0]=4 6728 B13R1.152 CN(C)C(=O)C(N)c1ccc[n]c1 Amb24396106 [0,2,0,0,0,0|2,0,0]=4 6729 B13R1.152 CN(C)C(=O)N(C)c1ccccc1 Amb24351829 [0,2,0,0,0,0|2,0,0]=4 6730 B13R1.152 CN(C)C(=O)[C@@H](C)c1ccccc1 Amb25370071 [0,2,0,0,0,0|1,0,0]=3 6731 B13R1.152 CN(C)C(=O)[C@@H](N)c1ccccc1 Amb24056498 [0,2,0,0,0,0|1,0,0]=3 6732 B13R1.152 CN(C)C(=O)[C@@H](O)c1ccccc1 Amb25795435 [0,2,0,0,0,0|1,0,0]=3 6733 B13R1.152 CN(C)C(=O)[C@H](C)c1ccccc1 Amb25093411 [0,2,0,0,0,0|1,0,0]=3 6734 B13R1.152 CN(C)C(=O)[C@H](N)c1ccccc1 Amb25291302 [0,2,0,0,0,0|1,0,0]=3 6735 B13R1.152 CN(C)C(=S)C(Cl)c1ccccc1 Amb25733493 [0,2,0,0,0,0|1,1,0]=4 6736 B13R1.152 CN(C)C(=S)C(O)c1ccccc1 Amb24533590 [0,2,0,0,0,0|1,1,0]=4 6737 B13R1.152 C[C@@H](C(=O)[C@H](C)N)c1ccccc1 Amb24561937 [0,2,0,0,0,0|1,0,0]=3 6738 B13R1.152 C\C(\F)=C(\F)/C(O)c1ccccc1 Amb25847030 [0,2,0,0,0,0|2,0,0]=4 6739 B13R1.152 ClC(C(=O)N(C)C)c1ccccc1 Amb1106097 [0,2,0,0,0,0|1,0,0]=3 6740 B13R1.152 NC(C(=O)N(C)C)c1ccccc1 Amb10609379 [0,2,0,0,0,0|1,0,0]=3 6741 B13R1.152 NC(c1ccccc1)C(=O)C(O)=O Amb24693899 [0,2,0,0,0,0|2,0,0]=4 6742 B13R1.152 N[C@H](C(=O)N(C)C)c1ccccc1 Amb17233442 [0,2,0,0,0,0|1,0,0]=3 6743 B13R1.152 OC(=O)C(=O)C(Br)c1ccccc1 Amb18135901 [0,2,0,0,0,0|2,0,0]=4 6744 B13R1.152 OC(=O)C(=O)C(Cl)c1ccccc1 Amb25292830 [0,2,0,0,0,0|2,0,0]=4 6745 B13R1.152 OC(C(=O)N(C)C)c1ccccc1 Amb17400708 [0,2,0,0,0,0|1,0,0]=3 6746 B13R1.263 CCP(O)(=O)C(N)c1ccccc1 Amb22451721 [0,2,0,0,0,0|2,0,0]=4 6747 B13R1.263 COC(C)(N)C(O)c1ccccc1 Amb24606141 [0,2,0,0,0,0|1,0,1]=4 6748 B13R1.263 COC(F)(F)C(Cl)c1ccccc1 Amb25756211 [0,2,0,0,0,0|1,0,1]=4 6749 B13R1.263 COP(O)(=O)C(O)c1ccccc1 Amb22466458 [0,2,0,0,0,0|1,0,0]=3 6750 B13R1.263 COP([O-])(=O)C(=O)c1ccccc1 Amb22489036 [0,2,0,0,0,0|1,0,1]=4 6751 B13R1.263 COP([O-])(=O)C(O)c1ccccc1 Amb22454980 [0,2,0,0,0,0|1,0,0]=3 6752 B13R1.263 CO[C@](C)(N)[C@@H](O)c1ccccc1 Amb24382550 [0,2,0,0,0,0|1,0,1]=4 6753 B13R1.532 BrCC(=O)C(c1ccccc1)C#N Amb1105450 [0,2,0,0,0,0|2,0,0]=4 6754 B13R1.532 C#CC(=O)C(CN)c1ccccc1 Amb25155992 [0,2,0,0,0,0|1,0,1]=4 6755 B13R1.532 CCC(=O)C(C#N)c1cc[n]cc1 Amb24734437 [0,2,0,0,0,0|2,0,0]=4 6756 B13R1.532 CCC(=O)C(C#N)c1ccc[n]c1 Amb24446057 [0,2,0,0,0,0|2,0,0]=4 6757 B13R1.532 CCC(=O)\C(=N\O)\c1ccccc1 Amb25059632 [0,2,0,0,0,0|1,0,1]=4 6758 B13R1.532 CCC(C(=O)C#C)c1ccccc1 Amb25076850 [0,2,0,0,0,0|1,0,1]=4 6759 B13R1.532 CCC(C(=O)CCl)c1ccccc1 Amb22395296 [0,2,0,0,0,0|2,0,0]=4 6760 B13R1.532 CCC(C(=S)NC)c1ccccc1 Amb25690915 [0,2,0,0,0,0|1,1,0]=4 6761 B13R1.532 CC[C@@H](C(=O)NC)c1ccccc1 Amb25685863 [0,2,0,0,0,0|1,0,0]=3 6762 B13R1.532 CNC(=N)C(OC)c1ccccc1 Amb25132391 [0,2,0,0,0,0|2,0,0]=4 6763 B13R1.532 CNC(=O)C(C#N)c1cccc[n]1 Amb25295860 [0,2,0,0,0,0|2,0,0]=4 6764 B13R1.532 CNC(=O)C(C#N)c1ccccc1 Amb18790298 [0,2,0,0,0,0|1,0,0]=3 6765 B13R1.532 CNC(=O)C(CN)c1ccc[n]c1 Amb23571968 [0,2,0,0,0,0|2,0,0]=4 6766 B13R1.532 CNC(=O)C(CN)c1cccc[n]1 Amb23571969 [0,2,0,0,0,0|2,0,0]=4 6767 B13R1.532 CNC(=O)C(CN)c1ccccc1 Amb18999518 [0,2,0,0,0,0|1,0,0]=3 6768 B13R1.532 CNC(=O)C(CO)c1ccccc1 Amb25685879 [0,2,0,0,0,0|1,0,0]=3 6769 B13R1.532 CNC(=O)C(NC)c1ccccc1 Amb18128254 [0,2,0,0,0,0|1,0,0]=3 6770 B13R1.532 CNC(=O)C(OC)c1ccccc1 Amb24390519 [0,2,0,0,0,0|1,0,0]=3 6771 B13R1.532 CNC(=O)N(N=O)c1ccccc1 Amb25752658 [0,2,0,0,0,0|2,0,0]=4 6772 B13R1.532 CNC(=O)N(NC)c1ccccc1 Amb25731876 [0,2,0,0,0,0|2,0,0]=4 6773 B13R1.532 CNC(=O)[C@@H](NO)c1ccccc1 Amb25803643 [0,2,0,0,0,0|1,0,0]=3 6774 B13R1.532 CNC(=O)\C(=N/O)\c1ccccc1 Amb1951205 [0,2,0,0,0,0|1,0,1]=4 6775 B13R1.532 CNC(=O)\C(=N\O)\c1ccccc1 Amb24605318 [0,2,0,0,0,0|1,0,1]=4 6776 B13R1.532 CNC(C(=O)NO)c1ccccc1 Amb25110038 [0,2,0,0,0,0|2,0,0]=4 6777 B13R1.532 CNC(C(=O)OC)c1ccccc1 Amb18809173 [0,2,0,0,0,0|0,0,0]=2 6778 B13R1.532 CNC(C(=O)OC)c1ccccc1 Amb19374443 [0,2,0,0,0,0|0,0,0]=2 6779 B13R1.532 CN[C@@H](C(=O)NO)c1ccccc1 Amb24739805 [0,2,0,0,0,0|2,0,0]=4 6780 B13R1.532 COC(=O)C(C#N)c1cc[n]cc1 Amb24423091 [0,2,0,0,0,0|1,0,0]=3 6781 B13R1.532 COC(=O)C(C=O)c1ccccc1 Amb18648108 [0,2,0,0,0,0|0,0,0]=2 6782 B13R1.532 COC(=O)C(CBr)c1ccccc1 Amb20671515 [0,2,0,0,0,0|0,0,0]=2 6783 B13R1.532 COC(=O)C(c1ccccc1)C#N Amb17335031 [0,2,0,0,0,0|0,0,0]=2 6784 B13R1.532 COC(=O)N(C#C)c1ccccc1 Amb24096211 [0,2,0,0,0,0|1,0,0]=3 6785 B13R1.532 COC(=O)[C@@H](OC)c1ccccc1 Amb22746502 [0,2,0,0,0,0|0,0,0]=2 6786 B13R1.532 COC(=O)[C@H](OC)c1ccccc1 Amb22274921 [0,2,0,0,0,0|0,0,0]=2 6787 B13R1.532 COC(=O)\C(=C\Cl)\c1ccccc1 Amb24626634 [0,2,0,0,0,0|0,0,1]=3 6788 B13R1.532 COC(=O)\C(=C\O)\c1ccccc1 Amb24495499 [0,2,0,0,0,0|0,0,1]=3 6789 B13R1.532 COC(=O)\C(=N/O)\c1cccc[n]1 Amb22640972 [0,2,0,0,0,0|1,0,1]=4 6790 B13R1.532 COC(=O)\C(=N/O)\c1ccccc1 Amb10243160 [0,2,0,0,0,0|0,0,1]=3 6791 B13R1.532 COC(=O)\C(=N\O)\c1cc[n]cc1 Amb25715658 [0,2,0,0,0,0|1,0,1]=4 6792 B13R1.532 COC(=O)\C(=N\O)\c1cccc[n]1 Amb25242697 [0,2,0,0,0,0|1,0,1]=4 6793 B13R1.532 COC(=O)\C(\C=O)=C\1/C=CC=CN1 Amb18128339 [0,2,0,0,0,0|1,0,1]=4 6794 B13R1.532 COC(C(=O)NO)c1ccccc1 Amb18184979 [0,2,0,0,0,0|2,0,0]=4 6795 B13R1.532 COC(c1ccccc1)C(=O)OC Amb10783162 [0,2,0,0,0,0|0,0,0]=2 6796 B13R1.532 CSC(C(=O)NN)c1ccccc1 Amb24568850 [0,2,0,0,0,0|2,0,0]=4 6797 B13R1.532 C\C(=C/C)\C(C=O)c1ccccc1 Amb25128277 [0,2,0,0,0,0|2,0,0]=4 6798 B13R1.532 C\C=C(\C(=O)CC)/c1ccccc1 Amb25318877 [0,2,0,0,0,0|1,0,1]=4 6799 B13R1.532 NCC(C(=O)NO)c1ccccc1 Amb25363657 [0,2,0,0,0,0|2,0,0]=4 6800 B13R1.532 NCC(c1ccccc1)C(=O)OC Amb17400701 [0,2,0,0,0,0|0,0,0]=2 6801 B13R1.532 NCC(c1ccccn1)C(=O)OC Amb17400759 [0,2,0,0,0,0|1,0,0]=3 6802 B13R1.532 NCC(c1cccnc1)C(=O)OC Amb17400761 [0,2,0,0,0,0|1,0,0]=3 6803 B13R1.532 NCC(c1ccncc1)C(=O)OC Amb17400764 [0,2,0,0,0,0|1,0,0]=3 6804 B13R1.532 NNC(=O)C(C#N)c1ccccc1 Amb22535750 [0,2,0,0,0,0|2,0,0]=4 6805 B13R1.532 NNC(=O)C(CO)c1ccccc1 Amb24747140 [0,2,0,0,0,0|2,0,0]=4 6806 B13R1.532 [NH3+]CC(c1ccccc1)C(=O)OC Amb10564340 [0,2,0,0,0,0|0,0,0]=2 6807 B13R1.696 CCC(=O)C(C)c1ccccc1F Amb24590756 [0,2,0,0,0,0|1,0,0]=3 6808 B13R1.696 CCC(=O)C(c1ccccc1C)Cl Amb17477477 [0,2,0,0,0,0|1,0,0]=3 6809 B13R1.696 CCC(=O)C(c1ccccc1Cl)Cl Amb17477636 [0,2,0,0,0,0|1,0,0]=3 6810 B13R1.696 CCC(=O)[C@@H](O)c1ccccc1F Amb24495717 [0,2,0,0,0,0|1,0,0]=3 6811 B13R1.696 CCS(=O)C(C)c1ccccc1Cl Amb24510086 [0,2,0,0,0,0|2,0,0]=4 6812 B13R1.696 CCS(=O)C(C)c1ccccc1F Amb25072307 [0,2,0,0,0,0|2,0,0]=4 6813 B13R1.696 CN(C(=O)CC)c1ccccc1F Amb25257297 [0,2,0,0,0,0|2,0,0]=4 6814 B13R1.696 CN(C(=O)CC)c1ccccc1I Amb24412551 [0,2,0,0,0,0|2,0,0]=4 6815 B13R1.696 CN(C(=O)CC)c1ccccc1N Amb18957819 [0,2,0,0,0,0|2,0,0]=4 6816 B13R1.696 CN(C(=O)OC)c1c[n]ccc1I Amb24073905 [0,2,0,0,0,0|2,0,0]=4 6817 B13R1.696 CN(C(=O)OC)c1cc[n]cc1N Amb18954072 [0,2,0,0,0,0|2,0,0]=4 6818 B13R1.696 CN(C(=O)OC)c1ccc[n]c1N Amb23557981 [0,2,0,0,0,0|2,0,0]=4 6819 B13R1.696 CN(C(=O)OC)c1ccccc1I Amb25097489 [0,2,0,0,0,0|1,0,0]=3 6820 B13R1.696 CN(C(=O)OC)c1ccccc1N Amb18957831 [0,2,0,0,0,0|1,0,0]=3 6821 B13R1.696 CNC(=O)C(=C)c1ccccc1F Amb25823522 [0,2,0,0,0,0|1,0,1]=4 6822 B13R1.696 CNC(=O)C(=O)c1ccccc1O Amb24410084 [0,2,0,0,0,0|1,0,1]=4 6823 B13R1.696 CNC(=O)C(Cl)c1ccccc1Br Amb24449759 [0,2,0,0,0,0|1,0,0]=3 6824 B13R1.696 CNC(=O)C(Cl)c1ccccc1Cl Amb25198433 [0,2,0,0,0,0|1,0,0]=3 6825 B13R1.696 CNC(=O)C(N)c1ccccc1Cl Amb24733869 [0,2,0,0,0,0|1,0,0]=3 6826 B13R1.696 CNC(=O)C(c1ccccc1Cl)C Amb2444727 [0,2,0,0,0,0|1,0,0]=3 6827 B13R1.696 CNC(=O)N(O)c1ccccc1Cl Amb22433830 [0,2,0,0,0,0|2,0,0]=4 6828 B13R1.696 COC(=O)C(=O)c1ccccc1Br Amb22498290 [0,2,0,0,0,0|0,0,1]=3 6829 B13R1.696 COC(=O)C(=O)c1ccccc1C Amb10562342 [0,2,0,0,0,0|0,0,1]=3 6830 B13R1.696 COC(=O)C(=O)c1ccccc1Cl Amb24054285 [0,2,0,0,0,0|0,0,1]=3 6831 B13R1.696 COC(=O)C(=O)c1ccccc1N Amb23412038 [0,2,0,0,0,0|0,0,1]=3 6832 B13R1.696 COC(=O)C(=O)c1ccccc1O Amb18128546 [0,2,0,0,0,0|0,0,1]=3 6833 B13R1.696 COC(=O)C(Br)c1ccccc1F Amb18228812 [0,2,0,0,0,0|0,0,0]=2 6834 B13R1.696 COC(=O)C(C)c1[n]cc[n]c1Cl Amb25351904 [0,2,0,0,0,0|2,0,0]=4 6835 B13R1.696 COC(=O)C(C)c1ccccc1Br Amb24597051 [0,2,0,0,0,0|0,0,0]=2 6836 B13R1.696 COC(=O)C(C)c1ccccc1Cl Amb19084563 [0,2,0,0,0,0|0,0,0]=2 6837 B13R1.696 COC(=O)C(C)c1ccccc1F Amb18187069 [0,2,0,0,0,0|0,0,0]=2 6838 B13R1.696 COC(=O)C(C)c1ccccc1I Amb24341288 [0,2,0,0,0,0|0,0,0]=2 6839 B13R1.696 COC(=O)C(C)c1ccccc1N Amb24634329 [0,2,0,0,0,0|0,0,0]=2 6840 B13R1.696 COC(=O)C(C)c1ccccc1O Amb24343860 [0,2,0,0,0,0|0,0,0]=2 6841 B13R1.696 COC(=O)C(Cl)c1ccccc1Br Amb23596603 [0,2,0,0,0,0|0,0,0]=2 6842 B13R1.696 COC(=O)C(Cl)c1ccccc1F Amb19148931 [0,2,0,0,0,0|0,0,0]=2 6843 B13R1.696 COC(=O)C(N)c1ccc[n]c1Br Amb25343341 [0,2,0,0,0,0|1,0,0]=3 6844 B13R1.696 COC(=O)C(N)c1ccc[n]c1Cl Amb24395201 [0,2,0,0,0,0|1,0,0]=3 6845 B13R1.696 COC(=O)C(N)c1ccc[n]c1F Amb24593210 [0,2,0,0,0,0|1,0,0]=3 6846 B13R1.696 COC(=O)C(N)c1ccc[n]c1N Amb24702478 [0,2,0,0,0,0|1,0,0]=3 6847 B13R1.696 COC(=O)C(N)c1ccccc1Cl Amb20623323 [0,2,0,0,0,0|0,0,0]=2 6848 B13R1.696 COC(=O)C(N)c1ccccc1F Amb20627934 [0,2,0,0,0,0|0,0,0]=2 6849 B13R1.696 COC(=O)C(N)c1ccccc1O Amb25337582 [0,2,0,0,0,0|0,0,0]=2 6850 B13R1.696 COC(=O)C(O)c1ccc[n]c1N Amb24531914 [0,2,0,0,0,0|1,0,0]=3 6851 B13R1.696 COC(=O)C(O)c1ccccc1Br Amb23596557 [0,2,0,0,0,0|0,0,0]=2 6852 B13R1.696 COC(=O)C(O)c1ccccc1F Amb19074670 [0,2,0,0,0,0|0,0,0]=2 6853 B13R1.696 COC(=O)C(O)c1ccccc1O Amb24408426 [0,2,0,0,0,0|0,0,0]=2 6854 B13R1.696 COC(=O)C(c1ccccc1C)N Amb10879656 [0,2,0,0,0,0|0,0,0]=2 6855 B13R1.696 COC(=O)C(c1ccccc1Cl)N Amb10879653 [0,2,0,0,0,0|0,0,0]=2 6856 B13R1.696 COC(=O)C(c1ccccc1F)N Amb10879650 [0,2,0,0,0,0|0,0,0]=2 6857 B13R1.696 COC(=O)N(N)c1ccccc1Cl Amb24520614 [0,2,0,0,0,0|1,0,0]=3 6858 B13R1.696 COC(=O)[C@@H](Br)c1ccccc1Cl Amb24759186 [0,2,0,0,0,0|0,0,0]=2 6859 B13R1.696 COC(=O)[C@@H](N)c1ccc[n]c1Br Amb24642908 [0,2,0,0,0,0|1,0,0]=3 6860 B13R1.696 COC(=O)[C@@H](N)c1ccc[n]c1F Amb25715233 [0,2,0,0,0,0|1,0,0]=3 6861 B13R1.696 COC(=O)[C@@H](N)c1ccc[n]c1N Amb25720217 [0,2,0,0,0,0|1,0,0]=3 6862 B13R1.696 COC(=O)[C@@H](N)c1ccccc1Cl Amb22169557 [0,2,0,0,0,0|0,0,0]=2 6863 B13R1.696 COC(=O)[C@@H](N)c1ccccc1Cl Amb22744937 [0,2,0,0,0,0|0,0,0]=2 6864 B13R1.696 COC(=O)[C@@H](N)c1ccccc1F Amb22899109 [0,2,0,0,0,0|0,0,0]=2 6865 B13R1.696 COC(=O)[C@@H](O)c1ccccc1Br Amb25704319 [0,2,0,0,0,0|0,0,0]=2 6866 B13R1.696 COC(=O)[C@@H](O)c1ccccc1Cl Amb19131235 [0,2,0,0,0,0|0,0,0]=2 6867 B13R1.696 COC(=O)[C@@H](c1ccccc1Cl)O Amb17610948 [0,2,0,0,0,0|0,0,0]=2 6868 B13R1.696 COC(=O)[C@H](N)c1ccc[n]c1Cl Amb25132876 [0,2,0,0,0,0|1,0,0]=3 6869 B13R1.696 COC(=O)[C@H](N)c1ccccc1Br Amb25858773 [0,2,0,0,0,0|0,0,0]=2 6870 B13R1.696 COC(=O)[C@H](N)c1ccccc1I Amb24488707 [0,2,0,0,0,0|0,0,0]=2 6871 B13R1.696 COC(=O)[C@H](O)c1ccccc1Br Amb25789173 [0,2,0,0,0,0|0,0,0]=2 6872 B13R1.696 COC(=O)[C@H](O)c1ccccc1F Amb25819798 [0,2,0,0,0,0|0,0,0]=2 6873 B13R1.696 COC(=O)[C@H](c1ccccc1Cl)N Amb17621788 [0,2,0,0,0,0|0,0,0]=2 6874 B13R1.696 C[C@@H](OC)[C@@H](C)c1ccccc1N Amb25794161 [0,2,0,0,0,0|1,0,1]=4 6875 B13R1.696 C[C@@H](OC)[C@H](C)c1ccccc1N Amb24433240 [0,2,0,0,0,0|1,0,1]=4 6876 B13R1.696 C\C=C(\Cl)/C(C)c1ccccc1N Amb24665072 [0,2,0,0,0,0|2,0,0]=4 6877 B13R1.696 Cc1cc[n]cc1C(C)C(=O)OC Amb25726247 [0,2,0,0,0,0|1,0,0]=3 6878 B13R1.696 Cc1cc[n]cc1C(Cl)C(=O)NC Amb24727843 [0,2,0,0,0,0|2,0,0]=4 6879 B13R1.696 Cc1cc[n]cc1C(Cl)C(=O)OC Amb25731575 [0,2,0,0,0,0|1,0,0]=3 6880 B13R1.696 Cc1ccccc1C(=O)C(=O)NC Amb19650933 [0,2,0,0,0,0|1,0,1]=4 6881 B13R1.696 Cc1ccccc1C(Br)C(=O)OC Amb18229360 [0,2,0,0,0,0|0,0,0]=2 6882 B13R1.696 Cc1ccccc1C(C)C(=O)OC Amb18184315 [0,2,0,0,0,0|0,0,0]=2 6883 B13R1.696 Cc1ccccc1C(Cl)C(=O)NC Amb18330995 [0,2,0,0,0,0|1,0,0]=3 6884 B13R1.696 Cc1ccccc1C(Cl)C(=O)OC Amb18331145 [0,2,0,0,0,0|0,0,0]=2 6885 B13R1.696 Cc1ccccc1C(N)C(=O)NC Amb25127837 [0,2,0,0,0,0|1,0,0]=3 6886 B13R1.696 Cc1ccccc1C(N)C(C)OC Amb25306982 [0,2,0,0,0,0|1,0,1]=4 6887 B13R1.696 Cc1ccccc1C(O)C(=C)CC Amb24354384 [0,2,0,0,0,0|2,0,0]=4 6888 B13R1.696 Cc1ccccc1C(O)C(=O)OC Amb18809302 [0,2,0,0,0,0|0,0,0]=2 6889 B13R1.696 Cc1ccccc1N(C)C(=O)NC Amb25323417 [0,2,0,0,0,0|2,0,0]=4 6890 B13R1.696 Cc1ccccc1[C@H](O)C(=O)OC Amb25706095 [0,2,0,0,0,0|0,0,0]=2 6891 B13R1.696 NNC(=O)C(N)c1ccccc1F Amb24342481 [0,2,0,0,0,0|2,0,0]=4 6892 B13R1.696 Oc1ccccc1C(O)C(=O)CO Amb24647892 [0,2,0,0,0,0|2,0,0]=4 6893 B13R1.708 C=CC(=O)C(c1ccccc1)(O)C Amb10562822 [0,2,0,0,0,0|1,0,1]=4 6894 B13R1.708 CC(Br)(C(=O)OC)c1cccc[n]1 Amb25041831 [0,2,0,0,0,0|1,0,0]=3 6895 B13R1.708 CC(Br)(C(=O)OC)c1ccccc1 Amb23537917 [0,2,0,0,0,0|0,0,0]=2 6896 B13R1.708 CC(C)(C(=N)OC)c1ccccc1 Amb18790848 [0,2,0,0,0,0|1,0,0]=3 6897 B13R1.708 CC(C)(C(=O)C#C)c1ccccc1 Amb24362116 [0,2,0,0,0,0|1,0,1]=4 6898 B13R1.708 CC(C)(C(=O)C#N)c1ccccc1 Amb24534512 [0,2,0,0,0,0|2,0,0]=4 6899 B13R1.708 CC(C)(C(=O)CBr)c1ccccc1 Amb24435085 [0,2,0,0,0,0|2,0,0]=4 6900 B13R1.708 CC(C)(C(=O)CC)c1ccccc1 Amb18790765 [0,2,0,0,0,0|1,0,0]=3 6901 B13R1.708 CC(C)(C(=O)OC)c1ccc[n]c1 Amb24331956 [0,2,0,0,0,0|1,0,0]=3 6902 B13R1.708 CC(Cl)(C(=O)NC)c1ccccc1 Amb24492676 [0,2,0,0,0,0|1,0,0]=3 6903 B13R1.708 CC(N)(C(=O)C#C)c1ccccc1 Amb25155621 [0,2,0,0,0,0|1,0,1]=4 6904 B13R1.708 CC(N)(C(=O)CC)c1ccccc1 Amb25843629 [0,2,0,0,0,0|1,0,0]=3 6905 B13R1.708 CC(N)(C(=O)NC)c1ccccc1 Amb18961972 [0,2,0,0,0,0|1,0,0]=3 6906 B13R1.708 CC(N)(C(=O)NO)c1ccccc1 Amb25772043 [0,2,0,0,0,0|2,0,0]=4 6907 B13R1.708 CC(N)(C(=O)OC)c1cc[n]cc1 Amb18968174 [0,2,0,0,0,0|1,0,0]=3 6908 B13R1.708 CC(N)(C(=O)OC)c1ccc[n]c1 Amb18288975 [0,2,0,0,0,0|1,0,0]=3 6909 B13R1.708 CC(N)(C(=O)OC)c1cccc[n]1 Amb18968166 [0,2,0,0,0,0|1,0,0]=3 6910 B13R1.708 CC(N)(C(=O)OC)c1ccccc1 Amb19373026 [0,2,0,0,0,0|0,0,0]=2 6911 B13R1.708 CC(O)(C(=O)NC)c1cccc[n]1 Amb25369257 [0,2,0,0,0,0|2,0,0]=4 6912 B13R1.708 CC(O)(C(=O)OC)c1cc[n]cc1 Amb18186775 [0,2,0,0,0,0|1,0,0]=3 6913 B13R1.708 CC(O)(C(=O)OC)c1ccc[n]c1 Amb18186774 [0,2,0,0,0,0|1,0,0]=3 6914 B13R1.708 CC(O)(C(=O)OC)c1cccc[n]1 Amb18186773 [0,2,0,0,0,0|1,0,0]=3 6915 B13R1.708 CC(O)(C(=O)OC)c1ccccc1 Amb18186543 [0,2,0,0,0,0|0,0,0]=2 6916 B13R1.708 CCS(=O)C(C)(C)c1ccccc1 Amb24510228 [0,2,0,0,0,0|2,0,0]=4 6917 B13R1.708 CNC(=O)C(F)(Cl)c1ccccc1 Amb25307221 [0,2,0,0,0,0|1,0,0]=3 6918 B13R1.708 CNC(=O)C(F)(F)c1cc[n]cc1 Amb24380413 [0,2,0,0,0,0|2,0,0]=4 6919 B13R1.708 COC(=O)C(C)(C)c1c[n]cc[n]1 Amb25041801 [0,2,0,0,0,0|2,0,0]=4 6920 B13R1.708 COC(=O)C(C)(N)c1c[n]cc[n]1 Amb25325603 [0,2,0,0,0,0|2,0,0]=4 6921 B13R1.708 COC(=O)C(C)(O)c1c[n]cc[n]1 Amb25790351 [0,2,0,0,0,0|2,0,0]=4 6922 B13R1.708 COC(=O)C(F)(Cl)c1ccccc1 Amb25848122 [0,2,0,0,0,0|0,0,0]=2 6923 B13R1.708 COC(=O)C(F)(F)c1ccccc1 Amb25053334 [0,2,0,0,0,0|0,0,0]=2 6924 B13R1.708 COC(=O)C(N)(Cl)c1ccccc1 Amb24493896 [0,2,0,0,0,0|0,0,0]=2 6925 B13R1.708 COC(=O)C(O)(O)c1cc[n]cc1 Amb24733578 [0,2,0,0,0,0|1,0,0]=3 6926 B13R1.708 COC(=O)C(c1ccccc1)(N)C Amb17400717 [0,2,0,0,0,0|0,0,0]=2 6927 B13R1.708 COC(=O)[C@@](C)(N)c1c[n]cc[n]1 Amb25761085 [0,2,0,0,0,0|2,0,0]=4 6928 B13R1.708 COC(C)C(C)(O)c1ccccc1 Amb25834742 [0,2,0,0,0,0|1,0,1]=4 6929 B13R1.708 C[C@@](N)(C(=O)OC)c1cc[n]cc1 Amb24635599 [0,2,0,0,0,0|1,0,0]=3 6930 B13R1.708 C[C@@](N)(C(=O)OC)c1ccc[n]c1 Amb25039478 [0,2,0,0,0,0|1,0,0]=3 6931 B13R1.708 C[C@@](N)(C(=O)OC)c1cccc[n]1 Amb24442824 [0,2,0,0,0,0|1,0,0]=3 6932 B13R1.708 C[C@@](N)(C(=O)OC)c1ccccc1 Amb25251449 [0,2,0,0,0,0|0,0,0]=2 6933 B13R1.708 C[C@@](O)(C(=O)CC)c1ccccc1 Amb24633433 [0,2,0,0,0,0|1,0,0]=3 6934 B13R1.708 C[C@](N)(C(=O)OC)c1cc[n]cc1 Amb24432776 [0,2,0,0,0,0|1,0,0]=3 6935 B13R1.708 C[C@](N)(C(=O)OC)c1ccc[n]c1 Amb24400557 [0,2,0,0,0,0|1,0,0]=3 6936 B13R1.708 C[C@](N)(C(=O)OC)c1cccc[n]1 Amb25760129 [0,2,0,0,0,0|1,0,0]=3 6937 B13R1.708 C[C@](O)(C(=O)CC)c1ccccc1 Amb24534294 [0,2,0,0,0,0|1,0,0]=3 6938 B13R1.708 NCC(=O)C(F)(F)c1ccccc1 Amb25178376 [0,2,0,0,0,0|2,0,0]=4 6939 B13R1.708 NNC(=O)C(F)(F)c1ccccc1 Amb25777644 [0,2,0,0,0,0|2,0,0]=4 6940 B13R1.133 CC(=C)C(=O)Cc1ccc(Cl)cc1 Amb25696266 [0,2,0,0,0,0|1,0,0]=3 6941 B13R1.133 CC(=C)C(=O)Cc1ccc(N)cc1 Amb25104589 [0,2,0,0,0,0|1,0,0]=3 6942 B13R1.133 CC(=C)C(=O)Nc1ccc(Br)cc1 Amb22001452 [0,2,0,0,0,0|2,0,0]=4 6943 B13R1.133 CC(=C)C(=O)Nc1ccc(N)cc1 Amb24390819 [0,2,0,0,0,0|2,0,0]=4 6944 B13R1.133 CC(=C)C(=O)Nc1ccc(O)cc1 Amb17934074 [0,2,0,0,0,0|2,0,0]=4 6945 B13R1.133 CC(=C)C(=O)Oc1ccc(Cl)cc1 Amb25138122 [0,2,0,0,0,0|2,0,0]=4 6946 B13R1.133 CC(=C)C(=O)Oc1ccc(N)cc1 Amb18127866 [0,2,0,0,0,0|2,0,0]=4 6947 B13R1.133 CC(=O)C(=O)Cc1ccc(Br)cc1 Amb23603629 [0,2,0,0,0,0|1,0,0]=3 6948 B13R1.133 CC(=O)C(=O)Cc1ccc(C)cc1 Amb23603620 [0,2,0,0,0,0|1,0,0]=3 6949 B13R1.133 CC(=O)C(=O)Cc1ccc(Cl)cc1 Amb23603627 [0,2,0,0,0,0|1,0,0]=3 6950 B13R1.133 CC(=O)C(=O)Cc1ccc(F)cc1 Amb23603622 [0,2,0,0,0,0|1,0,0]=3 6951 B13R1.133 CC(=O)C(=O)Nc1ccc(I)cc1 Amb21949004 [0,2,0,0,0,0|2,0,0]=4 6952 B13R1.133 CC(=O)C(=O)Oc1ccc(O)cc1 Amb25730163 [0,2,0,0,0,0|2,0,0]=4 6953 B13R1.133 CC(Br)C(=O)Nc1ccc(I)cc1 Amb25851732 [0,2,0,0,0,0|2,0,0]=4 6954 B13R1.133 CC(Br)C(=O)Nc1ccc(N)cc1 Amb25043730 [0,2,0,0,0,0|2,0,0]=4 6955 B13R1.133 CC(Br)C(=O)Oc1ccc(Cl)cc1 Amb25155222 [0,2,0,0,0,0|2,0,0]=4 6956 B13R1.133 CC(Br)C(=O)Oc1ccc(F)cc1 Amb17772362 [0,2,0,0,0,0|2,0,0]=4 6957 B13R1.133 CC(C(=O)Cc1ccc(cc1)F)C Amb17138955 [0,2,0,0,0,0|1,0,0]=3 6958 B13R1.133 CC(C(=O)Nc1ccc(cc1)Br)Cl Amb1208020 [0,2,0,0,0,0|2,0,0]=4 6959 B13R1.133 CC(C(=O)Nc1ccc(cc1)Br)O Amb17410948 [0,2,0,0,0,0|2,0,0]=4 6960 B13R1.133 CC(C(=O)Nc1ccc(cc1)Cl)C Amb2409473 [0,2,0,0,0,0|2,0,0]=4 6961 B13R1.133 CC(C(=O)Nc1ccc(cc1)Cl)N Amb1871264 [0,2,0,0,0,0|2,0,0]=4 6962 B13R1.133 CC(C(=O)Nc1ccc(cc1)Cl)O Amb17402322 [0,2,0,0,0,0|2,0,0]=4 6963 B13R1.133 CC(C(=O)Nc1ccc(cc1)F)Br Amb10788560 [0,2,0,0,0,0|2,0,0]=4 6964 B13R1.133 CC(C(=O)Nc1ccc(cc1)F)Cl Amb2274017 [0,2,0,0,0,0|2,0,0]=4 6965 B13R1.133 CC(C(=O)Nc1ccc(cc1)F)O Amb17400968 [0,2,0,0,0,0|2,0,0]=4 6966 B13R1.133 CC(C(=O)Nc1ccc(cc1)O)Br Amb10561094 [0,2,0,0,0,0|2,0,0]=4 6967 B13R1.133 CC(C(=O)Oc1ccc(cc1)Br)N Amb17349676 [0,2,0,0,0,0|2,0,0]=4 6968 B13R1.133 CC(C(=O)Oc1ccc(cc1)Cl)N Amb17337485 [0,2,0,0,0,0|2,0,0]=4 6969 B13R1.133 CC(C(=O)Oc1ccc(cc1)F)N Amb17335604 [0,2,0,0,0,0|2,0,0]=4 6970 B13R1.133 CC(C)C(=O)CN1C=CC(=O)C=C1 Amb25344027 [0,2,0,0,0,0|2,0,0]=4 6971 B13R1.133 CC(C)C(=O)Cc1ccc(Br)c[n]1 Amb24427999 [0,2,0,0,0,0|2,0,0]=4 6972 B13R1.133 CC(C)C(=O)Cc1ccc(Br)cc1 Amb25077569 [0,2,0,0,0,0|1,0,0]=3 6973 B13R1.133 CC(C)C(=O)Cc1ccc(Cl)cc1 Amb18034025 [0,2,0,0,0,0|1,0,0]=3 6974 B13R1.133 CC(C)C(=O)Nc1ccc(S)cc1 Amb24441576 [0,2,0,0,0,0|2,0,0]=4 6975 B13R1.133 CC(C)C(=O)Oc1ccc(I)cc1 Amb25687715 [0,2,0,0,0,0|2,0,0]=4 6976 B13R1.133 CC(C)S(=O)Cc1ccc(N)cc1 Amb18291559 [0,2,0,0,0,0|2,0,0]=4 6977 B13R1.133 CC(Cl)C(=O)Cc1ccc(F)cc1 Amb25751992 [0,2,0,0,0,0|1,0,0]=3 6978 B13R1.133 CC(Cl)C(=O)Oc1ccc(Cl)cc1 Amb24063640 [0,2,0,0,0,0|2,0,0]=4 6979 B13R1.133 CC(F)C(=O)Nc1ccc(N)cc1 Amb25857971 [0,2,0,0,0,0|2,0,0]=4 6980 B13R1.133 CC(I)C(=O)Nc1ccc(Br)cc1 Amb23579968 [0,2,0,0,0,0|2,0,0]=4 6981 B13R1.133 CC(I)C(=O)Nc1ccc(Cl)cc1 Amb23579966 [0,2,0,0,0,0|2,0,0]=4 6982 B13R1.133 CC(I)C(=O)Nc1ccc(F)cc1 Amb23579963 [0,2,0,0,0,0|2,0,0]=4 6983 B13R1.133 CC(N)C(=O)Cc1ccc(Br)cc1 Amb18727287 [0,2,0,0,0,0|1,0,0]=3 6984 B13R1.133 CC(N)C(=O)Cc1ccc(Cl)cc1 Amb18188148 [0,2,0,0,0,0|1,0,0]=3 6985 B13R1.133 CC(N)C(=O)Cc1ccc(F)cc1 Amb18193155 [0,2,0,0,0,0|1,0,0]=3 6986 B13R1.133 CC(N)C(=O)Cc1ccc(I)cc1 Amb25104635 [0,2,0,0,0,0|1,0,0]=3 6987 B13R1.133 CC(N)C(=O)Cc1ccc(O)cc1 Amb25155991 [0,2,0,0,0,0|1,0,0]=3 6988 B13R1.133 CC(N)C(=O)Nc1ccc(F)cc1 Amb21959100 [0,2,0,0,0,0|2,0,0]=4 6989 B13R1.133 CC(O)C(=O)Cc1ccc(Br)c[n]1 Amb24556257 [0,2,0,0,0,0|2,0,0]=4 6990 B13R1.133 CC(O)C(=O)Cc1ccc(F)cc1 Amb25848911 [0,2,0,0,0,0|1,0,0]=3 6991 B13R1.133 CC(O)C(=O)Cc1ccc(I)cc1 Amb25066618 [0,2,0,0,0,0|1,0,0]=3 6992 B13R1.133 CC(S)C(=O)Nc1ccc(Cl)cc1 Amb24490205 [0,2,0,0,0,0|2,0,0]=4 6993 B13R1.133 CC(S)C(=O)Nc1ccc(O)cc1 Amb24396216 [0,2,0,0,0,0|2,0,0]=4 6994 B13R1.133 CN(C(=O)Cc1ccc(cc1)N)C Amb1131914 [0,2,0,0,0,0|1,0,0]=3 6995 B13R1.133 CN(C(=O)Cc1ccc(cc1)O)C Amb10068674 [0,2,0,0,0,0|1,0,0]=3 6996 B13R1.133 CN(C(=O)Nc1ccc(cc1)Br)C Amb2572238 [0,2,0,0,0,0|2,0,0]=4 6997 B13R1.133 CN(C(=O)Nc1ccc(cc1)Cl)C Amb1196557 [0,2,0,0,0,0|2,0,0]=4 6998 B13R1.133 CN(C(=O)Nc1ccc(cc1)Cl)O Amb2416133 [0,2,0,0,0,0|2,0,0]=4 6999 B13R1.133 CN(C(=O)Nc1ccc(cc1)F)C Amb1233534 [0,2,0,0,0,0|2,0,0]=4 7000 B13R1.133 CN(C(=O)Nc1ccc(cc1)I)C Amb2572235 [0,2,0,0,0,0|2,0,0]=4 7001 B13R1.133 CN(C(=O)Nc1ccc(cc1)O)C Amb2571899 [0,2,0,0,0,0|2,0,0]=4 7002 B13R1.133 CN(C(=S)Cc1ccc(cc1)Br)C Amb2103117 [0,2,0,0,0,0|1,1,0]=4 7003 B13R1.133 CN(C(=S)Cc1ccc(cc1)Cl)C Amb2103115 [0,2,0,0,0,0|1,1,0]=4 7004 B13R1.133 CN(C)C(=N)Cc1ccc(Br)cc1 Amb24718681 [0,2,0,0,0,0|2,0,0]=4 7005 B13R1.133 CN(C)C(=O)CN1C=CC(=O)C=C1 Amb25155767 [0,2,0,0,0,0|2,0,0]=4 7006 B13R1.133 CN(C)C(=O)Cc1ccc(Cl)[n]c1 Amb24676258 [0,2,0,0,0,0|2,0,0]=4 7007 B13R1.133 CN(C)C(=O)Cc1ccc(Cl)c[n]1 Amb25848060 [0,2,0,0,0,0|2,0,0]=4 7008 B13R1.133 CN(C)C(=O)Cc1ccc(F)c[n]1 Amb24510023 [0,2,0,0,0,0|2,0,0]=4 7009 B13R1.133 CN(C)C(=O)Cc1ccc(I)cc1 Amb24676259 [0,2,0,0,0,0|1,0,0]=3 7010 B13R1.133 CN(C)C(=O)Cc1ccc(N)c[n]1 Amb25673883 [0,2,0,0,0,0|2,0,0]=4 7011 B13R1.133 CN(C)C(=O)Cc1ccc(S)cc1 Amb25101701 [0,2,0,0,0,0|1,0,0]=3 7012 B13R1.133 CN(C)C(=O)Oc1ccc(Cl)cc1 Amb24456204 [0,2,0,0,0,0|2,0,0]=4 7013 B13R1.133 CN(C)C(=O)Oc1ccc(N)cc1 Amb25201951 [0,2,0,0,0,0|2,0,0]=4 7014 B13R1.133 CN(C)C(=O)Sc1ccc(Cl)cc1 Amb25766589 [0,2,0,0,0,0|2,0,0]=4 7015 B13R1.133 CN(C)C(=O)Sc1ccc(N)cc1 Amb19514724 [0,2,0,0,0,0|2,0,0]=4 7016 B13R1.133 CN(N)C(=O)Cc1ccc(F)cc1 Amb25267853 [0,2,0,0,0,0|1,0,0]=3 7017 B13R1.133 CN(N)C(=O)Nc1ccc(Br)cc1 Amb22480619 [0,2,0,0,0,0|2,0,0]=4 7018 B13R1.133 CN(N)C(=O)Nc1ccc(Cl)cc1 Amb22454351 [0,2,0,0,0,0|2,0,0]=4 7019 B13R1.133 CN(N)C(=O)Nc1ccc(F)cc1 Amb24356668 [0,2,0,0,0,0|2,0,0]=4 7020 B13R1.133 CN(N)C(=O)Nc1ccc(I)cc1 Amb22473356 [0,2,0,0,0,0|2,0,0]=4 7021 B13R1.133 CN(O)C(=O)Cc1ccc(N)c[n]1 Amb25339527 [0,2,0,0,0,0|2,0,0]=4 7022 B13R1.133 CN(O)C(=O)Cc1ccc(N)cc1 Amb24654879 [0,2,0,0,0,0|1,0,0]=3 7023 B13R1.133 C[C@@H](F)C(=O)Nc1ccc(N)cc1 Amb25351732 [0,2,0,0,0,0|2,0,0]=4 7024 B13R1.133 C[C@@H](N)C(=O)Nc1ccc(Br)cc1 Amb18014690 [0,2,0,0,0,0|2,0,0]=4 7025 B13R1.133 C[C@@H](N)C(=O)Nc1ccc(Cl)cc1 Amb18527915 [0,2,0,0,0,0|2,0,0]=4 7026 B13R1.133 C[C@@H](N)C(=O)Nc1ccc(F)cc1 Amb18014684 [0,2,0,0,0,0|2,0,0]=4 7027 B13R1.133 C[C@@H](N)C(=O)Nc1ccc(N)cc1 Amb24474610 [0,2,0,0,0,0|2,0,0]=4 7028 B13R1.133 C[C@@H](N)C(=O)Nc1ccc(O)cc1 Amb18181077 [0,2,0,0,0,0|2,0,0]=4 7029 B13R1.133 C[C@@H](O)C(=O)Nc1ccc(Br)cc1 Amb24371942 [0,2,0,0,0,0|2,0,0]=4 7030 B13R1.133 C[C@@H](O)C(=O)Nc1ccc(Cl)cc1 Amb24412863 [0,2,0,0,0,0|2,0,0]=4 7031 B13R1.133 C[C@@H](O)C(=O)Nc1ccc(F)cc1 Amb25829779 [0,2,0,0,0,0|2,0,0]=4 7032 B13R1.133 C[C@@H](O)C(=O)Nc1ccc(I)cc1 Amb25818032 [0,2,0,0,0,0|2,0,0]=4 7033 B13R1.133 C[C@@H](O)C(=O)Nc1ccc(O)cc1 Amb25296984 [0,2,0,0,0,0|2,0,0]=4 7034 B13R1.133 C[C@@H](O)C(=O)Oc1ccc(Br)cc1 Amb25749588 [0,2,0,0,0,0|2,0,0]=4 7035 B13R1.133 C[C@@H](O)C(=O)Oc1ccc(Cl)cc1 Amb25749589 [0,2,0,0,0,0|2,0,0]=4 7036 B13R1.133 C[C@@H](O)C(=O)Oc1ccc(I)cc1 Amb25847716 [0,2,0,0,0,0|2,0,0]=4 7037 B13R1.133 C[C@H](Br)C(=O)Nc1ccc(N)cc1 Amb24556874 [0,2,0,0,0,0|2,0,0]=4 7038 B13R1.133 C[C@H](N)C(=O)Nc1ccc(N)cc1 Amb25732016 [0,2,0,0,0,0|2,0,0]=4 7039 B13R1.133 C[C@H](N)C(=O)Nc1ccc(O)cc1 Amb25327310 [0,2,0,0,0,0|2,0,0]=4 7040 B13R1.133 C[C@H](N)C(=O)Oc1ccc(F)cc1 Amb24489006 [0,2,0,0,0,0|2,0,0]=4 7041 B13R1.133 C[C@H](N)C(=O)Oc1ccc(O)cc1 Amb24696635 [0,2,0,0,0,0|2,0,0]=4 7042 B13R1.133 C[C@H](O)C(=O)Nc1ccc(F)cc1 Amb25307302 [0,2,0,0,0,0|2,0,0]=4 7043 B13R1.133 C[C@H](O)C(=O)Oc1ccc(Br)cc1 Amb24613750 [0,2,0,0,0,0|2,0,0]=4 7044 B13R1.133 C[C@H](O)C(=O)Oc1ccc(Cl)cc1 Amb25032716 [0,2,0,0,0,0|2,0,0]=4 7045 B13R1.133 Cc1ccc(CC(=O)C(C)N)cc1 Amb18195845 [0,2,0,0,0,0|1,0,0]=3 7046 B13R1.133 Cc1ccc(CC(=O)C(F)F)cc1 Amb18322779 [0,2,0,0,0,0|2,0,0]=4 7047 B13R1.133 Cc1ccc(CC(=O)N(C)C)c[n]1 Amb24459028 [0,2,0,0,0,0|2,0,0]=4 7048 B13R1.133 Cc1ccc(cc1)CC(=S)N(C)C Amb2103116 [0,2,0,0,0,0|1,1,0]=4 7049 B13R1.133 Cc1ccc(cc1)NC(=O)C(=C)C Amb2410051 [0,2,0,0,0,0|2,0,0]=4 7050 B13R1.133 Cc1ccc(cc1)NC(=O)C(=O)C Amb17400600 [0,2,0,0,0,0|2,0,0]=4 7051 B13R1.133 Cc1ccc(cc1)NC(=O)C(C)I Amb23579969 [0,2,0,0,0,0|2,0,0]=4 7052 B13R1.133 Cc1ccc(cc1)NC(=O)C(C)N Amb21959026 [0,2,0,0,0,0|2,0,0]=4 7053 B13R1.133 Cc1ccc(cc1)NC(=O)C(C)S Amb24606513 [0,2,0,0,0,0|2,0,0]=4 7054 B13R1.133 Cc1ccc(cc1)NC(=O)N(C)C Amb1240560 [0,2,0,0,0,0|2,0,0]=4 7055 B13R1.133 Cc1ccc(cc1)NC(=O)[C@@H](C)Cl Amb25241558 [0,2,0,0,0,0|2,0,0]=4 7056 B13R1.133 Cc1ccc(cc1)NC(=O)[C@@H](C)N Amb18527912 [0,2,0,0,0,0|2,0,0]=4 7057 B13R1.133 Cc1ccc(cc1)NC(=O)[C@H](C)O Amb24490412 [0,2,0,0,0,0|2,0,0]=4 7058 B13R1.133 Cc1ccc(cc1)OC(=O)[C@@H](C)O Amb25706037 [0,2,0,0,0,0|2,0,0]=4 7059 B13R1.133 Nc1ccc(CC(=O)C(O)=O)cc1 Amb24433983 [0,2,0,0,0,0|2,0,0]=4 7060 B13R1.133 O=C(C(=C)C)Nc1ccc(cc1)Cl Amb2406800 [0,2,0,0,0,0|2,0,0]=4 7061 B13R1.133 O=C(C(=O)C)Nc1ccc(cc1)Br Amb2383840 [0,2,0,0,0,0|2,0,0]=4 7062 B13R1.133 O=C(C(=O)C)Nc1ccc(cc1)Cl Amb2421104 [0,2,0,0,0,0|2,0,0]=4 7063 B13R1.133 O=C(C(=O)C)Nc1ccc(cc1)F Amb17400856 [0,2,0,0,0,0|2,0,0]=4 7064 B13R1.133 O=C(C(=O)O)Cc1ccc(cc1)Br Amb1140012 [0,2,0,0,0,0|2,0,0]=4 7065 B13R1.133 O=C(C(=O)O)Cc1ccc(cc1)C Amb1140634 [0,2,0,0,0,0|2,0,0]=4 7066 B13R1.133 O=C(C(=O)O)Cc1ccc(cc1)Cl Amb1141688 [0,2,0,0,0,0|2,0,0]=4 7067 B13R1.133 O=C(C(=O)O)Cc1ccc(cc1)F Amb1130482 [0,2,0,0,0,0|2,0,0]=4 7068 B13R1.133 O=C(C(Br)C)Nc1ccc(cc1)C Amb10788594 [0,2,0,0,0,0|2,0,0]=4 7069 B13R1.133 O=C(C(C)C)Cc1ccc(cc1)C Amb17138782 [0,2,0,0,0,0|1,0,0]=3 7070 B13R1.133 O=C(C(Cl)C)Nc1ccc(cc1)C Amb1643637 [0,2,0,0,0,0|2,0,0]=4 7071 B13R1.133 O=C(C(Cl)C)Nc1ccc(cc1)Cl Amb2516259 [0,2,0,0,0,0|2,0,0]=4 7072 B13R1.133 O=C(C(Cl)C)Sc1ccc(cc1)C Amb2447241 [0,2,0,0,0,0|2,0,0]=4 7073 B13R1.133 O=C(C(N)C)Oc1ccc(cc1)C Amb17335315 [0,2,0,0,0,0|2,0,0]=4 7074 B13R1.133 O=C(C(O)C)Nc1ccc(cc1)C Amb17400712 [0,2,0,0,0,0|2,0,0]=4 7075 B13R1.133 O=C(Cc1ccc(Cl)cc1)C(F)F Amb24394088 [0,2,0,0,0,0|2,0,0]=4 7076 B13R1.133 O=C(Cc1ccc(F)cc1)C(F)F Amb19059630 [0,2,0,0,0,0|2,0,0]=4 7077 B13R1.133 Oc1ccc(cc1)CC(=O)C(=O)O Amb1124591 [0,2,0,0,0,0|2,0,0]=4 7078 B13R1.148 Brc1cccc(c1)CC(=O)C(=O)O Amb1137720 [0,2,0,0,0,0|2,0,0]=4 7079 B13R1.148 Brc1cccc(c1)NC(=O)C(=O)C Amb17410540 [0,2,0,0,0,0|2,0,0]=4 7080 B13R1.148 CC(=C)C(=O)Cc1c[n]cc(Br)c1 Amb25366888 [0,2,0,0,0,0|2,0,0]=4 7081 B13R1.148 CC(=C)C(=O)Nc1cccc(Cl)c1 Amb22461310 [0,2,0,0,0,0|2,0,0]=4 7082 B13R1.148 CC(=C)C(=O)Nc1cccc(F)c1 Amb25216149 [0,2,0,0,0,0|2,0,0]=4 7083 B13R1.148 CC(=C)C(=O)Nc1cccc(O)c1 Amb24434891 [0,2,0,0,0,0|2,0,0]=4 7084 B13R1.148 CC(=C)C(=O)Oc1cccc(Br)c1 Amb25802008 [0,2,0,0,0,0|2,0,0]=4 7085 B13R1.148 CC(=C)C(=O)Oc1cccc(Cl)c1 Amb25159034 [0,2,0,0,0,0|2,0,0]=4 7086 B13R1.148 CC(=C)C(=O)Oc1cccc(O)c1 Amb25838787 [0,2,0,0,0,0|2,0,0]=4 7087 B13R1.148 CC(=O)C(=O)Cc1cc(C)ccc1 Amb23603621 [0,2,0,0,0,0|1,0,0]=3 7088 B13R1.148 CC(=O)C(=O)Cc1cccc(Br)c1 Amb23603630 [0,2,0,0,0,0|1,0,0]=3 7089 B13R1.148 CC(=O)C(=O)Cc1cccc(Cl)c1 Amb23603628 [0,2,0,0,0,0|1,0,0]=3 7090 B13R1.148 CC(=O)C(=O)Cc1cccc(F)c1 Amb23603623 [0,2,0,0,0,0|1,0,0]=3 7091 B13R1.148 CC(Br)C(=O)Nc1cc(Br)ccc1 Amb24638501 [0,2,0,0,0,0|2,0,0]=4 7092 B13R1.148 CC(C)C(=O)Cc1c[n]cc(Br)c1 Amb25156108 [0,2,0,0,0,0|2,0,0]=4 7093 B13R1.148 CC(C)C(=O)Cc1cc[n]c(N)c1 Amb24493966 [0,2,0,0,0,0|2,0,0]=4 7094 B13R1.148 CC(C)C(=O)Cc1cccc(N)c1 Amb24618101 [0,2,0,0,0,0|1,0,0]=3 7095 B13R1.148 CC(C)C(=O)Oc1cccc(I)c1 Amb24505586 [0,2,0,0,0,0|2,0,0]=4 7096 B13R1.148 CC(C)S(=O)Cc1cccc(N)c1 Amb18290937 [0,2,0,0,0,0|2,0,0]=4 7097 B13R1.148 CC(Cl)C(=O)Cc1cc(Cl)ccc1 Amb24534615 [0,2,0,0,0,0|1,0,0]=3 7098 B13R1.148 CC(Cl)C(=O)Nc1cccc(N)c1 Amb24358080 [0,2,0,0,0,0|2,0,0]=4 7099 B13R1.148 CC(I)C(=O)Nc1cccc(Cl)c1 Amb23579965 [0,2,0,0,0,0|2,0,0]=4 7100 B13R1.148 CC(N)C(=O)Cc1cccc(Br)c1 Amb18727292 [0,2,0,0,0,0|1,0,0]=3 7101 B13R1.148 CC(N)C(=O)Cc1cccc(Cl)c1 Amb18188149 [0,2,0,0,0,0|1,0,0]=3 7102 B13R1.148 CC(N)C(=O)Cc1cccc(F)c1 Amb18193154 [0,2,0,0,0,0|1,0,0]=3 7103 B13R1.148 CC(N)C(=O)Cc1cccc(O)c1 Amb24673789 [0,2,0,0,0,0|1,0,0]=3 7104 B13R1.148 CC(N)C(=O)Nc1cccc(O)c1 Amb18951678 [0,2,0,0,0,0|2,0,0]=4 7105 B13R1.148 CC(O)C(=O)Cc1cc[n]c(N)c1 Amb24411921 [0,2,0,0,0,0|2,0,0]=4 7106 B13R1.148 CC(O)C(=O)Cc1cccc(Br)c1 Amb24454281 [0,2,0,0,0,0|1,0,0]=3 7107 B13R1.148 CC(O)C(=O)Cc1cccc(Cl)c1 Amb25226019 [0,2,0,0,0,0|1,0,0]=3 7108 B13R1.148 CC(O)C(=O)Oc1cccc(Br)c1 Amb24397770 [0,2,0,0,0,0|2,0,0]=4 7109 B13R1.148 CC(O)C(=O)Oc1cccc(Cl)c1 Amb25686755 [0,2,0,0,0,0|2,0,0]=4 7110 B13R1.148 CC(S)C(=O)Nc1cccc(F)c1 Amb25042899 [0,2,0,0,0,0|2,0,0]=4 7111 B13R1.148 CN(C)C(=N)Cc1cccc(F)c1 Amb24457262 [0,2,0,0,0,0|2,0,0]=4 7112 B13R1.148 CN(C)C(=O)Cc1cc(Cl)cc[n]1 Amb20669409 [0,2,0,0,0,0|2,0,0]=4 7113 B13R1.148 CN(C)C(=O)Cc1cc[n]c(Cl)c1 Amb24743717 [0,2,0,0,0,0|2,0,0]=4 7114 B13R1.148 CN(C)C(=O)Cc1cccc(Br)c1 Amb23111039 [0,2,0,0,0,0|1,0,0]=3 7115 B13R1.148 CN(C)C(=O)Cc1cccc(Cl)c1 Amb23089205 [0,2,0,0,0,0|1,0,0]=3 7116 B13R1.148 CN(C)C(=O)Cc1cccc(I)c1 Amb22491389 [0,2,0,0,0,0|1,0,0]=3 7117 B13R1.148 CN(C)C(=O)Cc1cccc(O)c1 Amb18178663 [0,2,0,0,0,0|1,0,0]=3 7118 B13R1.148 CN(C)C(=O)Nc1cccc(I)c1 Amb25677099 [0,2,0,0,0,0|2,0,0]=4 7119 B13R1.148 CN(C)C(=O)Sc1cccc(N)c1 Amb19514721 [0,2,0,0,0,0|2,0,0]=4 7120 B13R1.148 CN(C)C(=O)Sc1cccc(N)c1 Amb25190381 [0,2,0,0,0,0|2,0,0]=4 7121 B13R1.148 CN(N)C(=O)Nc1cccc(Cl)c1 Amb22454415 [0,2,0,0,0,0|2,0,0]=4 7122 B13R1.148 CN(O)C(=O)Nc1cc(O)ccc1 Amb24444879 [0,2,0,0,0,0|2,0,0]=4 7123 B13R1.148 CN(O)C(=O)Nc1cccc(F)c1 Amb25119171 [0,2,0,0,0,0|2,0,0]=4 7124 B13R1.148 C[C@@H](Cl)C(=O)Nc1cc(Cl)ccc1 Amb25081086 [0,2,0,0,0,0|2,0,0]=4 7125 B13R1.148 C[C@@H](N)C(=O)Nc1cccc(Br)c1 Amb18527939 [0,2,0,0,0,0|2,0,0]=4 7126 B13R1.148 C[C@@H](N)C(=O)Nc1cccc(Cl)c1 Amb18527914 [0,2,0,0,0,0|2,0,0]=4 7127 B13R1.148 C[C@@H](N)C(=O)Nc1cccc(F)c1 Amb18014734 [0,2,0,0,0,0|2,0,0]=4 7128 B13R1.148 C[C@@H](N)C(=O)Nc1cccc(O)c1 Amb18181078 [0,2,0,0,0,0|2,0,0]=4 7129 B13R1.148 C[C@@H](O)C(=O)Nc1cc(O)ccc1 Amb24475768 [0,2,0,0,0,0|2,0,0]=4 7130 B13R1.148 C[C@@H](O)C(=O)Nc1cccc(Br)c1 Amb25749571 [0,2,0,0,0,0|2,0,0]=4 7131 B13R1.148 C[C@@H](O)C(=O)Nc1cccc(Cl)c1 Amb25734303 [0,2,0,0,0,0|2,0,0]=4 7132 B13R1.148 C[C@@H](O)C(=O)Nc1cccc(I)c1 Amb25829784 [0,2,0,0,0,0|2,0,0]=4 7133 B13R1.148 C[C@@H](O)C(=O)Oc1cccc(Cl)c1 Amb25052790 [0,2,0,0,0,0|2,0,0]=4 7134 B13R1.148 C[C@@H](O)C(=O)Oc1cccc(I)c1 Amb25712605 [0,2,0,0,0,0|2,0,0]=4 7135 B13R1.148 C[C@H](Cl)C(=O)Nc1cc(Cl)ccc1 Amb25785565 [0,2,0,0,0,0|2,0,0]=4 7136 B13R1.148 C[C@H](N)C(=O)Nc1cccc(I)c1 Amb24350240 [0,2,0,0,0,0|2,0,0]=4 7137 B13R1.148 C[C@H](N)C(=O)Nc1cccc(O)c1 Amb25085479 [0,2,0,0,0,0|2,0,0]=4 7138 B13R1.148 C[C@H](O)C(=O)Nc1cc(O)ccc1 Amb24474118 [0,2,0,0,0,0|2,0,0]=4 7139 B13R1.148 C[C@H](O)C(=O)Nc1cccc(Br)c1 Amb24721254 [0,2,0,0,0,0|2,0,0]=4 7140 B13R1.148 C[C@H](O)C(=O)Nc1cccc(Cl)c1 Amb24676341 [0,2,0,0,0,0|2,0,0]=4 7141 B13R1.148 C[C@H](O)C(=O)Nc1cccc(F)c1 Amb24577644 [0,2,0,0,0,0|2,0,0]=4 7142 B13R1.148 C[C@H](O)C(=O)Nc1cccc(I)c1 Amb25837599 [0,2,0,0,0,0|2,0,0]=4 7143 B13R1.148 C[C@H](O)C(=O)Oc1cccc(F)c1 Amb25847674 [0,2,0,0,0,0|2,0,0]=4 7144 B13R1.148 C[C@H](O)C(=O)Oc1cccc(I)c1 Amb24347608 [0,2,0,0,0,0|2,0,0]=4 7145 B13R1.148 Cc1cc(CC(=N)N(C)C)ccc1 Amb24464969 [0,2,0,0,0,0|2,0,0]=4 7146 B13R1.148 Cc1cc(CC(=O)C(C)=C)ccc1 Amb24489752 [0,2,0,0,0,0|1,0,0]=3 7147 B13R1.148 Cc1cc(CC(=O)C(C)N)ccc1 Amb24377295 [0,2,0,0,0,0|1,0,0]=3 7148 B13R1.148 Cc1cc(CC(=O)C(F)F)ccc1 Amb18326240 [0,2,0,0,0,0|2,0,0]=4 7149 B13R1.148 Cc1cc(ccc1)NC(=O)C(C)=C Amb25785229 [0,2,0,0,0,0|2,0,0]=4 7150 B13R1.148 Cc1cc(ccc1)NC(=O)C(C)N Amb21959009 [0,2,0,0,0,0|2,0,0]=4 7151 B13R1.148 Cc1cc(ccc1)NC(=O)C(C)S Amb25191424 [0,2,0,0,0,0|2,0,0]=4 7152 B13R1.148 Cc1cc(ccc1)NC(=O)[C@@H](C)N Amb18014667 [0,2,0,0,0,0|2,0,0]=4 7153 B13R1.148 Cc1cc(ccc1)NC(=O)[C@@H](C)O Amb25234661 [0,2,0,0,0,0|2,0,0]=4 7154 B13R1.148 Cc1cc(ccc1)OC(=O)C(C)Cl Amb25798881 [0,2,0,0,0,0|2,0,0]=4 7155 B13R1.148 Cc1cc(ccc1)OC(=O)[C@@H](C)O Amb25086184 [0,2,0,0,0,0|2,0,0]=4 7156 B13R1.148 Cc1cc(ccc1)OC(=O)[C@H](C)O Amb25032717 [0,2,0,0,0,0|2,0,0]=4 7157 B13R1.148 Cc1cccc(c1)CC(=O)C(=O)O Amb1131949 [0,2,0,0,0,0|2,0,0]=4 7158 B13R1.148 Cc1cccc(c1)CC(=O)N(C)C Amb2106657 [0,2,0,0,0,0|1,0,0]=3 7159 B13R1.148 Cc1cccc(c1)NC(=O)C(=O)C Amb17400599 [0,2,0,0,0,0|2,0,0]=4 7160 B13R1.148 Cc1cccc(c1)NC(=O)N(C)C Amb1233669 [0,2,0,0,0,0|2,0,0]=4 7161 B13R1.148 Clc1cccc(c1)CC(=O)C(=O)O Amb1135307 [0,2,0,0,0,0|2,0,0]=4 7162 B13R1.148 Clc1cccc(c1)NC(=O)C(=O)C Amb17402223 [0,2,0,0,0,0|2,0,0]=4 7163 B13R1.148 Clc1cccc(c1)NC(=O)N(C)C Amb1240562 [0,2,0,0,0,0|2,0,0]=4 7164 B13R1.148 Clc1cccc(c1)NC(=O)N(O)C Amb1789968 [0,2,0,0,0,0|2,0,0]=4 7165 B13R1.148 Fc1cccc(c1)CC(=O)C(=O)O Amb1126816 [0,2,0,0,0,0|2,0,0]=4 7166 B13R1.148 Fc1cccc(c1)CC(=O)N(C)C Amb15739660 [0,2,0,0,0,0|1,0,0]=3 7167 B13R1.148 Fc1cccc(c1)NC(=O)C(=O)C Amb17400857 [0,2,0,0,0,0|2,0,0]=4 7168 B13R1.148 O=C(C(Br)C)Nc1cccc(c1)C Amb10788590 [0,2,0,0,0,0|2,0,0]=4 7169 B13R1.148 O=C(C(Br)C)Nc1cccc(c1)F Amb17325716 [0,2,0,0,0,0|2,0,0]=4 7170 B13R1.148 O=C(C(Br)C)Nc1cccc(c1)O Amb17326361 [0,2,0,0,0,0|2,0,0]=4 7171 B13R1.148 O=C(C(C)C)Cc1cccc(c1)C Amb17138795 [0,2,0,0,0,0|1,0,0]=3 7172 B13R1.148 O=C(C(C)C)Cc1cccc(c1)Cl Amb17139626 [0,2,0,0,0,0|1,0,0]=3 7173 B13R1.148 O=C(C(C)C)Cc1cccc(c1)F Amb17138961 [0,2,0,0,0,0|1,0,0]=3 7174 B13R1.148 O=C(C(C)C)Nc1cccc(c1)N Amb1113918 [0,2,0,0,0,0|2,0,0]=4 7175 B13R1.148 O=C(C(C)C)Nc1cccc(c1)O Amb1933078 [0,2,0,0,0,0|2,0,0]=4 7176 B13R1.148 O=C(C(Cl)C)Nc1cccc(c1)C Amb1105698 [0,2,0,0,0,0|2,0,0]=4 7177 B13R1.148 O=C(C(Cl)C)Nc1cccc(c1)Cl Amb2260829 [0,2,0,0,0,0|2,0,0]=4 7178 B13R1.148 O=C(C(N)C)Oc1cccc(c1)Br Amb17349674 [0,2,0,0,0,0|2,0,0]=4 7179 B13R1.148 O=C(C(N)C)Oc1cccc(c1)C Amb17335313 [0,2,0,0,0,0|2,0,0]=4 7180 B13R1.148 O=C(C(N)C)Oc1cccc(c1)Cl Amb17337483 [0,2,0,0,0,0|2,0,0]=4 7181 B13R1.148 O=C(C(N)C)Oc1cccc(c1)F Amb17335602 [0,2,0,0,0,0|2,0,0]=4 7182 B13R1.148 O=C(C(O)C)Nc1cccc(c1)Br Amb17410950 [0,2,0,0,0,0|2,0,0]=4 7183 B13R1.148 O=C(C(O)C)Nc1cccc(c1)C Amb17400711 [0,2,0,0,0,0|2,0,0]=4 7184 B13R1.148 O=C(C(O)C)Nc1cccc(c1)Cl Amb17402321 [0,2,0,0,0,0|2,0,0]=4 7185 B13R1.148 O=C(C(O)C)Nc1cccc(c1)F Amb17400969 [0,2,0,0,0,0|2,0,0]=4 7186 B13R1.148 O=C(Cc1cc(F)ccc1)C(F)F Amb18324054 [0,2,0,0,0,0|2,0,0]=4 7187 B13R1.148 Oc1cc(CC(=O)C(F)F)ccc1 Amb25333794 [0,2,0,0,0,0|2,0,0]=4 7188 B13R1.148 Oc1cccc(c1)CC(=O)C(=O)O Amb1141341 [0,2,0,0,0,0|2,0,0]=4 7189 B13R1.148 Oc1cccc(c1)NC(=O)N(C)C Amb2572075 [0,2,0,0,0,0|2,0,0]=4 7190 B13R1.202 CC(=C)C(=O)Cc1c[n]ccc1N Amb24376845 [0,2,0,0,0,0|2,0,0]=4 7191 B13R1.202 CC(=C)C(=O)Cc1ccccc1Cl Amb25180911 [0,2,0,0,0,0|1,0,0]=3 7192 B13R1.202 CC(=C)C(=O)Nc1ccccc1O Amb18127847 [0,2,0,0,0,0|2,0,0]=4 7193 B13R1.202 CC(=C)C(=O)Oc1ccccc1Cl Amb25159245 [0,2,0,0,0,0|2,0,0]=4 7194 B13R1.202 CC(=C)C(=O)Oc1ccccc1F Amb25192592 [0,2,0,0,0,0|2,0,0]=4 7195 B13R1.202 CC(=C)C(=O)Oc1ccccc1I Amb24368864 [0,2,0,0,0,0|2,0,0]=4 7196 B13R1.202 CC(=C)C(=O)Oc1ccccc1O Amb18128071 [0,2,0,0,0,0|2,0,0]=4 7197 B13R1.202 CC(=O)C(=O)Cc1ccccc1C Amb25158383 [0,2,0,0,0,0|1,0,0]=3 7198 B13R1.202 CC(=O)C(=O)Cc1ccccc1F Amb23603624 [0,2,0,0,0,0|1,0,0]=3 7199 B13R1.202 CC(=O)C(=O)Nc1ccccc1Br Amb17410539 [0,2,0,0,0,0|2,0,0]=4 7200 B13R1.202 CC(=O)C(=O)Nc1ccccc1C Amb17400598 [0,2,0,0,0,0|2,0,0]=4 7201 B13R1.202 CC(=O)C(=O)Nc1ccccc1Cl Amb17402222 [0,2,0,0,0,0|2,0,0]=4 7202 B13R1.202 CC(=O)C(=O)Nc1ccccc1F Amb17400855 [0,2,0,0,0,0|2,0,0]=4 7203 B13R1.202 CC(Br)C(=O)Nc1ccccc1Br Amb25828722 [0,2,0,0,0,0|2,0,0]=4 7204 B13R1.202 CC(C)=C(C)Cc1ccccc1O Amb24492398 [0,2,0,0,0,0|2,0,0]=4 7205 B13R1.202 CC(C)C(=O)CN1C=CC=CC1=O Amb24343975 [0,2,0,0,0,0|2,0,0]=4 7206 B13R1.202 CC(C)C(=O)Cc1cc[n]cc1F Amb24361648 [0,2,0,0,0,0|2,0,0]=4 7207 B13R1.202 CC(C)C(=O)Cc1ccc[n]c1N Amb24453231 [0,2,0,0,0,0|2,0,0]=4 7208 B13R1.202 CC(C)C(=O)Cc1ccccc1Br Amb19374406 [0,2,0,0,0,0|1,0,0]=3 7209 B13R1.202 CC(C)C(=O)Cc1ccccc1O Amb18128196 [0,2,0,0,0,0|1,0,0]=3 7210 B13R1.202 CC(C)C(=O)Oc1ccccc1Br Amb25280146 [0,2,0,0,0,0|2,0,0]=4 7211 B13R1.202 CC(C)S(=O)Cc1ccccc1N Amb18974568 [0,2,0,0,0,0|2,0,0]=4 7212 B13R1.202 CC(Cl)C(=O)Oc1ccccc1Cl Amb24759143 [0,2,0,0,0,0|2,0,0]=4 7213 B13R1.202 CC(Cl)C(=O)Oc1ccccc1O Amb24682756 [0,2,0,0,0,0|2,0,0]=4 7214 B13R1.202 CC(I)C(=O)Nc1ccccc1Cl Amb23579964 [0,2,0,0,0,0|2,0,0]=4 7215 B13R1.202 CC(I)C(=O)Nc1ccccc1F Amb23579962 [0,2,0,0,0,0|2,0,0]=4 7216 B13R1.202 CC(N)C(=O)Cc1cc[n]cc1Cl Amb25369023 [0,2,0,0,0,0|2,0,0]=4 7217 B13R1.202 CC(N)C(=O)Cc1ccccc1Br Amb18156000 [0,2,0,0,0,0|1,0,0]=3 7218 B13R1.202 CC(N)C(=O)Cc1ccccc1Cl Amb18812029 [0,2,0,0,0,0|1,0,0]=3 7219 B13R1.202 CC(N)C(=O)Cc1ccccc1F Amb18193152 [0,2,0,0,0,0|1,0,0]=3 7220 B13R1.202 CC(N)C(=O)Nc1ccccc1O Amb25345469 [0,2,0,0,0,0|2,0,0]=4 7221 B13R1.202 CC(O)C(=O)Cc1[n]cccc1Br Amb24760982 [0,2,0,0,0,0|2,0,0]=4 7222 B13R1.202 CC(O)C(=O)Cc1c[n]ccc1N Amb25801552 [0,2,0,0,0,0|2,0,0]=4 7223 B13R1.202 CC(O)C(=O)Cc1cc[n]cc1Cl Amb25140619 [0,2,0,0,0,0|2,0,0]=4 7224 B13R1.202 CC(O)C(=O)Cc1ccc[n]c1N Amb25037173 [0,2,0,0,0,0|2,0,0]=4 7225 B13R1.202 CC(O)C(=O)Cc1ccccc1Cl Amb25180425 [0,2,0,0,0,0|1,0,0]=3 7226 B13R1.202 CC(O)C(=O)Cc1ccccc1F Amb24496472 [0,2,0,0,0,0|1,0,0]=3 7227 B13R1.202 CC(O)C(=O)Nc1ccccc1O Amb24455783 [0,2,0,0,0,0|2,0,0]=4 7228 B13R1.202 CC(O)C(=O)Oc1ccccc1Br Amb24703827 [0,2,0,0,0,0|2,0,0]=4 7229 B13R1.202 CC(O)C(=O)Oc1ccccc1I Amb25167397 [0,2,0,0,0,0|2,0,0]=4 7230 B13R1.202 CC(S)C(=O)Nc1ccccc1F Amb25781865 [0,2,0,0,0,0|2,0,0]=4 7231 B13R1.202 CN(C)C(=N)Cc1ccccc1Br Amb25744364 [0,2,0,0,0,0|2,0,0]=4 7232 B13R1.202 CN(C)C(=N)Cc1ccccc1F Amb24735283 [0,2,0,0,0,0|2,0,0]=4 7233 B13R1.202 CN(C)C(=O)CN1C=CC=CC1=O Amb25196595 [0,2,0,0,0,0|2,0,0]=4 7234 B13R1.202 CN(C)C(=O)Cc1ccccc1Br Amb22001119 [0,2,0,0,0,0|1,0,0]=3 7235 B13R1.202 CN(C)C(=O)Nc1ccccc1Cl Amb22466799 [0,2,0,0,0,0|2,0,0]=4 7236 B13R1.202 CN(C)C(=O)Nc1ccccc1I Amb25089033 [0,2,0,0,0,0|2,0,0]=4 7237 B13R1.202 CN(C)C(=O)Oc1ccccc1O Amb25319997 [0,2,0,0,0,0|2,0,0]=4 7238 B13R1.202 CN(C)C(=O)Sc1ccccc1N Amb19514714 [0,2,0,0,0,0|2,0,0]=4 7239 B13R1.202 CN(C)C(=O)Sc1ccccc1O Amb24494941 [0,2,0,0,0,0|2,0,0]=4 7240 B13R1.202 CN(N)C(=O)Nc1ccccc1Cl Amb22454414 [0,2,0,0,0,0|2,0,0]=4 7241 B13R1.202 CN(N)C(=O)Oc1ccccc1O Amb25768588 [0,2,0,0,0,0|2,0,0]=4 7242 B13R1.202 CN(O)C(=O)Cc1ccccc1Cl Amb22434674 [0,2,0,0,0,0|1,0,0]=3 7243 B13R1.202 C[C@@H](N)C(=O)Nc1ccccc1Br Amb18014735 [0,2,0,0,0,0|2,0,0]=4 7244 B13R1.202 C[C@@H](N)C(=O)Nc1ccccc1Cl Amb18014685 [0,2,0,0,0,0|2,0,0]=4 7245 B13R1.202 C[C@@H](N)C(=O)Nc1ccccc1F Amb18003111 [0,2,0,0,0,0|2,0,0]=4 7246 B13R1.202 C[C@@H](N)C(=O)Nc1ccccc1F Amb18796566 [0,2,0,0,0,0|2,0,0]=4 7247 B13R1.202 C[C@@H](N)C(=O)Nc1ccccc1I Amb24685590 [0,2,0,0,0,0|2,0,0]=4 7248 B13R1.202 C[C@@H](N)C(=O)Nc1ccccc1N Amb24718009 [0,2,0,0,0,0|2,0,0]=4 7249 B13R1.202 C[C@@H](N)C(=O)Nc1ccccc1O Amb25039327 [0,2,0,0,0,0|2,0,0]=4 7250 B13R1.202 C[C@@H](O)C(=O)Nc1ccccc1Cl Amb25818034 [0,2,0,0,0,0|2,0,0]=4 7251 B13R1.202 C[C@@H](O)C(=O)Nc1ccccc1I Amb25092525 [0,2,0,0,0,0|2,0,0]=4 7252 B13R1.202 C[C@@H](O)C(=O)Oc1ccccc1Br Amb25093332 [0,2,0,0,0,0|2,0,0]=4 7253 B13R1.202 C[C@@H](O)C(=O)Oc1ccccc1I Amb24347460 [0,2,0,0,0,0|2,0,0]=4 7254 B13R1.202 C[C@H](N)C(=O)Nc1ccccc1O Amb24465809 [0,2,0,0,0,0|2,0,0]=4 7255 B13R1.202 C[C@H](O)C(=O)Nc1ccccc1F Amb25749604 [0,2,0,0,0,0|2,0,0]=4 7256 B13R1.202 C[C@H](O)C(=O)Nc1ccccc1I Amb25797067 [0,2,0,0,0,0|2,0,0]=4 7257 B13R1.202 C[C@H](O)C(=O)Oc1ccccc1Cl Amb25032718 [0,2,0,0,0,0|2,0,0]=4 7258 B13R1.202 C[C@H](O)C(=O)Oc1ccccc1F Amb25145260 [0,2,0,0,0,0|2,0,0]=4 7259 B13R1.202 C[C@H](O)C(=O)Oc1ccccc1I Amb25829837 [0,2,0,0,0,0|2,0,0]=4 7260 B13R1.202 Cc1[n]cccc1CC(=O)N(C)C Amb25145262 [0,2,0,0,0,0|2,0,0]=4 7261 B13R1.202 Cc1c[n]ccc1CC(=O)N(C)C Amb25670454 [0,2,0,0,0,0|2,0,0]=4 7262 B13R1.202 Cc1ccc[n]c1CC(=O)C(C)C Amb25081208 [0,2,0,0,0,0|2,0,0]=4 7263 B13R1.202 Cc1ccccc1CC(=N)N(C)C Amb25854697 [0,2,0,0,0,0|2,0,0]=4 7264 B13R1.202 Cc1ccccc1CC(=O)C(C)O Amb25821919 [0,2,0,0,0,0|1,0,0]=3 7265 B13R1.202 Cc1ccccc1CC(=O)C(F)F Amb19057398 [0,2,0,0,0,0|2,0,0]=4 7266 B13R1.202 Cc1ccccc1NC(=O)C(C)=C Amb25123849 [0,2,0,0,0,0|2,0,0]=4 7267 B13R1.202 Cc1ccccc1NC(=O)C(C)N Amb21958992 [0,2,0,0,0,0|2,0,0]=4 7268 B13R1.202 Cc1ccccc1NC(=O)N(C)N Amb24536028 [0,2,0,0,0,0|2,0,0]=4 7269 B13R1.202 Cc1ccccc1NC(=O)[C@@H](C)N Amb18014656 [0,2,0,0,0,0|2,0,0]=4 7270 B13R1.202 Cc1ccccc1NC(=O)[C@@H](C)O Amb25145202 [0,2,0,0,0,0|2,0,0]=4 7271 B13R1.202 Cc1ccccc1OC(=O)C(C)Cl Amb25725086 [0,2,0,0,0,0|2,0,0]=4 7272 B13R1.202 O=C(C(Br)C)Nc1ccccc1C Amb10788589 [0,2,0,0,0,0|2,0,0]=4 7273 B13R1.202 O=C(C(Br)C)Nc1ccccc1O Amb17333158 [0,2,0,0,0,0|2,0,0]=4 7274 B13R1.202 O=C(C(C)C)Cc1ccccc1C Amb17138793 [0,2,0,0,0,0|1,0,0]=3 7275 B13R1.202 O=C(C(C)C)Cc1ccccc1Cl Amb17139624 [0,2,0,0,0,0|1,0,0]=3 7276 B13R1.202 O=C(C(C)C)Cc1ccccc1F Amb17138959 [0,2,0,0,0,0|1,0,0]=3 7277 B13R1.202 O=C(C(C)C)Nc1ccccc1N Amb1115072 [0,2,0,0,0,0|2,0,0]=4 7278 B13R1.202 O=C(C(Cl)C)Nc1ccccc1C Amb1651012 [0,2,0,0,0,0|2,0,0]=4 7279 B13R1.202 O=C(C(Cl)C)Nc1ccccc1Cl Amb1678049 [0,2,0,0,0,0|2,0,0]=4 7280 B13R1.202 O=C(C(Cl)C)Nc1ccccc1F Amb1645804 [0,2,0,0,0,0|2,0,0]=4 7281 B13R1.202 O=C(C(Cl)C)Nc1ccccc1O Amb17323230 [0,2,0,0,0,0|2,0,0]=4 7282 B13R1.202 O=C(C(N)C)Oc1ccccc1Br Amb17349672 [0,2,0,0,0,0|2,0,0]=4 7283 B13R1.202 O=C(C(N)C)Oc1ccccc1C Amb17335311 [0,2,0,0,0,0|2,0,0]=4 7284 B13R1.202 O=C(C(N)C)Oc1ccccc1Cl Amb17337481 [0,2,0,0,0,0|2,0,0]=4 7285 B13R1.202 O=C(C(N)C)Oc1ccccc1F Amb17335600 [0,2,0,0,0,0|2,0,0]=4 7286 B13R1.202 O=C(C(O)C)Nc1ccccc1Br Amb17410949 [0,2,0,0,0,0|2,0,0]=4 7287 B13R1.202 O=C(C(O)C)Nc1ccccc1C Amb17400710 [0,2,0,0,0,0|2,0,0]=4 7288 B13R1.202 O=C(C(O)C)Nc1ccccc1Cl Amb17402320 [0,2,0,0,0,0|2,0,0]=4 7289 B13R1.202 O=C(C(O)C)Nc1ccccc1F Amb17400967 [0,2,0,0,0,0|2,0,0]=4 7290 B13R1.202 O=C(Cc1ccccc1Br)C(F)F Amb24342540 [0,2,0,0,0,0|2,0,0]=4 7291 B13R1.202 O=C(Cc1ccccc1Cl)C(F)F Amb25068603 [0,2,0,0,0,0|2,0,0]=4 7292 B13R1.202 O=C(Cc1ccccc1F)C(F)F Amb18324055 [0,2,0,0,0,0|2,0,0]=4 7293 B13R1.202 O=C(N(C)C)Cc1ccccc1C Amb2106656 [0,2,0,0,0,0|1,0,0]=3 7294 B13R1.202 O=C(N(C)C)Cc1ccccc1Cl Amb15739661 [0,2,0,0,0,0|1,0,0]=3 7295 B13R1.202 O=C(N(C)C)Cc1ccccc1N Amb1137686 [0,2,0,0,0,0|1,0,0]=3 7296 B13R1.202 O=C(N(O)C)Nc1ccccc1F Amb2422572 [0,2,0,0,0,0|2,0,0]=4 7297 B13R1.202 OC(=O)C(=O)Cc1ccccc1C Amb1125804 [0,2,0,0,0,0|2,0,0]=4 7298 B13R1.202 OC(=O)C(=O)Cc1ccccc1Cl Amb1135873 [0,2,0,0,0,0|2,0,0]=4 7299 B13R1.353 CC(C)(C)C(=O)Cc1cc[n]cc1 Amb18186096 [0,2,0,0,0,0|2,0,0]=4 7300 B13R1.353 CC(C)(C)C(=O)Cc1ccc[n]c1 Amb18186094 [0,2,0,0,0,0|2,0,0]=4 7301 B13R1.353 CC(C)(F)C(=O)Cc1ccc[n]c1 Amb24632702 [0,2,0,0,0,0|2,0,0]=4 7302 B13R1.353 CC(C)(F)C(=O)Cc1ccccc1 Amb25303744 [0,2,0,0,0,0|1,0,0]=3 7303 B13R1.353 CC(C)(N)C(=O)Cc1ccc[n]c1 Amb18195250 [0,2,0,0,0,0|2,0,0]=4 7304 B13R1.353 CC(C)(N)C(=O)Cc1cccc[n]1 Amb24629610 [0,2,0,0,0,0|2,0,0]=4 7305 B13R1.353 CC(C)(N)C(=O)Cc1ccccc1 Amb18195906 [0,2,0,0,0,0|1,0,0]=3 7306 B13R1.353 CC(C)(N)C(=O)Nc1ccccc1 Amb21958886 [0,2,0,0,0,0|2,0,0]=4 7307 B13R1.353 CC(C)(O)C(=O)Cc1cc[n]cc1 Amb25761787 [0,2,0,0,0,0|2,0,0]=4 7308 B13R1.353 CC(C)(O)C(=O)Cc1ccc[n]c1 Amb24496208 [0,2,0,0,0,0|2,0,0]=4 7309 B13R1.353 CC(Cl)(Cl)C(=O)Nc1ccccc1 Amb25790575 [0,2,0,0,0,0|2,0,0]=4 7310 B13R1.353 CC(Cl)(Cl)C(=O)Oc1ccccc1 Amb25284091 [0,2,0,0,0,0|2,0,0]=4 7311 B13R1.353 CC(F)(F)C(=O)Cc1ccc[n]c1 Amb24604247 [0,2,0,0,0,0|2,0,0]=4 7312 B13R1.353 CC(F)(F)C(=O)Cc1ccccc1 Amb24715115 [0,2,0,0,0,0|1,0,0]=3 7313 B13R1.353 CC(F)(F)C(=O)Nc1ccccc1 Amb24753965 [0,2,0,0,0,0|2,0,0]=4 7314 B13R1.353 CC(O)(O)C(=O)Nc1ccccc1 Amb24490411 [0,2,0,0,0,0|2,0,0]=4 7315 B13R1.353 O=C(C(Br)(C)C)Nc1ccccc1 Amb17323634 [0,2,0,0,0,0|2,0,0]=4 7316 B13R1.353 O=C(C(N)(C)C)Nc1ccccc1 Amb17078366 [0,2,0,0,0,0|2,0,0]=4 7317 B13R1.353 O=C(C(O)(C)C)Cc1ccccc1 Amb10562690 [0,2,0,0,0,0|1,0,0]=3 7318 B13R1.353 O=C(C(O)(C)C)Nc1ccccc1 Amb10566125 [0,2,0,0,0,0|2,0,0]=4 7319 B13R1.353 O=C(Cc1ccccc1)C(F)(F)Br Amb25725768 [0,2,0,0,0,0|2,0,0]=4 7320 B13R1.353 O=C(Cc1ccccc1)[B-](F)(F)F Amb25665052 [0,2,0,0,0,0|2,0,0]=4 7321 B13R1.353 O=C([Si](C)(C)C)Cc1ccccc1 Amb10564106 [0,2,0,0,0,0|1,0,0]=3 7322 B13R1.418 CC(=O)C(=[N+]=[N-])Cc1ccccc1 Amb17594403 [0,2,0,0,0,0|2,0,0]=4 7323 B13R1.418 CC(=O)C(Cc1ccccc1)=CN Amb17777847 [0,2,0,0,0,0|2,0,0]=4 7324 B13R1.418 CC(=O)N(Oc1ccccc1)OC Amb24096701 [0,2,0,0,0,0|2,0,0]=4 7325 B13R1.418 CC(=O)\C(=C/C)\Oc1ccccc1 Amb25179538 [0,2,0,0,0,0|2,0,0]=4 7326 B13R1.418 CC(=O)\C(=C/c1ccccc1)\OC Amb24588864 [0,2,0,0,0,0|0,0,1]=3 7327 B13R1.418 CC(=O)\C(=C\C)\Nc1ccccc1 Amb24653578 [0,2,0,0,0,0|2,0,0]=4 7328 B13R1.418 CC(=O)\C(\CC)=C/c1ccccc1 Amb25034468 [0,2,0,0,0,0|1,0,1]=4 7329 B13R1.418 CC(=O)\C(\CC)=C\c1ccccc1 Amb25285770 [0,2,0,0,0,0|1,0,1]=4 7330 B13R1.418 CC(=O)\C(\CC)=N/c1ccccc1 Amb24614688 [0,2,0,0,0,0|2,0,0]=4 7331 B13R1.418 CC(=O)\C(\CC)=N\c1ccccc1 Amb24559130 [0,2,0,0,0,0|2,0,0]=4 7332 B13R1.418 CC(=O)\C(\Cc1ccccc1)=C/[O-] Amb21947890 [0,2,0,0,0,0|1,0,1]=4 7333 B13R1.418 CC(=O)\C(\Cc1ccccc1)=C/[O-] Amb21947891 [0,2,0,0,0,0|1,0,1]=4 7334 B13R1.418 CC(=O)\C(\Cc1ccccc1)=C\C Amb24364205 [0,2,0,0,0,0|1,0,0]=3 7335 B13R1.418 CC(=O)\C(\Cc1ccccc1)=C\N Amb25273959 [0,2,0,0,0,0|2,0,0]=4 7336 B13R1.418 CC(=O)\C(\Cc1ccccc1)=C\O Amb24752497 [0,2,0,0,0,0|1,0,1]=4 7337 B13R1.418 CC(=O)\C(\Cc1ccccc1)=N\O Amb24620100 [0,2,0,0,0,0|1,0,1]=4 7338 B13R1.418 CC(C)=C(C=O)Sc1ccccc1 Amb18651322 [0,2,0,0,0,0|2,0,0]=4 7339 B13R1.418 CC(C)=C(Cc1ccccc1)C=O Amb24419788 [0,2,0,0,0,0|1,0,0]=3 7340 B13R1.418 CC(C)\C(\C=O)=C\c1ccccc1 Amb24688469 [0,2,0,0,0,0|1,0,1]=4 7341 B13R1.418 CC(O)C(Cc1ccccc1)=C=C Amb24495404 [0,2,0,0,0,0|2,0,0]=4 7342 B13R1.418 CC(O)\C(\C=O)=C/c1ccccc1 Amb25767847 [0,2,0,0,0,0|1,0,1]=4 7343 B13R1.418 CC(O)\C(\C=O)=C\c1ccccc1 Amb25264847 [0,2,0,0,0,0|1,0,1]=4 7344 B13R1.418 CCC(C(=O)C)Cc1ccccc1 Amb17233201 [0,2,0,0,0,0|1,0,1]=4 7345 B13R1.418 CCN(C(=O)Cl)Cc1ccccc1 Amb17563084 [0,2,0,0,0,0|2,0,0]=4 7346 B13R1.418 CC\C(=C/c1ccccc1)\C(N)=O Amb24634133 [0,2,0,0,0,0|1,0,1]=4 7347 B13R1.418 CC\C(=C\c1ccccc1)\C(O)=O Amb24702993 [0,2,0,0,0,0|1,0,1]=4 7348 B13R1.418 CC\C(=C\c1ccccc1)\[N+]([O-])=O Amb25099680 [0,2,0,0,0,0|1,0,1]=4 7349 B13R1.418 CN(C)\C(\C=O)=C/c1ccccc1 Amb18127488 [0,2,0,0,0,0|1,0,1]=4 7350 B13R1.418 CN(C)\C(\C=O)=C\c1ccccc1 Amb24512909 [0,2,0,0,0,0|1,0,1]=4 7351 B13R1.418 CN[C@@H](C(=O)O)Cc1ccccc1 Amb16183857 [0,2,0,0,0,0|1,0,1]=4 7352 B13R1.418 CN[C@@H](Cc1ccccc1)C(O)=O Amb22744994 [0,2,0,0,0,0|1,0,1]=4 7353 B13R1.418 CN[C@H](C(=O)O)Cc1ccccc1 Amb10604038 [0,2,0,0,0,0|1,0,1]=4 7354 B13R1.418 COC(Cc1ccccc1)C(O)=O Amb18128650 [0,2,0,0,0,0|0,0,1]=3 7355 B13R1.418 CON(Cc1ccccc1)C(=O)Cl Amb24564167 [0,2,0,0,0,0|1,0,0]=3 7356 B13R1.418 CON(Cc1ccccc1)C(N)=O Amb24529724 [0,2,0,0,0,0|1,0,0]=3 7357 B13R1.418 CO[C@@H](Cc1ccccc1)C(O)=O Amb22747352 [0,2,0,0,0,0|0,0,1]=3 7358 B13R1.418 CO\C(=C/c1ccccc1)\C(=O)O Amb1945718 [0,2,0,0,0,0|0,0,1]=3 7359 B13R1.418 CS\C(=C\c1ccccc1)\C(O)=O Amb18130097 [0,2,0,0,0,0|0,1,1]=4 7360 B13R1.418 C[C@H](O)C(Cc1ccccc1)=C=C Amb25236568 [0,2,0,0,0,0|2,0,0]=4 7361 B13R1.418 C\C(\Cl)=C(\Cc1ccccc1)/C=O Amb25759081 [0,2,0,0,0,0|1,0,0]=3 7362 B13R1.418 C\C(\N)=C(\Cc1ccccc1)/C#N Amb25264958 [0,2,0,0,0,0|2,0,0]=4 7363 B13R1.418 C\C=C(/Sc1ccccc1)\C(O)=O Amb18651957 [0,2,0,0,0,0|2,0,0]=4 7364 B13R1.418 C\C=C(\Cc1ccccc1)/C(N)=O Amb25268913 [0,2,0,0,0,0|1,0,0]=3 7365 B13R1.418 C\C=C(\Cc1ccccc1)/C(O)=O Amb24711241 [0,2,0,0,0,0|1,0,0]=3 7366 B13R1.418 C\C=C(\Cc1ccccc1)/[N+]([O-])=O Amb25198565 [0,2,0,0,0,0|1,0,0]=3 7367 B13R1.418 NC(=O)\C(\Cc1ccccc1)=C\Cl Amb25300288 [0,2,0,0,0,0|2,0,0]=4 7368 B13R1.418 NO[C@@H](C(=O)O)Cc1ccccc1 Amb10070584 [0,2,0,0,0,0|1,0,1]=4 7369 B13R1.418 NO[C@H](C(=O)O)Cc1ccccc1 Amb10070583 [0,2,0,0,0,0|1,0,1]=4 7370 B13R1.418 O=C\C(=C\c1ccccc1)\C(C)C Amb17334988 [0,2,0,0,0,0|1,0,1]=4 7371 B13R1.418 [NH3+]OC(Cc1ccccc1)C(O)=O Amb22471708 [0,2,0,0,0,0|1,0,1]=4 7372 B13R1.5 BrCc1ccc(cc1)CC(=O)OC Amb10071259 [0,2,0,0,0,0|0,0,0]=2 7373 B13R1.5 CCC(=O)Cc1ccc(cc1)C#N Amb24737376 [0,2,0,0,0,0|1,0,0]=3 7374 B13R1.5 CCC(=O)Cc1ccc(cc1)OC Amb17138854 [0,2,0,0,0,0|1,0,0]=3 7375 B13R1.5 CCC(=O)Nc1ccc(CBr)cc1 Amb25332871 [0,2,0,0,0,0|2,0,0]=4 7376 B13R1.5 CCC(=O)Nc1ccc(CCl)cc1 Amb25130120 [0,2,0,0,0,0|2,0,0]=4 7377 B13R1.5 CCC(=O)Nc1ccc(cc1)C#C Amb25064758 [0,2,0,0,0,0|2,0,0]=4 7378 B13R1.5 CCC(=O)Nc1ccc(cc1)CN Amb1113129 [0,2,0,0,0,0|2,0,0]=4 7379 B13R1.5 CCC(=O)Oc1ccc(CCl)cc1 Amb20667898 [0,2,0,0,0,0|2,0,0]=4 7380 B13R1.5 CCC(=O)Oc1ccc(CO)cc1 Amb24102996 [0,2,0,0,0,0|2,0,0]=4 7381 B13R1.5 CCC(=O)Oc1ccc(cc1)C#N Amb18127399 [0,2,0,0,0,0|2,0,0]=4 7382 B13R1.5 CCC(=O)Oc1ccc(cc1)C=C Amb16231186 [0,2,0,0,0,0|2,0,0]=4 7383 B13R1.5 CCS(=O)Cc1ccc(cc1)C#N Amb24520815 [0,2,0,0,0,0|2,0,0]=4 7384 B13R1.5 CCc1ccc(CC(=N)OC)cc1 Amb18065704 [0,2,0,0,0,0|1,0,0]=3 7385 B13R1.5 CCc1ccc(CC(=O)CO)cc1 Amb18564079 [0,2,0,0,0,0|2,0,0]=4 7386 B13R1.5 CCc1ccc(CC(=O)NC)cc1 Amb19557312 [0,2,0,0,0,0|1,0,0]=3 7387 B13R1.5 CCc1ccc(CC(=O)NO)cc1 Amb24335102 [0,2,0,0,0,0|2,0,0]=4 7388 B13R1.5 CCc1ccc(cc1)CC(=O)NN Amb1921794 [0,2,0,0,0,0|2,0,0]=4 7389 B13R1.5 CCc1ccc(cc1)OC(=O)NC Amb25725883 [0,2,0,0,0,0|2,0,0]=4 7390 B13R1.5 CN(Cc1ccc(cc1)C#N)OC Amb24660691 [0,2,0,0,0,0|2,0,0]=4 7391 B13R1.5 CNC(=O)Cc1ccc(cc1)C#N Amb22584211 [0,2,0,0,0,0|1,0,0]=3 7392 B13R1.5 CNC(=O)Cc1ccc(cc1)NC Amb18303213 [0,2,0,0,0,0|1,0,0]=3 7393 B13R1.5 CNC(=O)Cc1ccc(cc1)SC Amb25344417 [0,2,0,0,0,0|1,0,0]=3 7394 B13R1.5 CNC(=O)Nc1ccc(CC)cc1 Amb24664056 [0,2,0,0,0,0|2,0,0]=4 7395 B13R1.5 CNC(=O)Nc1ccc(CCl)cc1 Amb24400673 [0,2,0,0,0,0|2,0,0]=4 7396 B13R1.5 CNC(=O)Nc1ccc(cc1)NC Amb18967644 [0,2,0,0,0,0|2,0,0]=4 7397 B13R1.5 CNC(=O)Oc1ccc(CCl)cc1 Amb24443098 [0,2,0,0,0,0|2,0,0]=4 7398 B13R1.5 CNC(=O)Oc1ccc(cc1)C#N Amb25075570 [0,2,0,0,0,0|2,0,0]=4 7399 B13R1.5 CNC(=O)Oc1ccc(cc1)C=O Amb25326082 [0,2,0,0,0,0|2,0,0]=4 7400 B13R1.5 CNc1ccc(CC(=O)OC)cc1 Amb25211326 [0,2,0,0,0,0|0,0,0]=2 7401 B13R1.5 CNc1ccc(c[n]1)NC(=O)OC Amb25713943 [0,2,0,0,0,0|2,0,0]=4 7402 B13R1.5 CNc1ccc(cc1)NC(=O)CC Amb19002863 [0,2,0,0,0,0|2,0,0]=4 7403 B13R1.5 CNc1ccc(cc1)NC(=O)OC Amb18303227 [0,2,0,0,0,0|1,0,0]=3 7404 B13R1.5 COC(=C)Nc1ccc(cc1)OC Amb24409699 [0,2,0,0,0,0|2,0,0]=4 7405 B13R1.5 COC(=O)Cc1[n]cc(c[n]1)C#N Amb25034224 [0,2,0,0,0,0|2,0,0]=4 7406 B13R1.5 COC(=O)Cc1ccc([n][n]1)OC Amb23586411 [0,2,0,0,0,0|2,0,0]=4 7407 B13R1.5 COC(=O)Cc1ccc(cc1)C=O Amb22002624 [0,2,0,0,0,0|0,0,0]=2 7408 B13R1.5 COC(=O)Cc1ccc(cc1)NN Amb24613154 [0,2,0,0,0,0|0,0,0]=2 7409 B13R1.5 COC(=O)Cc1ccc(cc1)SC Amb18942911 [0,2,0,0,0,0|0,0,0]=2 7410 B13R1.5 COC(=O)Nc1c[n]c(cc1)SC Amb25144253 [0,2,0,0,0,0|2,0,0]=4 7411 B13R1.5 COC(=O)Nc1ccc(C=C)c[n]1 Amb24096213 [0,2,0,0,0,0|2,0,0]=4 7412 B13R1.5 COC(=O)Nc1ccc(CN)c[n]1 Amb18989109 [0,2,0,0,0,0|2,0,0]=4 7413 B13R1.5 COC(=O)Nc1ccc(CO)cc1 Amb22295889 [0,2,0,0,0,0|1,0,0]=3 7414 B13R1.5 COC(=O)Nc1ccc(c[n]1)C#N Amb18184128 [0,2,0,0,0,0|2,0,0]=4 7415 B13R1.5 COC(=O)Nc1ccc(c[n]1)OC Amb24631038 [0,2,0,0,0,0|2,0,0]=4 7416 B13R1.5 COC(=O)Nc1ccc(c[n]1)SC Amb25668576 [0,2,0,0,0,0|2,0,0]=4 7417 B13R1.5 COC(=O)Nc1ccc(cc1)C=O Amb18648222 [0,2,0,0,0,0|1,0,0]=3 7418 B13R1.5 COC(=O)Nc1ccc(cc1)N=O Amb24095879 [0,2,0,0,0,0|1,0,0]=3 7419 B13R1.5 COC(=O)Nc1ccc(cc1)SC Amb22476342 [0,2,0,0,0,0|1,0,0]=3 7420 B13R1.5 COC(=O)Oc1ccc(cc1)C#N Amb16498350 [0,2,0,0,0,0|1,0,0]=3 7421 B13R1.5 COc1ccc(CC(=O)CO)cc1 Amb18065902 [0,2,0,0,0,0|2,0,0]=4 7422 B13R1.5 COc1ccc(cc1)OC(=O)NC Amb25290168 [0,2,0,0,0,0|2,0,0]=4 7423 B13R1.5 CSC(=O)Nc1ccc(cc1)SC Amb25799035 [0,2,0,0,0,0|1,1,0]=4 7424 B13R1.5 CSc1ccc(CC(=O)NN)cc1 Amb24643948 [0,2,0,0,0,0|2,0,0]=4 7425 B13R1.5 CSc1ccc(cc1)SC(=O)NC Amb25738060 [0,2,0,0,0,0|2,0,0]=4 7426 B13R1.5 N#Cc1ccc(CC(=O)CCl)cc1 Amb18130052 [0,2,0,0,0,0|2,0,0]=4 7427 B13R1.5 N#Cc1ccc(CC(=O)CO)cc1 Amb18127395 [0,2,0,0,0,0|2,0,0]=4 7428 B13R1.145 CC\C(=C/c1ccc(cc1)Br)\C=O Amb17347962 [0,2,0,0,0,0|1,0,1]=4 7429 B13R1.145 CC\C(=C/c1ccc(cc1)C)\C=O Amb17334991 [0,2,0,0,0,0|1,0,1]=4 7430 B13R1.145 CC\C(=C/c1ccc(cc1)Cl)\C=O Amb17336899 [0,2,0,0,0,0|1,0,1]=4 7431 B13R1.145 CC\C(=C/c1ccc(cc1)F)\C=O Amb17335220 [0,2,0,0,0,0|1,0,1]=4 7432 B13R1.145 CC\C(=C/c1ccc(cc1)O)\C=O Amb17335120 [0,2,0,0,0,0|1,0,1]=4 7433 B13R1.145 CC\C(\C=O)=C\c1ccc(Cl)cc1 Amb24489765 [0,2,0,0,0,0|1,0,1]=4 7434 B13R1.145 CN\C(\Cc1ccc(Br)cc1)=N\N Amb24609284 [0,2,0,0,0,0|2,0,0]=4 7435 B13R1.145 CN\C(\Cc1ccc(Cl)cc1)=N/N Amb18318338 [0,2,0,0,0,0|2,0,0]=4 7436 B13R1.145 CN\C(\Cc1ccc(F)cc1)=N/N Amb18791232 [0,2,0,0,0,0|2,0,0]=4 7437 B13R1.145 COC(Cc1ccc(F)cc1)OC Amb19330385 [0,2,0,0,0,0|0,0,2]=4 7438 B13R1.145 COC(Cc1ccc(N)cc1)OC Amb21963825 [0,2,0,0,0,0|0,0,2]=4 7439 B13R1.145 Cc1ccc(CC(OC)OC)cc1 Amb24066883 [0,2,0,0,0,0|0,0,2]=4 7440 B13R1.145 Cc1ccc(C\C(\CC)=N/N)cc1 Amb24672341 [0,2,0,0,0,0|2,0,0]=4 7441 B13R1.145 Cc1ccc(C\C(\NC)=N/C)cc1 Amb24728214 [0,2,0,0,0,0|2,0,0]=4 7442 B13R1.145 Cc1ccc(C\C(\NC)=N\N)cc1 Amb18790851 [0,2,0,0,0,0|2,0,0]=4 7443 B13R1.145 Cc1ccc(\C=C(\CC)/C=O)cc1 Amb25835920 [0,2,0,0,0,0|1,0,1]=4 7444 B13R1.249 CCS(=O)(=O)Cc1ccc(Br)cc1 Amb23443747 [0,2,0,0,0,0|2,0,0]=4 7445 B13R1.249 CCS(=O)(=O)Cc1ccc(F)cc1 Amb25763605 [0,2,0,0,0,0|2,0,0]=4 7446 B13R1.249 CCS(=O)(=O)Cc1ccc(O)cc1 Amb25086097 [0,2,0,0,0,0|2,0,0]=4 7447 B13R1.249 CNS(=O)(=O)Cc1ccc(I)cc1 Amb25255614 [0,2,0,0,0,0|2,0,0]=4 7448 B13R1.249 COP(O)(=O)Cc1ccc(O)cc1 Amb25282783 [0,2,0,0,0,0|1,0,0]=3 7449 B13R1.249 COP(O)(=O)Nc1ccc(N)cc1 Amb24490239 [0,2,0,0,0,0|2,0,0]=4 7450 B13R1.249 COP(O)(=O)Oc1ccc(N)cc1 Amb25733082 [0,2,0,0,0,0|2,0,0]=4 7451 B13R1.249 COS(=O)(=O)Cc1ccc(F)cc1 Amb24335185 [0,2,0,0,0,0|1,0,0]=3 7452 B13R1.249 CP(=O)(Nc1ccc(N)cc1)OC Amb24658330 [0,2,0,0,0,0|2,0,0]=4 7453 B13R1.249 Cc1ccc(CS(=O)(=O)CC)cc1 Amb25245015 [0,2,0,0,0,0|2,0,0]=4 7454 B13R1.249 Cc1ccc(CS(=O)(=O)NC)cc1 Amb22301446 [0,2,0,0,0,0|2,0,0]=4 7455 B13R1.2679 C#CC(=O)Cc1ccc(Cl)cc1Cl Amb24393138 [0,2,0,0,0,0|1,0,1]=4 7456 B13R1.2679 C=CC(=O)Cc1ccc(Br)cc1Cl Amb24438928 [0,2,0,0,0,0|1,0,1]=4 7457 B13R1.2679 C=CC(=O)Cc1ccc(Cl)cc1F Amb25307724 [0,2,0,0,0,0|1,0,1]=4 7458 B13R1.2679 C=CC(=O)Cc1ccc(F)cc1Br Amb24496274 [0,2,0,0,0,0|1,0,1]=4 7459 B13R1.2679 C=CC(=O)Cc1ccc(F)cc1Cl Amb25155187 [0,2,0,0,0,0|1,0,1]=4 7460 B13R1.2679 CC1=CC(=O)N(CC(=O)OC)C=N1 Amb18791374 [0,2,0,0,0,0|2,0,0]=4 7461 B13R1.2679 CC=1C=CN(CC(=O)CC)C(=O)C1 Amb18178669 [0,2,0,0,0,0|2,0,0]=4 7462 B13R1.2679 CC=1C=CN(CC(=O)NC)C(=O)C1 Amb19126955 [0,2,0,0,0,0|2,0,0]=4 7463 B13R1.2679 CC=1C=CN(CC(=O)OC)C(=O)C1 Amb18178981 [0,2,0,0,0,0|1,0,0]=3 7464 B13R1.2679 CCC(=O)Cc1ccc(Br)cc1Cl Amb25126378 [0,2,0,0,0,0|1,0,0]=3 7465 B13R1.2679 CCC(=O)Cc1ccc(C)cc1C Amb24492780 [0,2,0,0,0,0|1,0,0]=3 7466 B13R1.2679 CCC(=O)Cc1ccc(Cl)cc1F Amb24555297 [0,2,0,0,0,0|1,0,0]=3 7467 B13R1.2679 CCC(=O)Cc1ccc(F)cc1Br Amb25326941 [0,2,0,0,0,0|1,0,0]=3 7468 B13R1.2679 CCC(=O)Cc1ccc(F)cc1Cl Amb19087646 [0,2,0,0,0,0|1,0,0]=3 7469 B13R1.2679 CCC(=O)Cc1ccc(F)cc1F Amb18328431 [0,2,0,0,0,0|1,0,0]=3 7470 B13R1.2679 CCC(=O)Cc1ccc(cc1Cl)Cl Amb17141003 [0,2,0,0,0,0|1,0,0]=3 7471 B13R1.2679 CCC(=O)Nc1ccc(Br)cc1Cl Amb25214498 [0,2,0,0,0,0|2,0,0]=4 7472 B13R1.2679 CCC(=O)Nc1ccc(Br)cc1O Amb24502783 [0,2,0,0,0,0|2,0,0]=4 7473 B13R1.2679 CCC(=O)Nc1ccc(Cl)cc1Br Amb24489285 [0,2,0,0,0,0|2,0,0]=4 7474 B13R1.2679 CCC(=O)Nc1ccc(Cl)cc1I Amb24734570 [0,2,0,0,0,0|2,0,0]=4 7475 B13R1.2679 CCC(=O)Nc1ccc(F)cc1O Amb24350165 [0,2,0,0,0,0|2,0,0]=4 7476 B13R1.2679 CCC(=O)Nc1ccc(N)cc1O Amb25725571 [0,2,0,0,0,0|2,0,0]=4 7477 B13R1.2679 CCC(=O)Nc1ccc(O)cc1F Amb25039611 [0,2,0,0,0,0|2,0,0]=4 7478 B13R1.2679 CCC(=O)Nc1ccc(cc1C)Br Amb1844022 [0,2,0,0,0,0|2,0,0]=4 7479 B13R1.2679 CCC(=O)Nc1ccc(cc1C)C Amb1254030 [0,2,0,0,0,0|2,0,0]=4 7480 B13R1.2679 CCC(=O)Nc1ccc(cc1C)F Amb2021222 [0,2,0,0,0,0|2,0,0]=4 7481 B13R1.2679 CCC(=O)Nc1ccc(cc1C)I Amb2552102 [0,2,0,0,0,0|2,0,0]=4 7482 B13R1.2679 CCC(=O)Nc1ccc(cc1C)N Amb10187479 [0,2,0,0,0,0|2,0,0]=4 7483 B13R1.2679 CCC(=O)Nc1ccc(cc1C)N Amb1121196 [0,2,0,0,0,0|2,0,0]=4 7484 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)F Amb197181 [0,2,0,0,0,0|2,0,0]=4 7485 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)N Amb1120268 [0,2,0,0,0,0|2,0,0]=4 7486 B13R1.2679 CCC(=O)Nc1ccc(cc1N)Cl Amb1118780 [0,2,0,0,0,0|2,0,0]=4 7487 B13R1.2679 CCC(=O)Nc1ccc(cc1N)F Amb1112808 [0,2,0,0,0,0|2,0,0]=4 7488 B13R1.2679 CCC(=O)Oc1ccc(Br)cc1Br Amb25846063 [0,2,0,0,0,0|2,0,0]=4 7489 B13R1.2679 CCC(=O)Oc1ccc(Br)cc1Cl Amb25344687 [0,2,0,0,0,0|2,0,0]=4 7490 B13R1.2679 CCC(=O)Oc1ccc(Br)cc1F Amb25345802 [0,2,0,0,0,0|2,0,0]=4 7491 B13R1.2679 CCC(=O)Oc1ccc(Cl)cc1Br Amb24502785 [0,2,0,0,0,0|2,0,0]=4 7492 B13R1.2679 CCC(=O)Oc1ccc(F)cc1Cl Amb25317168 [0,2,0,0,0,0|2,0,0]=4 7493 B13R1.2679 CCC(=O)Oc1ccc(O)cc1Cl Amb24492503 [0,2,0,0,0,0|2,0,0]=4 7494 B13R1.2679 CCC(=O)Oc1ccc(cc1C)Cl Amb2555275 [0,2,0,0,0,0|2,0,0]=4 7495 B13R1.2679 CCS(=O)Cc1ccc(Br)cc1N Amb24491761 [0,2,0,0,0,0|2,0,0]=4 7496 B13R1.2679 CCS(=O)Cc1ccc(Cl)cc1N Amb18986288 [0,2,0,0,0,0|2,0,0]=4 7497 B13R1.2679 CCS(=O)Cc1ccc(F)cc1F Amb24721320 [0,2,0,0,0,0|2,0,0]=4 7498 B13R1.2679 CCS(=O)Cc1ccc(F)cc1N Amb25840767 [0,2,0,0,0,0|2,0,0]=4 7499 B13R1.2679 CCS(=O)Cc1ccc(N)cc1Cl Amb18984608 [0,2,0,0,0,0|2,0,0]=4 7500 B13R1.2679 CN(Cc1ccc(Br)cc1Cl)OC Amb25221249 [0,2,0,0,0,0|2,0,0]=4 7501 B13R1.2679 CN(Cc1ccc(Br)cc1N)OC Amb24748695 [0,2,0,0,0,0|2,0,0]=4 7502 B13R1.2679 CN(Cc1ccc(Cl)cc1Br)OC Amb25856250 [0,2,0,0,0,0|2,0,0]=4 7503 B13R1.2679 CN(Cc1ccc(Cl)cc1F)OC Amb25345809 [0,2,0,0,0,0|2,0,0]=4 7504 B13R1.2679 CN(Cc1ccc(Cl)cc1N)OC Amb18986284 [0,2,0,0,0,0|2,0,0]=4 7505 B13R1.2679 CN(Cc1ccc(F)cc1Cl)OC Amb25796225 [0,2,0,0,0,0|2,0,0]=4 7506 B13R1.2679 CN(Cc1ccc(I)cc1Cl)OC Amb24404515 [0,2,0,0,0,0|2,0,0]=4 7507 B13R1.2679 CN(Cc1ccc(N)cc1Br)OC Amb18288992 [0,2,0,0,0,0|2,0,0]=4 7508 B13R1.2679 CN(Cc1ccc(N)cc1Cl)OC Amb18294625 [0,2,0,0,0,0|2,0,0]=4 7509 B13R1.2679 CNC(=N)Cc1ccc(F)cc1F Amb24466595 [0,2,0,0,0,0|2,0,0]=4 7510 B13R1.2679 CNC(=O)CN1C=CC(=O)C=C1Cl Amb25681199 [0,2,0,0,0,0|2,0,0]=4 7511 B13R1.2679 CNC(=O)Cc1ccc(Br)cc1O Amb25686662 [0,2,0,0,0,0|1,0,0]=3 7512 B13R1.2679 CNC(=O)Cc1ccc(Cl)cc1Br Amb21926823 [0,2,0,0,0,0|1,0,0]=3 7513 B13R1.2679 CNC(=O)Cc1ccc(Cl)cc1F Amb19558478 [0,2,0,0,0,0|1,0,0]=3 7514 B13R1.2679 CNC(=O)Cc1ccc(F)cc1Br Amb24592281 [0,2,0,0,0,0|1,0,0]=3 7515 B13R1.2679 CNC(=O)Cc1ccc(F)cc1Cl Amb24474715 [0,2,0,0,0,0|1,0,0]=3 7516 B13R1.2679 CNC(=O)Cc1ccc(cc1Cl)Cl Amb1225666 [0,2,0,0,0,0|1,0,0]=3 7517 B13R1.2679 CNC(=O)Nc1ccc(Cl)cc1Br Amb25796998 [0,2,0,0,0,0|2,0,0]=4 7518 B13R1.2679 CNC(=O)Nc1ccc(F)cc1I Amb25307224 [0,2,0,0,0,0|2,0,0]=4 7519 B13R1.2679 CNC(=O)Nc1ccc(F)cc1N Amb24399062 [0,2,0,0,0,0|2,0,0]=4 7520 B13R1.2679 CNC(=O)Nc1ccc(I)cc1Cl Amb25038893 [0,2,0,0,0,0|2,0,0]=4 7521 B13R1.2679 CNC(=O)Nc1ccc(N)cc1Br Amb24351875 [0,2,0,0,0,0|2,0,0]=4 7522 B13R1.2679 CNC(=O)Nc1ccc(N)cc1O Amb25708351 [0,2,0,0,0,0|2,0,0]=4 7523 B13R1.2679 CNC(=O)Nc1ccc(O)cc1F Amb25669261 [0,2,0,0,0,0|2,0,0]=4 7524 B13R1.2679 CNC(=O)Nc1ccc(cc1Br)Br Amb14010755 [0,2,0,0,0,0|2,0,0]=4 7525 B13R1.2679 CNC(=O)Nc1ccc(cc1Br)C Amb11316749 [0,2,0,0,0,0|2,0,0]=4 7526 B13R1.2679 CNC(=O)Nc1ccc(cc1Br)F Amb11371502 [0,2,0,0,0,0|2,0,0]=4 7527 B13R1.2679 CNC(=O)Nc1ccc(cc1C)Br Amb11259119 [0,2,0,0,0,0|2,0,0]=4 7528 B13R1.2679 CNC(=O)Nc1ccc(cc1C)I Amb11258983 [0,2,0,0,0,0|2,0,0]=4 7529 B13R1.2679 CNC(=O)Nc1ccc(cc1Cl)Br Amb11316921 [0,2,0,0,0,0|2,0,0]=4 7530 B13R1.2679 CNC(=O)Nc1ccc(cc1Cl)F Amb2444107 [0,2,0,0,0,0|2,0,0]=4 7531 B13R1.2679 CNC(=O)Nc1ccc(cc1F)Br Amb11316881 [0,2,0,0,0,0|2,0,0]=4 7532 B13R1.2679 CNC(=O)Nc1ccc(cc1F)Cl Amb11316629 [0,2,0,0,0,0|2,0,0]=4 7533 B13R1.2679 CNC(=O)Oc1ccc(F)cc1Cl Amb22469460 [0,2,0,0,0,0|2,0,0]=4 7534 B13R1.2679 CNC(=O)Oc1ccc(F)cc1N Amb25172413 [0,2,0,0,0,0|2,0,0]=4 7535 B13R1.2679 CNC(=O)Oc1ccc(N)cc1F Amb24468121 [0,2,0,0,0,0|2,0,0]=4 7536 B13R1.2679 COC(=N)Cc1ccc(F)cc1F Amb25767973 [0,2,0,0,0,0|1,0,0]=3 7537 B13R1.2679 COC(=O)CC1=CN=C(N)NC1=O Amb19804594 [0,2,0,0,0,0|2,0,0]=4 7538 B13R1.2679 COC(=O)CC1=CN=C(N)NC1=O Amb22284207 [0,2,0,0,0,0|2,0,0]=4 7539 B13R1.2679 COC(=O)CC1=CNC(=O)NC1=O Amb24360176 [0,2,0,0,0,0|2,0,0]=4 7540 B13R1.2679 COC(=O)CC1=CNC(=S)NC1=S Amb25727767 [0,2,0,0,0,0|2,0,0]=4 7541 B13R1.2679 COC(=O)CN1C=CC(=O)NC1=O Amb18328418 [0,2,0,0,0,0|2,0,0]=4 7542 B13R1.2679 COC(=O)CN1C=CC(=O)NC1=S Amb18331471 [0,2,0,0,0,0|2,0,0]=4 7543 B13R1.2679 COC(=O)CN1C=CC(=S)NC1=O Amb24563900 [0,2,0,0,0,0|2,0,0]=4 7544 B13R1.2679 COC(=O)CN1C=CC(Br)=CC1=O Amb25126822 [0,2,0,0,0,0|1,0,0]=3 7545 B13R1.2679 COC(=O)Cc1[n]cc(Br)cc1Cl Amb24595577 [0,2,0,0,0,0|1,0,0]=3 7546 B13R1.2679 COC(=O)Cc1[n]cc(Br)cc1N Amb25122880 [0,2,0,0,0,0|1,0,0]=3 7547 B13R1.2679 COC(=O)Cc1[n]cc(Cl)cc1F Amb25037480 [0,2,0,0,0,0|1,0,0]=3 7548 B13R1.2679 COC(=O)Cc1[n]cc(F)cc1N Amb25212649 [0,2,0,0,0,0|1,0,0]=3 7549 B13R1.2679 COC(=O)Cc1[n]cc(I)cc1F Amb25238935 [0,2,0,0,0,0|1,0,0]=3 7550 B13R1.2679 COC(=O)Cc1[n]cc(O)cc1Br Amb24424120 [0,2,0,0,0,0|1,0,0]=3 7551 B13R1.2679 COC(=O)Cc1c[n]c(Br)cc1Cl Amb25287475 [0,2,0,0,0,0|1,0,0]=3 7552 B13R1.2679 COC(=O)Cc1c[n]c(Br)cc1N Amb24501481 [0,2,0,0,0,0|1,0,0]=3 7553 B13R1.2679 COC(=O)Cc1c[n]c(Cl)cc1F Amb24528372 [0,2,0,0,0,0|1,0,0]=3 7554 B13R1.2679 COC(=O)Cc1c[n]c(N)[n]c1N Amb25196070 [0,2,0,0,0,0|2,0,0]=4 7555 B13R1.2679 COC(=O)Cc1c[n]c(N)cc1Br Amb25683534 [0,2,0,0,0,0|1,0,0]=3 7556 B13R1.2679 COC(=O)Cc1c[n]c(O)[n]c1N Amb24759275 [0,2,0,0,0,0|2,0,0]=4 7557 B13R1.2679 COC(=O)Cc1c[n]c(O)cc1Br Amb24353592 [0,2,0,0,0,0|1,0,0]=3 7558 B13R1.2679 COC(=O)Cc1ccc(Br)cc1Br Amb25217922 [0,2,0,0,0,0|0,0,0]=2 7559 B13R1.2679 COC(=O)Cc1ccc(Br)cc1Cl Amb22169560 [0,2,0,0,0,0|0,0,0]=2 7560 B13R1.2679 COC(=O)Cc1ccc(Br)cc1F Amb22002660 [0,2,0,0,0,0|0,0,0]=2 7561 B13R1.2679 COC(=O)Cc1ccc(Br)cc1I Amb25081927 [0,2,0,0,0,0|0,0,0]=2 7562 B13R1.2679 COC(=O)Cc1ccc(Br)cc1N Amb25105067 [0,2,0,0,0,0|0,0,0]=2 7563 B13R1.2679 COC(=O)Cc1ccc(Br)cc1O Amb25180982 [0,2,0,0,0,0|0,0,0]=2 7564 B13R1.2679 COC(=O)Cc1ccc(Cl)[n]c1F Amb24528375 [0,2,0,0,0,0|1,0,0]=3 7565 B13R1.2679 COC(=O)Cc1ccc(Cl)[n]c1N Amb25856916 [0,2,0,0,0,0|1,0,0]=3 7566 B13R1.2679 COC(=O)Cc1ccc(Cl)[n]c1O Amb25247342 [0,2,0,0,0,0|1,0,0]=3 7567 B13R1.2679 COC(=O)Cc1ccc(Cl)cc1N Amb24520812 [0,2,0,0,0,0|0,0,0]=2 7568 B13R1.2679 COC(=O)Cc1ccc(Cl)cc1O Amb25364084 [0,2,0,0,0,0|0,0,0]=2 7569 B13R1.2679 COC(=O)Cc1ccc(F)[n]c1Cl Amb24528374 [0,2,0,0,0,0|1,0,0]=3 7570 B13R1.2679 COC(=O)Cc1ccc(F)[n]c1I Amb25376471 [0,2,0,0,0,0|1,0,0]=3 7571 B13R1.2679 COC(=O)Cc1ccc(F)[n]c1N Amb24742768 [0,2,0,0,0,0|1,0,0]=3 7572 B13R1.2679 COC(=O)Cc1ccc(F)cc1Br Amb25802314 [0,2,0,0,0,0|0,0,0]=2 7573 B13R1.2679 COC(=O)Cc1ccc(F)cc1F Amb19888814 [0,2,0,0,0,0|0,0,0]=2 7574 B13R1.2679 COC(=O)Cc1ccc(F)cc1I Amb24666504 [0,2,0,0,0,0|0,0,0]=2 7575 B13R1.2679 COC(=O)Cc1ccc(I)cc1Br Amb25155404 [0,2,0,0,0,0|0,0,0]=2 7576 B13R1.2679 COC(=O)Cc1ccc(I)cc1N Amb25035602 [0,2,0,0,0,0|0,0,0]=2 7577 B13R1.2679 COC(=O)Cc1ccc(N)[n]c1Br Amb24753282 [0,2,0,0,0,0|1,0,0]=3 7578 B13R1.2679 COC(=O)Cc1ccc(N)[n]c1F Amb25208133 [0,2,0,0,0,0|1,0,0]=3 7579 B13R1.2679 COC(=O)Cc1ccc(N)cc1Cl Amb24531898 [0,2,0,0,0,0|0,0,0]=2 7580 B13R1.2679 COC(=O)Cc1ccc(N)cc1I Amb25377035 [0,2,0,0,0,0|0,0,0]=2 7581 B13R1.2679 COC(=O)Cc1ccc(O)[n]c1Br Amb25095404 [0,2,0,0,0,0|1,0,0]=3 7582 B13R1.2679 COC(=O)Cc1ccc(O)[n]c1Cl Amb25212055 [0,2,0,0,0,0|1,0,0]=3 7583 B13R1.2679 COC(=O)Cc1ccc(O)cc1Br Amb25035443 [0,2,0,0,0,0|0,0,0]=2 7584 B13R1.2679 COC(=O)Cc1ccc(O)cc1Cl Amb18653409 [0,2,0,0,0,0|0,0,0]=2 7585 B13R1.2679 COC(=O)Cc1ccc(O)cc1F Amb22001581 [0,2,0,0,0,0|0,0,0]=2 7586 B13R1.2679 COC(=O)Cc1ccc(O)cc1O Amb18275069 [0,2,0,0,0,0|0,0,0]=2 7587 B13R1.2679 COC(=O)Cc1ccc(cc1C)C Amb2209400 [0,2,0,0,0,0|0,0,0]=2 7588 B13R1.2679 COC(=O)Cc1ccc(cc1N)N Amb16229549 [0,2,0,0,0,0|0,0,0]=2 7589 B13R1.2679 COC(=O)Cn1ccc(nc1=O)N Amb10575343 [0,2,0,0,0,0|2,0,0]=4 7590 B13R1.2679 COC(=O)Nc1ccc(Br)[n]c1O Amb25668573 [0,2,0,0,0,0|2,0,0]=4 7591 B13R1.2679 COC(=O)Nc1ccc(Br)cc1O Amb25297304 [0,2,0,0,0,0|1,0,0]=3 7592 B13R1.2679 COC(=O)Nc1ccc(C)cc1C Amb17789921 [0,2,0,0,0,0|1,0,0]=3 7593 B13R1.2679 COC(=O)Nc1ccc(Cl)cc1Br Amb25035478 [0,2,0,0,0,0|1,0,0]=3 7594 B13R1.2679 COC(=O)Nc1ccc(F)cc1O Amb25807348 [0,2,0,0,0,0|1,0,0]=3 7595 B13R1.2679 COC(=O)Nc1ccc(I)cc1Cl Amb25784339 [0,2,0,0,0,0|1,0,0]=3 7596 B13R1.2679 COC(=O)Nc1ccc(N)cc1F Amb18956096 [0,2,0,0,0,0|1,0,0]=3 7597 B13R1.2679 COC(=O)Nc1ccc(O)cc1Cl Amb25783537 [0,2,0,0,0,0|1,0,0]=3 7598 B13R1.2679 COC(=O)Nc1ccc(O)cc1I Amb25297306 [0,2,0,0,0,0|1,0,0]=3 7599 B13R1.2679 COC(=O)Nc1ccc(O)cc1N Amb25276026 [0,2,0,0,0,0|1,0,0]=3 7600 B13R1.2679 COC(=O)Nc1ccc(cc1C)Br Amb2134728 [0,2,0,0,0,0|1,0,0]=3 7601 B13R1.2679 COC(=O)Nc1ccc(cc1C)F Amb2021223 [0,2,0,0,0,0|1,0,0]=3 7602 B13R1.2679 COC(=O)Oc1ccc(Br)cc1Cl Amb25205320 [0,2,0,0,0,0|1,0,0]=3 7603 B13R1.2679 COC(=O)Oc1ccc(C)cc1C Amb25372625 [0,2,0,0,0,0|1,0,0]=3 7604 B13R1.2679 COC(=O)Oc1ccc(Cl)cc1N Amb25723550 [0,2,0,0,0,0|1,0,0]=3 7605 B13R1.2679 COC(=O)Oc1ccc(F)cc1Cl Amb22471900 [0,2,0,0,0,0|1,0,0]=3 7606 B13R1.2679 COC(=O)Oc1ccc(N)cc1Cl Amb25839507 [0,2,0,0,0,0|1,0,0]=3 7607 B13R1.2679 COC(=O)Oc1ccc(N)cc1F Amb25247133 [0,2,0,0,0,0|1,0,0]=3 7608 B13R1.2679 COC(=O)Oc1ccc(cc1Cl)Cl Amb2445309 [0,2,0,0,0,0|1,0,0]=3 7609 B13R1.2679 CSC(=O)Nc1ccc(Cl)cc1Cl Amb22455526 [0,2,0,0,0,0|1,1,0]=4 7610 B13R1.2679 C\C=C(/C)\Cc1ccc(C)cc1O Amb24687773 [0,2,0,0,0,0|2,0,0]=4 7611 B13R1.2679 Cc1[n]c(Br)ccc1NC(=O)OC Amb24449419 [0,2,0,0,0,0|2,0,0]=4 7612 B13R1.2679 Cc1[n]c(Cl)ccc1CC(=O)NC Amb24718176 [0,2,0,0,0,0|2,0,0]=4 7613 B13R1.2679 Cc1[n]c(Cl)ccc1CC(=O)OC Amb24496941 [0,2,0,0,0,0|1,0,0]=3 7614 B13R1.2679 Cc1[n]c(Cl)ccc1NC(=O)OC Amb25668574 [0,2,0,0,0,0|2,0,0]=4 7615 B13R1.2679 Cc1[n]c(O)[n]cc1CC(=O)OC Amb24628761 [0,2,0,0,0,0|2,0,0]=4 7616 B13R1.2679 Cc1c[n]c(CC(=O)OC)c(Cl)c1 Amb24606851 [0,2,0,0,0,0|1,0,0]=3 7617 B13R1.2679 Cc1c[n]c(NC(=O)OC)c(N)c1 Amb25255147 [0,2,0,0,0,0|2,0,0]=4 7618 B13R1.2679 Cc1cc(Br)[n]cc1NC(=O)OC Amb24509946 [0,2,0,0,0,0|2,0,0]=4 7619 B13R1.2679 Cc1cc(Br)c(CC(=O)CBr)cc1 Amb25208632 [0,2,0,0,0,0|2,0,0]=4 7620 B13R1.2679 Cc1cc(Br)c[n]c1NC(=O)OC Amb24353327 [0,2,0,0,0,0|2,0,0]=4 7621 B13R1.2679 Cc1cc(Br)ccc1OC(=O)CC Amb25037103 [0,2,0,0,0,0|2,0,0]=4 7622 B13R1.2679 Cc1cc(C)c(CC(=O)CO)cc1 Amb18065756 [0,2,0,0,0,0|2,0,0]=4 7623 B13R1.2679 Cc1cc(Cl)[n]cc1NC(=O)OC Amb25334667 [0,2,0,0,0,0|2,0,0]=4 7624 B13R1.2679 Cc1cc(Cl)c(CC(=O)CN)cc1 Amb25673933 [0,2,0,0,0,0|2,0,0]=4 7625 B13R1.2679 Cc1cc(Cl)c(CC(=O)OC)c[n]1 Amb24615231 [0,2,0,0,0,0|1,0,0]=3 7626 B13R1.2679 Cc1cc(Cl)c[n]c1CC(=O)OC Amb24738589 [0,2,0,0,0,0|1,0,0]=3 7627 B13R1.2679 Cc1cc(Cl)ccc1CC(=O)CBr Amb25238902 [0,2,0,0,0,0|2,0,0]=4 7628 B13R1.2679 Cc1cc(Cl)ccc1CN(C)OC Amb25792165 [0,2,0,0,0,0|2,0,0]=4 7629 B13R1.2679 Cc1cc(F)c(CC(=O)OC)c[n]1 Amb25352177 [0,2,0,0,0,0|1,0,0]=3 7630 B13R1.2679 Cc1cc(F)ccc1CC(=O)C=C Amb24640077 [0,2,0,0,0,0|1,0,1]=4 7631 B13R1.2679 Cc1cc(F)ccc1CC(=O)CCl Amb24578910 [0,2,0,0,0,0|2,0,0]=4 7632 B13R1.2679 Cc1cc(F)ccc1CC(=O)CN Amb18909202 [0,2,0,0,0,0|2,0,0]=4 7633 B13R1.2679 Cc1cc(F)ccc1CC(=O)OC Amb25755089 [0,2,0,0,0,0|0,0,0]=2 7634 B13R1.2679 Cc1cc(F)ccc1CS(=O)CC Amb25092621 [0,2,0,0,0,0|2,0,0]=4 7635 B13R1.2679 Cc1cc(F)ccc1NC(=O)NC Amb25272756 [0,2,0,0,0,0|2,0,0]=4 7636 B13R1.2679 Cc1cc(I)ccc1CC(=O)OC Amb24488750 [0,2,0,0,0,0|0,0,0]=2 7637 B13R1.2679 Cc1cc(I)ccc1NC(=O)OC Amb24459226 [0,2,0,0,0,0|1,0,0]=3 7638 B13R1.2679 Cc1cc(N)ccc1CC(=O)OC Amb25074520 [0,2,0,0,0,0|0,0,0]=2 7639 B13R1.2679 Cc1cc(O)ccc1NC(=O)NC Amb25669260 [0,2,0,0,0,0|2,0,0]=4 7640 B13R1.2679 Cc1cc(O)ccc1OC(=O)CC Amb25053012 [0,2,0,0,0,0|2,0,0]=4 7641 B13R1.2679 Cc1cc(S)ccc1CC(=O)CBr Amb25254859 [0,2,0,0,0,0|2,0,0]=4 7642 B13R1.2679 Cc1ccc(CC(=N)OC)c(C)c1 Amb18065712 [0,2,0,0,0,0|1,0,0]=3 7643 B13R1.2679 Cc1ccc(CC(=O)CBr)c(C)c1 Amb24708300 [0,2,0,0,0,0|2,0,0]=4 7644 B13R1.2679 Cc1ccc(CC(=O)CBr)c(Cl)c1 Amb24656580 [0,2,0,0,0,0|2,0,0]=4 7645 B13R1.2679 Cc1ccc(CC(=O)CC)c(Cl)c1 Amb25071233 [0,2,0,0,0,0|1,0,0]=3 7646 B13R1.2679 Cc1ccc(CC(=O)NC)c(C)c1 Amb19559113 [0,2,0,0,0,0|1,0,0]=3 7647 B13R1.2679 Cc1ccc(CC(=O)NC)c(Cl)[n]1 Amb25119803 [0,2,0,0,0,0|2,0,0]=4 7648 B13R1.2679 Cc1ccc(CC(=O)NC)c(Cl)c1 Amb24403506 [0,2,0,0,0,0|1,0,0]=3 7649 B13R1.2679 Cc1ccc(CC(=O)NC)c(N)c1 Amb22913582 [0,2,0,0,0,0|1,0,0]=3 7650 B13R1.2679 Cc1ccc(CC(=O)NN)c(O)c1 Amb24089643 [0,2,0,0,0,0|2,0,0]=4 7651 B13R1.2679 Cc1ccc(CC(=O)NO)c(Cl)c1 Amb24613786 [0,2,0,0,0,0|2,0,0]=4 7652 B13R1.2679 Cc1ccc(CC(=O)OC)c(Br)c1 Amb22831596 [0,2,0,0,0,0|0,0,0]=2 7653 B13R1.2679 Cc1ccc(CC(=O)OC)c(F)[n]1 Amb25268611 [0,2,0,0,0,0|1,0,0]=3 7654 B13R1.2679 Cc1ccc(CC(=O)OC)c(F)c1 Amb25800757 [0,2,0,0,0,0|0,0,0]=2 7655 B13R1.2679 Cc1ccc(CC(=O)OC)c(N)c1 Amb22263001 [0,2,0,0,0,0|0,0,0]=2 7656 B13R1.2679 Cc1ccc(CC(=O)OC)c(O)[n]1 Amb24708302 [0,2,0,0,0,0|1,0,0]=3 7657 B13R1.2679 Cc1ccc(CS(=O)CC)c(Cl)c1 Amb24510266 [0,2,0,0,0,0|2,0,0]=4 7658 B13R1.2679 Cc1ccc(NC(=O)CC)c(Cl)c1 Amb25674659 [0,2,0,0,0,0|2,0,0]=4 7659 B13R1.2679 Cc1ccc(NC(=O)CC)c(F)c1 Amb25850568 [0,2,0,0,0,0|2,0,0]=4 7660 B13R1.2679 Cc1ccc(NC(=O)NC)c(Cl)c1 Amb25130982 [0,2,0,0,0,0|2,0,0]=4 7661 B13R1.2679 Cc1ccc(NC(=O)NC)c(O)c1 Amb24474038 [0,2,0,0,0,0|2,0,0]=4 7662 B13R1.2679 Cc1ccc(NC(=O)OC)c(C)[n]1 Amb24422147 [0,2,0,0,0,0|2,0,0]=4 7663 B13R1.2679 Cc1ccc(NC(=O)OC)c(Cl)c1 Amb24372555 [0,2,0,0,0,0|1,0,0]=3 7664 B13R1.2679 Cc1ccc(NC(=O)OC)c(F)c1 Amb25772989 [0,2,0,0,0,0|1,0,0]=3 7665 B13R1.2679 Cc1ccc(NC(=O)OC)c(O)[n]1 Amb25734858 [0,2,0,0,0,0|2,0,0]=4 7666 B13R1.2679 Cc1ccc(NC(=O)OC)c(O)c1 Amb18178976 [0,2,0,0,0,0|1,0,0]=3 7667 B13R1.2679 Cc1ccc(OC(=O)NC)c(Cl)c1 Amb25190430 [0,2,0,0,0,0|2,0,0]=4 7668 B13R1.2679 Cc1ccc(OC(=O)NC)c(N)c1 Amb24626550 [0,2,0,0,0,0|2,0,0]=4 7669 B13R1.2679 Cc1ccc(OC(=O)OC)c(Br)c1 Amb24676438 [0,2,0,0,0,0|1,0,0]=3 7670 B13R1.2679 Cc1ccc(OC(=O)OC)c(N)[n]1 Amb25719106 [0,2,0,0,0,0|2,0,0]=4 7671 B13R1.2679 Cc1ccc(OC(=O)OC)c(N)c1 Amb24442140 [0,2,0,0,0,0|1,0,0]=3 7672 B13R1.2679 NCC(=O)Cc1ccc(Br)cc1Cl Amb25155818 [0,2,0,0,0,0|2,0,0]=4 7673 B13R1.2679 NCC(=O)Cc1ccc(Br)cc1F Amb24400945 [0,2,0,0,0,0|2,0,0]=4 7674 B13R1.2679 NCC(=O)Cc1ccc(Cl)cc1Cl Amb25849130 [0,2,0,0,0,0|2,0,0]=4 7675 B13R1.2679 NCC(=O)Cc1ccc(F)cc1Br Amb25155620 [0,2,0,0,0,0|2,0,0]=4 7676 B13R1.2679 NCC(=O)Cc1ccc(F)cc1F Amb18252890 [0,2,0,0,0,0|2,0,0]=4 7677 B13R1.2679 NNC(=O)Cc1ccc(cc1C)C Amb2209300 [0,2,0,0,0,0|2,0,0]=4 7678 B13R1.2679 NNC(=O)Cc1ccc(cc1F)F Amb15695315 [0,2,0,0,0,0|2,0,0]=4 7679 B13R1.2679 Nc1cc(Br)ccc1CC(=O)CCl Amb24549291 [0,2,0,0,0,0|2,0,0]=4 7680 B13R1.2679 Nc1cc(Cl)c(CC(=O)CCl)cc1 Amb24756987 [0,2,0,0,0,0|2,0,0]=4 7681 B13R1.2679 Nc1cc(F)ccc1CC(=O)CBr Amb24637134 [0,2,0,0,0,0|2,0,0]=4 7682 B13R1.2679 Nc1cc(I)ccc1CC(=O)CBr Amb24656710 [0,2,0,0,0,0|2,0,0]=4 7683 B13R1.2679 Nc1cc(O)ccc1CC(=O)CBr Amb24537053 [0,2,0,0,0,0|2,0,0]=4 7684 B13R1.2679 Nc1cc(S)ccc1CC(=O)CCl Amb24537088 [0,2,0,0,0,0|2,0,0]=4 7685 B13R1.2679 Nc1ccc(CC(=O)CBr)c(Cl)c1 Amb24637103 [0,2,0,0,0,0|2,0,0]=4 7686 B13R1.2679 Nc1ccc(CC(=O)CBr)c(F)c1 Amb25351859 [0,2,0,0,0,0|2,0,0]=4 7687 B13R1.2679 Nc1ccc(CC(=O)CBr)c(N)c1 Amb24537169 [0,2,0,0,0,0|2,0,0]=4 7688 B13R1.2679 Nc1ccc(CC(=O)CCl)c(O)c1 Amb24541326 [0,2,0,0,0,0|2,0,0]=4 7689 B13R1.2679 O=C(CBr)Cc1ccc(F)cc1F Amb24394796 [0,2,0,0,0,0|2,0,0]=4 7690 B13R1.2679 O=C(CBr)Cc1ccc(I)cc1F Amb24598654 [0,2,0,0,0,0|2,0,0]=4 7691 B13R1.2679 O=C(CBr)Cc1ccc(I)cc1I Amb24756953 [0,2,0,0,0,0|2,0,0]=4 7692 B13R1.2679 O=C(CCl)Cc1ccc(F)cc1Br Amb24637060 [0,2,0,0,0,0|2,0,0]=4 7693 B13R1.2679 O=C(CCl)Cc1ccc(F)cc1F Amb24459605 [0,2,0,0,0,0|2,0,0]=4 7694 B13R1.2679 O=C(CCl)Cc1ccc(I)cc1F Amb24561255 [0,2,0,0,0,0|2,0,0]=4 7695 B13R1.2679 O=C(CCl)Cc1ccc(I)cc1I Amb24666834 [0,2,0,0,0,0|2,0,0]=4 7696 B13R1.2679 O=C(Cc1ccc(Br)cc1Br)CBr Amb25364389 [0,2,0,0,0,0|2,0,0]=4 7697 B13R1.2679 O=C(Cc1ccc(Cl)cc1Br)CBr Amb24536985 [0,2,0,0,0,0|2,0,0]=4 7698 B13R1.2679 O=C(Cc1ccc(Cl)cc1Br)CCl Amb24536990 [0,2,0,0,0,0|2,0,0]=4 7699 B13R1.2679 O=C(Cc1ccc(Cl)cc1F)CBr Amb25253215 [0,2,0,0,0,0|2,0,0]=4 7700 B13R1.2679 O=C(Cc1ccc(F)cc1Cl)CBr Amb24628050 [0,2,0,0,0,0|2,0,0]=4 7701 B13R1.2679 O=C(Cc1ccc(F)cc1S)CBr Amb24605288 [0,2,0,0,0,0|2,0,0]=4 7702 B13R1.2679 OCC(=O)Cc1ccc(Cl)cc1Cl Amb18067433 [0,2,0,0,0,0|2,0,0]=4 7703 B13R1.2679 ONC(=O)Cc1ccc(Cl)cc1Cl Amb25663620 [0,2,0,0,0,0|2,0,0]=4 7704 B13R1.2679 ONC(=O)Cc1ccc(F)cc1Cl Amb24686068 [0,2,0,0,0,0|2,0,0]=4 7705 B13R1.2679 ONC(=O)Cc1ccc(F)cc1F Amb25104068 [0,2,0,0,0,0|2,0,0]=4 7706 B13R1.2679 Oc1cc(Br)c(CC(=O)CBr)cc1 Amb25364543 [0,2,0,0,0,0|2,0,0]=4 7707 B13R1.2679 Oc1cc(I)c(CC(=O)CBr)cc1 Amb24598661 [0,2,0,0,0,0|2,0,0]=4 7708 B13R1.2679 Oc1cc(I)ccc1CC(=O)CCl Amb24527882 [0,2,0,0,0,0|2,0,0]=4 7709 B13R1.2679 Oc1cc(S)ccc1CC(=O)CBr Amb24603434 [0,2,0,0,0,0|2,0,0]=4 7710 B13R1.2679 Oc1ccc(CC(=O)CBr)c(S)c1 Amb24667926 [0,2,0,0,0,0|2,0,0]=4 7711 B13R1.2679 Oc1ccc(CC(=O)NO)c(Cl)c1 Amb24734734 [0,2,0,0,0,0|2,0,0]=4 7712 B13R1.2879 C#CC(=O)Cc1cc(Cl)c(Cl)cc1 Amb25155184 [0,2,0,0,0,0|1,0,1]=4 7713 B13R1.2879 C#CC(=O)Cc1cc(F)c(F)cc1 Amb25161220 [0,2,0,0,0,0|1,0,1]=4 7714 B13R1.2879 C=CC(=O)Cc1cc(Cl)c(Cl)cc1 Amb25340293 [0,2,0,0,0,0|1,0,1]=4 7715 B13R1.2879 C=CC(=O)Cc1ccc(Cl)c(F)c1 Amb25126495 [0,2,0,0,0,0|1,0,1]=4 7716 B13R1.2879 C=CC(=O)Cc1ccc(F)c(Br)c1 Amb24452327 [0,2,0,0,0,0|1,0,1]=4 7717 B13R1.2879 CC1=CN(CC(=O)CC)C=CC1=O Amb24746511 [0,2,0,0,0,0|2,0,0]=4 7718 B13R1.2879 CC1=CN(CC(=O)NC)C=CC1=O Amb25259164 [0,2,0,0,0,0|2,0,0]=4 7719 B13R1.2879 CCC(=O)Cc1cc(Br)c(F)cc1 Amb24472634 [0,2,0,0,0,0|1,0,0]=3 7720 B13R1.2879 CCC(=O)Cc1cc(F)c(Cl)cc1 Amb24445135 [0,2,0,0,0,0|1,0,0]=3 7721 B13R1.2879 CCC(=O)Cc1ccc(C)c(C)c1 Amb18795833 [0,2,0,0,0,0|1,0,0]=3 7722 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Cl)Cl Amb17141002 [0,2,0,0,0,0|1,0,0]=3 7723 B13R1.2879 CCC(=O)Nc1ccc(Br)c(I)c1 Amb24469936 [0,2,0,0,0,0|2,0,0]=4 7724 B13R1.2879 CCC(=O)Nc1ccc(Br)c(O)c1 Amb24473696 [0,2,0,0,0,0|2,0,0]=4 7725 B13R1.2879 CCC(=O)Nc1ccc(N)c(Br)c1 Amb19981750 [0,2,0,0,0,0|2,0,0]=4 7726 B13R1.2879 CCC(=O)Nc1ccc(N)c(Cl)c1 Amb24658697 [0,2,0,0,0,0|2,0,0]=4 7727 B13R1.2879 CCC(=O)Nc1ccc(N)c(F)c1 Amb24470568 [0,2,0,0,0,0|2,0,0]=4 7728 B13R1.2879 CCC(=O)Nc1ccc(O)c(Cl)c1 Amb24697427 [0,2,0,0,0,0|2,0,0]=4 7729 B13R1.2879 CCC(=O)Nc1ccc(O)c(O)c1 Amb25815937 [0,2,0,0,0,0|2,0,0]=4 7730 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)F Amb1885386 [0,2,0,0,0,0|2,0,0]=4 7731 B13R1.2879 CCC(=O)Nc1ccc(c(c1)N)Cl Amb1115293 [0,2,0,0,0,0|2,0,0]=4 7732 B13R1.2879 CCC(=O)Nc1ccc(c(c1)N)F Amb1117421 [0,2,0,0,0,0|2,0,0]=4 7733 B13R1.2879 CCC(=O)Oc1cc(F)c(F)cc1 Amb24613338 [0,2,0,0,0,0|2,0,0]=4 7734 B13R1.2879 CCC(=O)Oc1ccc(Br)c(F)c1 Amb24673308 [0,2,0,0,0,0|2,0,0]=4 7735 B13R1.2879 CCC(=O)Oc1ccc(Cl)c(F)c1 Amb25739540 [0,2,0,0,0,0|2,0,0]=4 7736 B13R1.2879 CCC(=O)Oc1ccc(Cl)c(O)c1 Amb25786891 [0,2,0,0,0,0|2,0,0]=4 7737 B13R1.2879 CCC(=O)Oc1ccc(F)c(Br)c1 Amb24573877 [0,2,0,0,0,0|2,0,0]=4 7738 B13R1.2879 CCC(=O)Oc1ccc(F)c(Cl)c1 Amb24719245 [0,2,0,0,0,0|2,0,0]=4 7739 B13R1.2879 CCC(=O)Oc1ccc(O)c(F)c1 Amb24361544 [0,2,0,0,0,0|2,0,0]=4 7740 B13R1.2879 CCS(=O)Cc1cc(C)c(C)cc1 Amb24612529 [0,2,0,0,0,0|2,0,0]=4 7741 B13R1.2879 CCS(=O)Cc1cc(Cl)c(Br)cc1 Amb24510265 [0,2,0,0,0,0|2,0,0]=4 7742 B13R1.2879 CCS(=O)Cc1cc(F)c(F)cc1 Amb24575777 [0,2,0,0,0,0|2,0,0]=4 7743 B13R1.2879 CCS(=O)Cc1cc(N)c(Cl)cc1 Amb18974555 [0,2,0,0,0,0|2,0,0]=4 7744 B13R1.2879 CNC(=O)CN1C=CC(=O)C(N)=C1 Amb23454748 [0,2,0,0,0,0|2,0,0]=4 7745 B13R1.2879 CNC(=O)Cc1ccc(F)c(Br)c1 Amb25680375 [0,2,0,0,0,0|1,0,0]=3 7746 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)Cl Amb11217768 [0,2,0,0,0,0|1,0,0]=3 7747 B13R1.2879 CNC(=O)N[13c]1[13cH][13cH][13c](Cl)[13c](Cl)[13cH]1 Amb22054889 [0,2,0,0,0,0|2,0,0]=4 7748 B13R1.2879 CNC(=O)Nc1ccc(Br)c(Cl)c1 Amb24469925 [0,2,0,0,0,0|2,0,0]=4 7749 B13R1.2879 CNC(=O)Nc1ccc(Br)c(I)c1 Amb25110805 [0,2,0,0,0,0|2,0,0]=4 7750 B13R1.2879 CNC(=O)Nc1ccc(F)c(Br)c1 Amb25772639 [0,2,0,0,0,0|2,0,0]=4 7751 B13R1.2879 CNC(=O)Nc1ccc(F)c(F)c1 Amb25833405 [0,2,0,0,0,0|2,0,0]=4 7752 B13R1.2879 CNC(=O)Nc1ccc(I)c(Br)c1 Amb25191695 [0,2,0,0,0,0|2,0,0]=4 7753 B13R1.2879 CNC(=O)Nc1ccc(N)c(Br)c1 Amb25704373 [0,2,0,0,0,0|2,0,0]=4 7754 B13R1.2879 CNC(=O)Nc1ccc(O)c(F)c1 Amb25236765 [0,2,0,0,0,0|2,0,0]=4 7755 B13R1.2879 CNC(=O)Nc1ccc(c(c1)C)Br Amb11258850 [0,2,0,0,0,0|2,0,0]=4 7756 B13R1.2879 CNC(=O)Nc1ccc(c(c1)C)F Amb2444106 [0,2,0,0,0,0|2,0,0]=4 7757 B13R1.2879 CNC(=O)Nc1ccc(c(c1)Cl)C Amb2444985 [0,2,0,0,0,0|2,0,0]=4 7758 B13R1.2879 CNC(=O)Nc1ccc(c(c1)Cl)F Amb11258852 [0,2,0,0,0,0|2,0,0]=4 7759 B13R1.2879 CNC(=O)Nc1ccc(c(c1)F)Cl Amb11371891 [0,2,0,0,0,0|2,0,0]=4 7760 B13R1.2879 CNC(=O)Oc1ccc(Cl)c(F)c1 Amb22433648 [0,2,0,0,0,0|2,0,0]=4 7761 B13R1.2879 CNC(=O)Oc1ccc(Cl)c(N)c1 Amb25719105 [0,2,0,0,0,0|2,0,0]=4 7762 B13R1.2879 CNC(=O)Oc1ccc(N)c(Cl)c1 Amb24432357 [0,2,0,0,0,0|2,0,0]=4 7763 B13R1.2879 COC(=N)Cc1cc(Cl)c(Cl)cc1 Amb25803251 [0,2,0,0,0,0|1,0,0]=3 7764 B13R1.2879 COC(=O)CN1C=CC(=O)C(N)=C1 Amb25118080 [0,2,0,0,0,0|1,0,0]=3 7765 B13R1.2879 COC(=O)Cc1c[n]c(Br)c(Cl)c1 Amb24694458 [0,2,0,0,0,0|1,0,0]=3 7766 B13R1.2879 COC(=O)Cc1c[n]c(Br)c(F)c1 Amb24754328 [0,2,0,0,0,0|1,0,0]=3 7767 B13R1.2879 COC(=O)Cc1c[n]c(Cl)c(Br)c1 Amb25233208 [0,2,0,0,0,0|1,0,0]=3 7768 B13R1.2879 COC(=O)Cc1c[n]c(Cl)c(F)c1 Amb24695698 [0,2,0,0,0,0|1,0,0]=3 7769 B13R1.2879 COC(=O)Cc1c[n]c(I)c(F)c1 Amb25364408 [0,2,0,0,0,0|1,0,0]=3 7770 B13R1.2879 COC(=O)Cc1c[n]c(O)c(Cl)c1 Amb25228189 [0,2,0,0,0,0|1,0,0]=3 7771 B13R1.2879 COC(=O)Cc1cc(Br)c(Br)cc1 Amb25178846 [0,2,0,0,0,0|0,0,0]=2 7772 B13R1.2879 COC(=O)Cc1cc(Br)c(Cl)c[n]1 Amb25211093 [0,2,0,0,0,0|1,0,0]=3 7773 B13R1.2879 COC(=O)Cc1cc(Br)c(N)c[n]1 Amb24501486 [0,2,0,0,0,0|1,0,0]=3 7774 B13R1.2879 COC(=O)Cc1cc(Br)c(O)c[n]1 Amb25123767 [0,2,0,0,0,0|1,0,0]=3 7775 B13R1.2879 COC(=O)Cc1cc(Cl)c(F)c[n]1 Amb24610786 [0,2,0,0,0,0|1,0,0]=3 7776 B13R1.2879 COC(=O)Cc1cc(Cl)c(O)c[n]1 Amb24728272 [0,2,0,0,0,0|1,0,0]=3 7777 B13R1.2879 COC(=O)Cc1cc(F)c(F)[n]c1 Amb25292936 [0,2,0,0,0,0|1,0,0]=3 7778 B13R1.2879 COC(=O)Cc1cc(F)c(F)cc1 Amb18942898 [0,2,0,0,0,0|0,0,0]=2 7779 B13R1.2879 COC(=O)Cc1cc(O)c(Br)c[n]1 Amb24652852 [0,2,0,0,0,0|1,0,0]=3 7780 B13R1.2879 COC(=O)Cc1cc(O)c(F)c[n]1 Amb25325113 [0,2,0,0,0,0|1,0,0]=3 7781 B13R1.2879 COC(=O)Cc1ccc(Br)c(F)c1 Amb22898798 [0,2,0,0,0,0|0,0,0]=2 7782 B13R1.2879 COC(=O)Cc1ccc(Br)c(N)c1 Amb23402137 [0,2,0,0,0,0|0,0,0]=2 7783 B13R1.2879 COC(=O)Cc1ccc(Br)c(O)c1 Amb24451265 [0,2,0,0,0,0|0,0,0]=2 7784 B13R1.2879 COC(=O)Cc1ccc(Cl)c(Br)c1 Amb19888250 [0,2,0,0,0,0|0,0,0]=2 7785 B13R1.2879 COC(=O)Cc1ccc(Cl)c(F)c1 Amb25195356 [0,2,0,0,0,0|0,0,0]=2 7786 B13R1.2879 COC(=O)Cc1ccc(F)c(Br)c1 Amb25798154 [0,2,0,0,0,0|0,0,0]=2 7787 B13R1.2879 COC(=O)Cc1ccc(F)c(N)c1 Amb23400547 [0,2,0,0,0,0|0,0,0]=2 7788 B13R1.2879 COC(=O)Cc1ccc(I)c(Br)c1 Amb19888249 [0,2,0,0,0,0|0,0,0]=2 7789 B13R1.2879 COC(=O)Cc1ccc(N)c(Br)c1 Amb19888247 [0,2,0,0,0,0|0,0,0]=2 7790 B13R1.2879 COC(=O)Cc1ccc(N)c(Cl)c1 Amb18130631 [0,2,0,0,0,0|0,0,0]=2 7791 B13R1.2879 COC(=O)Cc1ccc(N)c(F)c1 Amb22225000 [0,2,0,0,0,0|0,0,0]=2 7792 B13R1.2879 COC(=O)Cc1ccc(N)c(I)c1 Amb21964148 [0,2,0,0,0,0|0,0,0]=2 7793 B13R1.2879 COC(=O)Cc1ccc(N)c(S)c1 Amb24413500 [0,2,0,0,0,0|0,0,0]=2 7794 B13R1.2879 COC(=O)Cc1ccc(O)c(Br)c1 Amb24761488 [0,2,0,0,0,0|0,0,0]=2 7795 B13R1.2879 COC(=O)Cc1ccc(O)c(Cl)[n]1 Amb24680023 [0,2,0,0,0,0|1,0,0]=3 7796 B13R1.2879 COC(=O)Cc1ccc(O)c(F)c1 Amb18129332 [0,2,0,0,0,0|0,0,0]=2 7797 B13R1.2879 COC(=O)Cc1ccc(S)c(Cl)c1 Amb25783404 [0,2,0,0,0,0|0,0,0]=2 7798 B13R1.2879 COC(=O)Cc1ccc(c(c1)C)F Amb17400911 [0,2,0,0,0,0|0,0,0]=2 7799 B13R1.2879 COC(=O)Cc1ccc(c(c1)C)O Amb10602495 [0,2,0,0,0,0|0,0,0]=2 7800 B13R1.2879 COC(=O)Cc1ccc(c(c1)N)O Amb2423588 [0,2,0,0,0,0|0,0,0]=2 7801 B13R1.2879 COC(=O)Cc1ccc(c(c1)O)O Amb16193044 [0,2,0,0,0,0|0,0,0]=2 7802 B13R1.2879 COC(=O)NC1=CN(C)C(=O)C=C1 Amb25066222 [0,2,0,0,0,0|2,0,0]=4 7803 B13R1.2879 COC(=O)Nc1cc(Cl)c(Cl)[n]c1 Amb25334665 [0,2,0,0,0,0|2,0,0]=4 7804 B13R1.2879 COC(=O)Nc1ccc(Br)c(Cl)c1 Amb22486940 [0,2,0,0,0,0|1,0,0]=3 7805 B13R1.2879 COC(=O)Nc1ccc(Br)c(F)c1 Amb24182180 [0,2,0,0,0,0|1,0,0]=3 7806 B13R1.2879 COC(=O)Nc1ccc(Br)c(O)c1 Amb24722374 [0,2,0,0,0,0|1,0,0]=3 7807 B13R1.2879 COC(=O)Nc1ccc(Cl)c(Br)c1 Amb25314829 [0,2,0,0,0,0|1,0,0]=3 7808 B13R1.2879 COC(=O)Nc1ccc(F)c(Br)c1 Amb25139114 [0,2,0,0,0,0|1,0,0]=3 7809 B13R1.2879 COC(=O)Nc1ccc(N)c(Br)[n]1 Amb24496298 [0,2,0,0,0,0|2,0,0]=4 7810 B13R1.2879 COC(=O)Nc1ccc(N)c(Br)c1 Amb25329606 [0,2,0,0,0,0|1,0,0]=3 7811 B13R1.2879 COC(=O)Nc1ccc(N)c(Cl)c1 Amb25085031 [0,2,0,0,0,0|1,0,0]=3 7812 B13R1.2879 COC(=O)Nc1ccc(N)c(N)c1 Amb25313021 [0,2,0,0,0,0|1,0,0]=3 7813 B13R1.2879 COC(=O)Nc1ccc(O)c(F)c1 Amb25692514 [0,2,0,0,0,0|1,0,0]=3 7814 B13R1.2879 COC(=O)Nc1ccc(O)c(O)c1 Amb25124694 [0,2,0,0,0,0|1,0,0]=3 7815 B13R1.2879 COC(=O)Nc1ccc(c(c1)Cl)Cl Amb1065310 [0,2,0,0,0,0|1,0,0]=3 7816 B13R1.2879 COC(=O)Oc1ccc(Cl)c(Cl)c1 Amb22448748 [0,2,0,0,0,0|1,0,0]=3 7817 B13R1.2879 COC(=O)Oc1ccc(Cl)c(N)c1 Amb25187045 [0,2,0,0,0,0|1,0,0]=3 7818 B13R1.2879 COC(=O)Oc1ccc(F)c(Cl)c1 Amb22486331 [0,2,0,0,0,0|1,0,0]=3 7819 B13R1.2879 COC(=O)Oc1ccc(N)c(F)c1 Amb25360302 [0,2,0,0,0,0|1,0,0]=3 7820 B13R1.2879 COC(=O)Sc1ccc(O)c(Cl)c1 Amb25093675 [0,2,0,0,0,0|1,0,0]=3 7821 B13R1.2879 CON(C)Cc1cc(C)c(C)cc1 Amb24335064 [0,2,0,0,0,0|2,0,0]=4 7822 B13R1.2879 CON(C)Cc1ccc(Cl)c(F)c1 Amb25357068 [0,2,0,0,0,0|2,0,0]=4 7823 B13R1.2879 CON(C)Cc1ccc(F)c(Cl)c1 Amb25856251 [0,2,0,0,0,0|2,0,0]=4 7824 B13R1.2879 CON(C)Cc1ccc(I)c(Cl)c1 Amb24335065 [0,2,0,0,0,0|2,0,0]=4 7825 B13R1.2879 CSC(=O)Nc1cc(Cl)c(Cl)cc1 Amb22446137 [0,2,0,0,0,0|1,1,0]=4 7826 B13R1.2879 CSC(=O)Nc1ccc(F)c(Cl)c1 Amb25368432 [0,2,0,0,0,0|1,1,0]=4 7827 B13R1.2879 Cc1[n]c(CC(=O)OC)[n]cc1O Amb25325121 [0,2,0,0,0,0|2,0,0]=4 7828 B13R1.2879 Cc1[n]c(CC(=O)OC)ccc1O Amb24697061 [0,2,0,0,0,0|1,0,0]=3 7829 B13R1.2879 Cc1c[n]c(CC(=O)OC)[n]c1O Amb24638284 [0,2,0,0,0,0|2,0,0]=4 7830 B13R1.2879 Cc1c[n]c(CC(=O)OC)cc1Br Amb25217110 [0,2,0,0,0,0|1,0,0]=3 7831 B13R1.2879 Cc1cc(CC(=N)OC)ccc1C Amb18178412 [0,2,0,0,0,0|1,0,0]=3 7832 B13R1.2879 Cc1cc(CC(=O)C#C)ccc1C Amb24735276 [0,2,0,0,0,0|1,0,1]=4 7833 B13R1.2879 Cc1cc(CC(=O)C=C)ccc1C Amb25180970 [0,2,0,0,0,0|1,0,1]=4 7834 B13R1.2879 Cc1cc(CC(=O)CBr)ccc1Br Amb24697023 [0,2,0,0,0,0|2,0,0]=4 7835 B13R1.2879 Cc1cc(CC(=O)CBr)ccc1S Amb24579738 [0,2,0,0,0,0|2,0,0]=4 7836 B13R1.2879 Cc1cc(CC(=O)CCl)ccc1Br Amb24637084 [0,2,0,0,0,0|2,0,0]=4 7837 B13R1.2879 Cc1cc(CC(=O)CN)ccc1C Amb18252378 [0,2,0,0,0,0|2,0,0]=4 7838 B13R1.2879 Cc1cc(CC(=O)NO)ccc1C Amb18809174 [0,2,0,0,0,0|2,0,0]=4 7839 B13R1.2879 Cc1cc(CC(=O)OC)[n]cc1F Amb24665996 [0,2,0,0,0,0|1,0,0]=3 7840 B13R1.2879 Cc1cc(CC(=O)OC)[n]cc1N Amb24564681 [0,2,0,0,0,0|1,0,0]=3 7841 B13R1.2879 Cc1cc(CC(=O)OC)c[n]c1F Amb25312682 [0,2,0,0,0,0|1,0,0]=3 7842 B13R1.2879 Cc1cc(CC(=O)OC)ccc1Br Amb18277179 [0,2,0,0,0,0|0,0,0]=2 7843 B13R1.2879 Cc1cc(CC(=O)OC)ccc1Cl Amb18277008 [0,2,0,0,0,0|0,0,0]=2 7844 B13R1.2879 Cc1cc(CN(C)OC)ccc1N Amb25371110 [0,2,0,0,0,0|2,0,0]=4 7845 B13R1.2879 Cc1cc(NC(=O)OC)[n]cc1Br Amb25091496 [0,2,0,0,0,0|2,0,0]=4 7846 B13R1.2879 Cc1cc(NC(=O)OC)[n]cc1N Amb18952893 [0,2,0,0,0,0|2,0,0]=4 7847 B13R1.2879 Cc1cc(ccc1Br)OC(=O)NC Amb22454641 [0,2,0,0,0,0|2,0,0]=4 7848 B13R1.2879 Cc1cc(ccc1C)OC(=O)NC Amb22274341 [0,2,0,0,0,0|2,0,0]=4 7849 B13R1.2879 Cc1cc(ccc1Cl)NC(=O)CC Amb25034340 [0,2,0,0,0,0|2,0,0]=4 7850 B13R1.2879 Cc1cc(ccc1Cl)NC(=O)NC Amb24666665 [0,2,0,0,0,0|2,0,0]=4 7851 B13R1.2879 Cc1cc(ccc1Cl)NC(=O)OC Amb22450068 [0,2,0,0,0,0|1,0,0]=3 7852 B13R1.2879 Cc1cc(ccc1F)NC(=O)CC Amb24413291 [0,2,0,0,0,0|2,0,0]=4 7853 B13R1.2879 Cc1cc(ccc1F)OC(=O)CC Amb25078875 [0,2,0,0,0,0|2,0,0]=4 7854 B13R1.2879 Cc1cc(ccc1I)NC(=O)CC Amb24674867 [0,2,0,0,0,0|2,0,0]=4 7855 B13R1.2879 Cc1cc(ccc1N)NC(=O)OC Amb18956456 [0,2,0,0,0,0|1,0,0]=3 7856 B13R1.2879 Cc1cc(ccc1O)NC(=O)OC Amb24534097 [0,2,0,0,0,0|1,0,0]=3 7857 B13R1.2879 Cc1cc(ccc1O)OC(=O)CC Amb24494999 [0,2,0,0,0,0|2,0,0]=4 7858 B13R1.2879 Cc1ccc(CC(=O)C=C)cc1Br Amb25322443 [0,2,0,0,0,0|1,0,1]=4 7859 B13R1.2879 Cc1ccc(CC(=O)CBr)cc1S Amb25250475 [0,2,0,0,0,0|2,0,0]=4 7860 B13R1.2879 Cc1ccc(CC(=O)CC)cc1Br Amb25110660 [0,2,0,0,0,0|1,0,0]=3 7861 B13R1.2879 Cc1ccc(CC(=O)CCl)cc1O Amb25248707 [0,2,0,0,0,0|2,0,0]=4 7862 B13R1.2879 Cc1ccc(CC(=O)CCl)cc1S Amb25267981 [0,2,0,0,0,0|2,0,0]=4 7863 B13R1.2879 Cc1ccc(CC(=O)CN)cc1Br Amb25031136 [0,2,0,0,0,0|2,0,0]=4 7864 B13R1.2879 Cc1ccc(CC(=O)NC)cc1Br Amb24335194 [0,2,0,0,0,0|1,0,0]=3 7865 B13R1.2879 Cc1ccc(CC(=O)NC)cc1N Amb25202351 [0,2,0,0,0,0|1,0,0]=3 7866 B13R1.2879 Cc1ccc(CC(=O)NC)cc1O Amb25284039 [0,2,0,0,0,0|1,0,0]=3 7867 B13R1.2879 Cc1ccc(CC(=O)NO)cc1Br Amb25818358 [0,2,0,0,0,0|2,0,0]=4 7868 B13R1.2879 Cc1ccc(CC(=O)OC)[n]c1F Amb25208714 [0,2,0,0,0,0|1,0,0]=3 7869 B13R1.2879 Cc1ccc(CC(=O)OC)[n]c1O Amb24756871 [0,2,0,0,0,0|1,0,0]=3 7870 B13R1.2879 Cc1ccc(CC(=O)OC)cc1Br Amb25137333 [0,2,0,0,0,0|0,0,0]=2 7871 B13R1.2879 Cc1ccc(CC(=O)OC)cc1F Amb21964588 [0,2,0,0,0,0|0,0,0]=2 7872 B13R1.2879 Cc1ccc(CC(=O)OC)cc1I Amb25155251 [0,2,0,0,0,0|0,0,0]=2 7873 B13R1.2879 Cc1ccc(CC(=O)OC)cc1O Amb24725274 [0,2,0,0,0,0|0,0,0]=2 7874 B13R1.2879 Cc1ccc(CS(=O)CC)cc1Br Amb24721182 [0,2,0,0,0,0|2,0,0]=4 7875 B13R1.2879 Cc1ccc(cc1Br)NC(=O)CC Amb25834924 [0,2,0,0,0,0|2,0,0]=4 7876 B13R1.2879 Cc1ccc(cc1Cl)OC(=O)NC Amb25731851 [0,2,0,0,0,0|2,0,0]=4 7877 B13R1.2879 Cc1ccc(cc1F)NC(=O)NC Amb25819773 [0,2,0,0,0,0|2,0,0]=4 7878 B13R1.2879 Cc1ccc(cc1F)OC(=O)CC Amb25851957 [0,2,0,0,0,0|2,0,0]=4 7879 B13R1.2879 Cc1ccc(cc1F)OC(=O)OC Amb25350850 [0,2,0,0,0,0|1,0,0]=3 7880 B13R1.2879 Cc1ccc(cc1I)NC(=O)NC Amb25257878 [0,2,0,0,0,0|2,0,0]=4 7881 B13R1.2879 Cc1ccc(cc1N)OC(=O)NC Amb25086978 [0,2,0,0,0,0|2,0,0]=4 7882 B13R1.2879 Cc1ccc(cc1N)OC(=O)OC Amb24551162 [0,2,0,0,0,0|1,0,0]=3 7883 B13R1.2879 NCC(=O)Cc1cc(Cl)c(Cl)cc1 Amb25314998 [0,2,0,0,0,0|2,0,0]=4 7884 B13R1.2879 NCC(=O)Cc1cc(F)c(Cl)cc1 Amb18177064 [0,2,0,0,0,0|2,0,0]=4 7885 B13R1.2879 NCC(=O)Cc1cc(F)c(F)cc1 Amb18252889 [0,2,0,0,0,0|2,0,0]=4 7886 B13R1.2879 NNC(=O)Cc1cc(F)c(F)cc1 Amb19944603 [0,2,0,0,0,0|2,0,0]=4 7887 B13R1.2879 NNC(=O)Cc1ccc(c(c1)C)C Amb1827139 [0,2,0,0,0,0|2,0,0]=4 7888 B13R1.2879 NNC(=O)Cc1ccc(c(c1)N)O Amb10975355 [0,2,0,0,0,0|2,0,0]=4 7889 B13R1.2879 Nc1cc(CC(=O)CBr)ccc1Cl Amb24664628 [0,2,0,0,0,0|2,0,0]=4 7890 B13R1.2879 Nc1cc(CC(=O)CBr)ccc1O Amb24696676 [0,2,0,0,0,0|2,0,0]=4 7891 B13R1.2879 Nc1cc(CC(=O)CCl)ccc1F Amb24679158 [0,2,0,0,0,0|2,0,0]=4 7892 B13R1.2879 Nc1cc(CC(=O)CCl)ccc1N Amb25352069 [0,2,0,0,0,0|2,0,0]=4 7893 B13R1.2879 Nc1ccc(CC(=O)CBr)cc1F Amb25238793 [0,2,0,0,0,0|2,0,0]=4 7894 B13R1.2879 Nc1ccc(CC(=O)CBr)cc1I Amb24656711 [0,2,0,0,0,0|2,0,0]=4 7895 B13R1.2879 Nc1ccc(CC(=O)CBr)cc1O Amb25248650 [0,2,0,0,0,0|2,0,0]=4 7896 B13R1.2879 Nc1ccc(CC(=O)CBr)cc1S Amb24537086 [0,2,0,0,0,0|2,0,0]=4 7897 B13R1.2879 Nc1ccc(CC(=O)CCl)cc1Cl Amb24743959 [0,2,0,0,0,0|2,0,0]=4 7898 B13R1.2879 O=C(CBr)Cc1cc(F)c(F)cc1 Amb25062120 [0,2,0,0,0,0|2,0,0]=4 7899 B13R1.2879 O=C(CBr)Cc1cc(S)c(S)cc1 Amb24708299 [0,2,0,0,0,0|2,0,0]=4 7900 B13R1.2879 O=C(CCl)Cc1cc(Br)c(F)cc1 Amb25243488 [0,2,0,0,0,0|2,0,0]=4 7901 B13R1.2879 O=C(CCl)Cc1cc(F)c(F)cc1 Amb20673441 [0,2,0,0,0,0|2,0,0]=4 7902 B13R1.2879 O=C(CCl)Cc1ccc(I)c(S)c1 Amb24561246 [0,2,0,0,0,0|2,0,0]=4 7903 B13R1.2879 O=C(Cc1cc(Br)c(Br)cc1)CBr Amb24756783 [0,2,0,0,0,0|2,0,0]=4 7904 B13R1.2879 O=C(Cc1cc(Br)c(F)cc1)CBr Amb25247583 [0,2,0,0,0,0|2,0,0]=4 7905 B13R1.2879 O=C(Cc1cc(Cl)c(I)cc1)CCl Amb25268023 [0,2,0,0,0,0|2,0,0]=4 7906 B13R1.2879 O=C(Cc1ccc(Cl)c(Br)c1)CCl Amb24566530 [0,2,0,0,0,0|2,0,0]=4 7907 B13R1.2879 O=C(Cc1ccc(Cl)c(S)c1)CBr Amb24697056 [0,2,0,0,0,0|2,0,0]=4 7908 B13R1.2879 O=C(Cc1ccc(Cl)c(S)c1)CCl Amb25239074 [0,2,0,0,0,0|2,0,0]=4 7909 B13R1.2879 O=C(Cc1ccc(S)c(Cl)c1)CBr Amb25239467 [0,2,0,0,0,0|2,0,0]=4 7910 B13R1.2879 OCC(=O)Cc1cc(Cl)c(Cl)cc1 Amb18067435 [0,2,0,0,0,0|2,0,0]=4 7911 B13R1.2879 ONC(=O)Cc1cc(Cl)c(Cl)cc1 Amb25789732 [0,2,0,0,0,0|2,0,0]=4 7912 B13R1.2879 ONC(=O)Cc1ccc(F)c(Br)c1 Amb25084048 [0,2,0,0,0,0|2,0,0]=4 7913 B13R1.2879 Oc1cc(CC(=O)CBr)ccc1F Amb24603941 [0,2,0,0,0,0|2,0,0]=4 7914 B13R1.2879 Oc1cc(CC(=O)CBr)ccc1I Amb24527870 [0,2,0,0,0,0|2,0,0]=4 7915 B13R1.2879 Oc1cc(CC(=O)CBr)ccc1S Amb24758162 [0,2,0,0,0,0|2,0,0]=4 7916 B13R1.2879 Oc1cc(CC(=O)CCl)ccc1O Amb25270372 [0,2,0,0,0,0|2,0,0]=4 7917 B13R1.2879 Oc1ccc(CC(=O)CCl)cc1Br Amb25365273 [0,2,0,0,0,0|2,0,0]=4 7918 B13R1.2879 Oc1ccc(CC(=O)CCl)cc1I Amb24603456 [0,2,0,0,0,0|2,0,0]=4 7919 B13R1.2879 Oc1ccc(CC(=O)CCl)cc1S Amb25278635 [0,2,0,0,0,0|2,0,0]=4 7920 B13R1.2879 Oc1ccc(CC(=O)NO)cc1F Amb24520654 [0,2,0,0,0,0|2,0,0]=4 7921 B13R1.40 C=CC(=O)Cc1cccc(F)c1Br Amb25726031 [0,2,0,0,0,0|1,0,1]=4 7922 B13R1.40 CC1=CC=CN(CC(=O)NC)C1=O Amb18378092 [0,2,0,0,0,0|2,0,0]=4 7923 B13R1.40 CC1=CC=CN(CC(=O)OC)C1=O Amb18405598 [0,2,0,0,0,0|1,0,0]=3 7924 B13R1.40 CCC(=O)Cc1cccc(F)c1Br Amb24444695 [0,2,0,0,0,0|1,0,0]=3 7925 B13R1.40 CCC(=O)Cc1cccc(F)c1F Amb18326241 [0,2,0,0,0,0|1,0,0]=3 7926 B13R1.40 CCC(=O)Cc1cccc(c1Cl)Cl Amb17477634 [0,2,0,0,0,0|1,0,0]=3 7927 B13R1.40 CCC(=O)Nc1cccc(Cl)c1Br Amb24468486 [0,2,0,0,0,0|2,0,0]=4 7928 B13R1.40 CCC(=O)Nc1cccc(Cl)c1F Amb25319052 [0,2,0,0,0,0|2,0,0]=4 7929 B13R1.40 CCC(=O)Nc1cccc(Cl)c1O Amb24724852 [0,2,0,0,0,0|2,0,0]=4 7930 B13R1.40 CCC(=O)Nc1cccc(F)c1Cl Amb25822162 [0,2,0,0,0,0|2,0,0]=4 7931 B13R1.40 CCC(=O)Nc1cccc(F)c1F Amb25821616 [0,2,0,0,0,0|2,0,0]=4 7932 B13R1.40 CCC(=O)Nc1cccc(F)c1I Amb24590593 [0,2,0,0,0,0|2,0,0]=4 7933 B13R1.40 CCC(=O)Nc1cccc(O)c1F Amb25681278 [0,2,0,0,0,0|2,0,0]=4 7934 B13R1.40 CCC(=O)Oc1cccc(Cl)c1F Amb25295917 [0,2,0,0,0,0|2,0,0]=4 7935 B13R1.40 CCC(=O)Oc1cccc(F)c1F Amb25689145 [0,2,0,0,0,0|2,0,0]=4 7936 B13R1.40 CCC(=O)Oc1cccc(F)c1I Amb25344506 [0,2,0,0,0,0|2,0,0]=4 7937 B13R1.40 CCS(=O)Cc1cccc(Cl)c1Cl Amb25833995 [0,2,0,0,0,0|2,0,0]=4 7938 B13R1.40 CCS(=O)Cc1cccc(N)c1F Amb25287841 [0,2,0,0,0,0|2,0,0]=4 7939 B13R1.40 CN(Cc1cccc(Cl)c1F)OC Amb24529779 [0,2,0,0,0,0|2,0,0]=4 7940 B13R1.40 CN(Cc1cccc(N)c1Br)OC Amb24459500 [0,2,0,0,0,0|2,0,0]=4 7941 B13R1.40 CNC(=N)Cc1cccc(Cl)c1F Amb25221752 [0,2,0,0,0,0|2,0,0]=4 7942 B13R1.40 CNC(=O)CN1C=CC=C(N)C1=O Amb18958850 [0,2,0,0,0,0|2,0,0]=4 7943 B13R1.40 CNC(=O)Cc1cc[n]c(O)c1Br Amb24465873 [0,2,0,0,0,0|2,0,0]=4 7944 B13R1.40 CNC(=O)Cc1cccc(O)c1F Amb24705255 [0,2,0,0,0,0|1,0,0]=3 7945 B13R1.40 CNC(=O)Nc1cccc(C)c1C Amb22346485 [0,2,0,0,0,0|2,0,0]=4 7946 B13R1.40 CNC(=O)Nc1cccc(Cl)c1Br Amb25670785 [0,2,0,0,0,0|2,0,0]=4 7947 B13R1.40 CNC(=O)Nc1cccc(F)c1I Amb25701240 [0,2,0,0,0,0|2,0,0]=4 7948 B13R1.40 CNC(=O)Nc1cccc(c1F)Cl Amb11316926 [0,2,0,0,0,0|2,0,0]=4 7949 B13R1.40 COC(=N)Cc1cccc(Cl)c1F Amb24731239 [0,2,0,0,0,0|1,0,0]=3 7950 B13R1.40 COC(=O)CN1C=CC=C(Br)C1=O Amb24644409 [0,2,0,0,0,0|1,0,0]=3 7951 B13R1.40 COC(=O)CN1C=CC=C(N)C1=O Amb18986293 [0,2,0,0,0,0|1,0,0]=3 7952 B13R1.40 COC(=O)CN1C=NC=C(Br)C1=O Amb25383347 [0,2,0,0,0,0|2,0,0]=4 7953 B13R1.40 COC(=O)Cc1[n]c[n]c(Cl)c1Cl Amb24695658 [0,2,0,0,0,0|2,0,0]=4 7954 B13R1.40 COC(=O)Cc1[n]ccc(Br)c1Cl Amb24527908 [0,2,0,0,0,0|1,0,0]=3 7955 B13R1.40 COC(=O)Cc1[n]ccc(Br)c1N Amb25122879 [0,2,0,0,0,0|1,0,0]=3 7956 B13R1.40 COC(=O)Cc1[n]ccc(I)c1F Amb24743790 [0,2,0,0,0,0|1,0,0]=3 7957 B13R1.40 COC(=O)Cc1c[n]cc(Br)c1Br Amb25239190 [0,2,0,0,0,0|1,0,0]=3 7958 B13R1.40 COC(=O)Cc1c[n]cc(Br)c1Cl Amb24652728 [0,2,0,0,0,0|1,0,0]=3 7959 B13R1.40 COC(=O)Cc1c[n]cc(Br)c1F Amb25253019 [0,2,0,0,0,0|1,0,0]=3 7960 B13R1.40 COC(=O)Cc1c[n]cc(F)c1I Amb24637271 [0,2,0,0,0,0|1,0,0]=3 7961 B13R1.40 COC(=O)Cc1c[n]cc(O)c1Br Amb24381612 [0,2,0,0,0,0|1,0,0]=3 7962 B13R1.40 COC(=O)Cc1cc[n]c(Br)c1F Amb25276849 [0,2,0,0,0,0|1,0,0]=3 7963 B13R1.40 COC(=O)Cc1cc[n]c(Br)c1N Amb24708123 [0,2,0,0,0,0|1,0,0]=3 7964 B13R1.40 COC(=O)Cc1cc[n]c(Br)c1O Amb24441711 [0,2,0,0,0,0|1,0,0]=3 7965 B13R1.40 COC(=O)Cc1cc[n]c(Cl)c1O Amb24652975 [0,2,0,0,0,0|1,0,0]=3 7966 B13R1.40 COC(=O)Cc1cc[n]c(I)c1F Amb24651222 [0,2,0,0,0,0|1,0,0]=3 7967 B13R1.40 COC(=O)Cc1cc[n]c(O)c1Br Amb24510278 [0,2,0,0,0,0|1,0,0]=3 7968 B13R1.40 COC(=O)Cc1cccc(Br)c1Cl Amb25055320 [0,2,0,0,0,0|0,0,0]=2 7969 B13R1.40 COC(=O)Cc1cccc(Br)c1N Amb24666607 [0,2,0,0,0,0|0,0,0]=2 7970 B13R1.40 COC(=O)Cc1cccc(Br)c1O Amb25364129 [0,2,0,0,0,0|0,0,0]=2 7971 B13R1.40 COC(=O)Cc1cccc(Cl)c1I Amb24556960 [0,2,0,0,0,0|0,0,0]=2 7972 B13R1.40 COC(=O)Cc1cccc(Cl)c1O Amb25732505 [0,2,0,0,0,0|0,0,0]=2 7973 B13R1.40 COC(=O)Cc1cccc(F)c1Br Amb24701120 [0,2,0,0,0,0|0,0,0]=2 7974 B13R1.40 COC(=O)Cc1cccc(F)c1F Amb22831318 [0,2,0,0,0,0|0,0,0]=2 7975 B13R1.40 COC(=O)Cc1cccc(I)c1Cl Amb25800202 [0,2,0,0,0,0|0,0,0]=2 7976 B13R1.40 COC(=O)Cc1cccc(I)c1F Amb24488725 [0,2,0,0,0,0|0,0,0]=2 7977 B13R1.40 COC(=O)Cc1cccc(I)c1N Amb25732972 [0,2,0,0,0,0|0,0,0]=2 7978 B13R1.40 COC(=O)Cc1cccc(N)c1I Amb25289302 [0,2,0,0,0,0|0,0,0]=2 7979 B13R1.40 COC(=O)Cc1cccc(O)c1Br Amb25667810 [0,2,0,0,0,0|0,0,0]=2 7980 B13R1.40 COC(=O)Cc1cccc(O)c1F Amb25189992 [0,2,0,0,0,0|0,0,0]=2 7981 B13R1.40 COC(=O)Cc1cccc(c1Br)Cl Amb10603555 [0,2,0,0,0,0|0,0,0]=2 7982 B13R1.40 COC(=O)Nc1cccc(Cl)c1Br Amb25363620 [0,2,0,0,0,0|1,0,0]=3 7983 B13R1.40 COC(=O)Nc1cccc(N)c1Cl Amb24427796 [0,2,0,0,0,0|1,0,0]=3 7984 B13R1.40 COC(=O)Oc1cccc(C)c1C Amb25092689 [0,2,0,0,0,0|1,0,0]=3 7985 B13R1.40 COC(=O)Oc1cccc(N)c1Br Amb25066601 [0,2,0,0,0,0|1,0,0]=3 7986 B13R1.40 COC(=O)Oc1cccc(O)c1N Amb25187013 [0,2,0,0,0,0|1,0,0]=3 7987 B13R1.40 COC(=O)Oc1cccc(O)c1O Amb24582515 [0,2,0,0,0,0|1,0,0]=3 7988 B13R1.40 CON(C)Cc1cccc(Cl)c1Cl Amb25080726 [0,2,0,0,0,0|2,0,0]=4 7989 B13R1.40 CON(C)Cc1cccc(F)c1F Amb24457652 [0,2,0,0,0,0|2,0,0]=4 7990 B13R1.40 Cc1[n]c[n]c(CC(=O)OC)c1O Amb24579202 [0,2,0,0,0,0|2,0,0]=4 7991 B13R1.40 Cc1[n]ccc(CC(=O)OC)c1Cl Amb24400584 [0,2,0,0,0,0|1,0,0]=3 7992 B13R1.40 Cc1[n]ccc(CC(=O)OC)c1F Amb24639236 [0,2,0,0,0,0|1,0,0]=3 7993 B13R1.40 Cc1[n]ccc(NC(=O)OC)c1C Amb24404865 [0,2,0,0,0,0|2,0,0]=4 7994 B13R1.40 Cc1c(Br)cccc1CC(=O)NO Amb24720584 [0,2,0,0,0,0|2,0,0]=4 7995 B13R1.40 Cc1c(Br)cccc1CS(=O)CC Amb25837658 [0,2,0,0,0,0|2,0,0]=4 7996 B13R1.40 Cc1c(Br)cccc1NC(=O)NC Amb25721746 [0,2,0,0,0,0|2,0,0]=4 7997 B13R1.40 Cc1c(CC(=O)CBr)cccc1I Amb25209563 [0,2,0,0,0,0|2,0,0]=4 7998 B13R1.40 Cc1c(Cl)cc[n]c1CC(=O)OC Amb25331438 [0,2,0,0,0,0|1,0,0]=3 7999 B13R1.40 Cc1c(F)cccc1CC(=O)OC Amb24543672 [0,2,0,0,0,0|0,0,0]=2 8000 B13R1.40 Cc1c(F)cccc1NC(=O)CC Amb25712359 [0,2,0,0,0,0|2,0,0]=4 8001 B13R1.40 Cc1c(F)cccc1NC(=O)NC Amb25257003 [0,2,0,0,0,0|2,0,0]=4 8002 B13R1.40 Cc1c(I)cccc1NC(=O)CC Amb24601731 [0,2,0,0,0,0|2,0,0]=4 8003 B13R1.40 Cc1c(I)cccc1NC(=O)NC Amb25362957 [0,2,0,0,0,0|2,0,0]=4 8004 B13R1.40 Cc1c(I)cccc1NC(=O)OC Amb25310887 [0,2,0,0,0,0|1,0,0]=3 8005 B13R1.40 Cc1c(N)cc[n]c1CC(=O)OC Amb24656720 [0,2,0,0,0,0|1,0,0]=3 8006 B13R1.40 Cc1c(N)cccc1CC(=O)CCl Amb24536934 [0,2,0,0,0,0|2,0,0]=4 8007 B13R1.40 Cc1c(N)cccc1CC(=O)OC Amb25759375 [0,2,0,0,0,0|0,0,0]=2 8008 B13R1.40 Cc1c(N)cccc1CS(=O)CC Amb18290935 [0,2,0,0,0,0|2,0,0]=4 8009 B13R1.40 Cc1c(N)cccc1OC(=O)NC Amb25859615 [0,2,0,0,0,0|2,0,0]=4 8010 B13R1.40 Cc1c(NC(=O)CC)cccc1N Amb1114129 [0,2,0,0,0,0|2,0,0]=4 8011 B13R1.40 Cc1c(O)[n]ccc1CC(=O)OC Amb25208664 [0,2,0,0,0,0|1,0,0]=3 8012 B13R1.40 Cc1c(O)cccc1CC(=O)CCl Amb24541072 [0,2,0,0,0,0|2,0,0]=4 8013 B13R1.40 Cc1c(O)cccc1OC(=O)CC Amb24662281 [0,2,0,0,0,0|2,0,0]=4 8014 B13R1.40 Cc1c[n]cc(CC(=O)OC)c1Cl Amb24406727 [0,2,0,0,0,0|1,0,0]=3 8015 B13R1.40 Cc1c[n]cc(CC(=O)OC)c1O Amb25268560 [0,2,0,0,0,0|1,0,0]=3 8016 B13R1.40 Cc1cc[n]c(CC(=O)OC)c1Br Amb25243502 [0,2,0,0,0,0|1,0,0]=3 8017 B13R1.40 Cc1cc[n]c(CC(=O)OC)c1F Amb24708351 [0,2,0,0,0,0|1,0,0]=3 8018 B13R1.40 Cc1cc[n]c(CC(=O)OC)c1O Amb24651280 [0,2,0,0,0,0|1,0,0]=3 8019 B13R1.40 Cc1cccc(CC(=O)CBr)c1Br Amb24651251 [0,2,0,0,0,0|2,0,0]=4 8020 B13R1.40 Cc1cccc(CC(=O)CBr)c1Cl Amb24664753 [0,2,0,0,0,0|2,0,0]=4 8021 B13R1.40 Cc1cccc(CC(=O)CBr)c1F Amb25268005 [0,2,0,0,0,0|2,0,0]=4 8022 B13R1.40 Cc1cccc(CC(=O)CBr)c1S Amb25238007 [0,2,0,0,0,0|2,0,0]=4 8023 B13R1.40 Cc1cccc(CC(=O)CCl)c1I Amb25238026 [0,2,0,0,0,0|2,0,0]=4 8024 B13R1.40 Cc1cccc(CC(=O)CCl)c1N Amb24536933 [0,2,0,0,0,0|2,0,0]=4 8025 B13R1.40 Cc1cccc(CC(=O)NC)c1Cl Amb25235503 [0,2,0,0,0,0|1,0,0]=3 8026 B13R1.40 Cc1cccc(CC(=O)NN)c1Br Amb25687865 [0,2,0,0,0,0|2,0,0]=4 8027 B13R1.40 Cc1cccc(CC(=O)NO)c1Cl Amb24390022 [0,2,0,0,0,0|2,0,0]=4 8028 B13R1.40 Cc1cccc(CC(=O)OC)c1Br Amb25040084 [0,2,0,0,0,0|0,0,0]=2 8029 B13R1.40 Cc1cccc(CC(=O)OC)c1C Amb24074155 [0,2,0,0,0,0|0,0,0]=2 8030 B13R1.40 Cc1cccc(CC(=O)OC)c1F Amb24623078 [0,2,0,0,0,0|0,0,0]=2 8031 B13R1.40 Cc1cccc(CC(=O)OC)c1O Amb24415356 [0,2,0,0,0,0|0,0,0]=2 8032 B13R1.40 Cc1cccc(NC(=O)CC)c1Cl Amb25328222 [0,2,0,0,0,0|2,0,0]=4 8033 B13R1.40 Cc1cccc(NC(=O)CC)c1O Amb24706505 [0,2,0,0,0,0|2,0,0]=4 8034 B13R1.40 Cc1cccc(NC(=O)NC)c1Br Amb24572120 [0,2,0,0,0,0|2,0,0]=4 8035 B13R1.40 Cc1cccc(NC(=O)NC)c1F Amb24649647 [0,2,0,0,0,0|2,0,0]=4 8036 B13R1.40 Cc1cccc(NC(=O)OC)c1Cl Amb25765396 [0,2,0,0,0,0|1,0,0]=3 8037 B13R1.40 Cc1cccc(NC(=O)OC)c1O Amb24352085 [0,2,0,0,0,0|1,0,0]=3 8038 B13R1.40 Cc1cccc(OC(=O)CC)c1Cl Amb24502786 [0,2,0,0,0,0|2,0,0]=4 8039 B13R1.40 Cc1cccc(OC(=O)CC)c1F Amb25345604 [0,2,0,0,0,0|2,0,0]=4 8040 B13R1.40 Cc1cccc(OC(=O)NC)c1C Amb24725268 [0,2,0,0,0,0|2,0,0]=4 8041 B13R1.40 Cc1cccc(OC(=O)OC)c1N Amb25735987 [0,2,0,0,0,0|1,0,0]=3 8042 B13R1.40 NCC(=O)Cc1cccc(Cl)c1F Amb25038906 [0,2,0,0,0,0|2,0,0]=4 8043 B13R1.40 NCC(=O)Cc1cccc(F)c1Cl Amb25378396 [0,2,0,0,0,0|2,0,0]=4 8044 B13R1.40 NCC(=O)Cc1cccc(F)c1F Amb24698235 [0,2,0,0,0,0|2,0,0]=4 8045 B13R1.40 NNC(=O)Cc1cccc(Cl)c1Cl Amb25842366 [0,2,0,0,0,0|2,0,0]=4 8046 B13R1.40 NNC(=O)Cc1cccc(F)c1F Amb24489431 [0,2,0,0,0,0|2,0,0]=4 8047 B13R1.40 Nc1c(CC(=O)CBr)cccc1I Amb24628342 [0,2,0,0,0,0|2,0,0]=4 8048 B13R1.40 Nc1c(O)cccc1CC(=O)CBr Amb24537052 [0,2,0,0,0,0|2,0,0]=4 8049 B13R1.40 Nc1c(O)cccc1CC(=O)CCl Amb24579153 [0,2,0,0,0,0|2,0,0]=4 8050 B13R1.40 Nc1cccc(CC(=O)CBr)c1F Amb25351858 [0,2,0,0,0,0|2,0,0]=4 8051 B13R1.40 Nc1cccc(CC(=O)CCl)c1Cl Amb24756986 [0,2,0,0,0,0|2,0,0]=4 8052 B13R1.40 Nc1cccc(CC(=O)CCl)c1N Amb24743771 [0,2,0,0,0,0|2,0,0]=4 8053 B13R1.40 Nc1cccc(CC(=O)CCl)c1S Amb24727398 [0,2,0,0,0,0|2,0,0]=4 8054 B13R1.40 O=C(CBr)Cc1cccc(Cl)c1Cl Amb24695636 [0,2,0,0,0,0|2,0,0]=4 8055 B13R1.40 O=C(CBr)Cc1cccc(F)c1I Amb24712665 [0,2,0,0,0,0|2,0,0]=4 8056 B13R1.40 O=C(CBr)Cc1cccc(I)c1F Amb24605304 [0,2,0,0,0,0|2,0,0]=4 8057 B13R1.40 O=C(CBr)Cc1cccc(I)c1S Amb25209534 [0,2,0,0,0,0|2,0,0]=4 8058 B13R1.40 O=C(CCl)Cc1cccc(Br)c1F Amb24663655 [0,2,0,0,0,0|2,0,0]=4 8059 B13R1.40 O=C(CCl)Cc1cccc(F)c1F Amb25670352 [0,2,0,0,0,0|2,0,0]=4 8060 B13R1.40 O=C(CCl)Cc1cccc(F)c1I Amb24571923 [0,2,0,0,0,0|2,0,0]=4 8061 B13R1.40 O=C(Cc1cccc(Cl)c1Br)CCl Amb24536989 [0,2,0,0,0,0|2,0,0]=4 8062 B13R1.40 O=C(Cc1cccc(Cl)c1F)CBr Amb25217431 [0,2,0,0,0,0|2,0,0]=4 8063 B13R1.40 O=C(Cc1cccc(Cl)c1S)CCl Amb24727744 [0,2,0,0,0,0|2,0,0]=4 8064 B13R1.40 O=C(Cc1cccc(F)c1S)CBr Amb25249972 [0,2,0,0,0,0|2,0,0]=4 8065 B13R1.40 O=C(Cc1cccc(S)c1Br)CBr Amb24596724 [0,2,0,0,0,0|2,0,0]=4 8066 B13R1.40 OCC(=O)Cc1cccc(F)c1F Amb24682409 [0,2,0,0,0,0|2,0,0]=4 8067 B13R1.40 ONC(=O)Cc1cccc(F)c1F Amb25035488 [0,2,0,0,0,0|2,0,0]=4 8068 B13R1.40 Oc1c(CC(=O)CCl)cccc1Br Amb24638280 [0,2,0,0,0,0|2,0,0]=4 8069 B13R1.40 Oc1c(CC(=O)CCl)cccc1I Amb24527883 [0,2,0,0,0,0|2,0,0]=4 8070 B13R1.40 Oc1c(S)cccc1CC(=O)CBr Amb25209309 [0,2,0,0,0,0|2,0,0]=4 8071 B13R1.40 Oc1c(S)cccc1CC(=O)CCl Amb24574993 [0,2,0,0,0,0|2,0,0]=4 8072 B13R1.40 Oc1cccc(CC(=O)CBr)c1I Amb25338414 [0,2,0,0,0,0|2,0,0]=4 8073 B13R1.40 Oc1cccc(CC(=O)CCl)c1Cl Amb24628097 [0,2,0,0,0,0|2,0,0]=4 8074 B13R1.40 Oc1cccc(CC(=O)CCl)c1S Amb24574994 [0,2,0,0,0,0|2,0,0]=4 8075 B13R1.81 CCC(=O)Cc1cccc(c1)OC Amb17477455 [0,2,0,0,0,0|1,0,0]=3 8076 B13R1.81 CCC(=O)Nc1cc(CCl)ccc1 Amb25755071 [0,2,0,0,0,0|2,0,0]=4 8077 B13R1.81 CCC(=O)Nc1cc(CO)ccc1 Amb18186321 [0,2,0,0,0,0|2,0,0]=4 8078 B13R1.81 CCC(=O)Nc1cc(ccc1)C=O Amb24643712 [0,2,0,0,0,0|2,0,0]=4 8079 B13R1.81 CCC(=O)Nc1cccc(CC)c1 Amb17860502 [0,2,0,0,0,0|2,0,0]=4 8080 B13R1.81 CCC(=O)Nc1cccc(c1)CN Amb1114853 [0,2,0,0,0,0|2,0,0]=4 8081 B13R1.81 CCC(=O)Oc1cc(CCl)ccc1 Amb20667901 [0,2,0,0,0,0|2,0,0]=4 8082 B13R1.81 CCC(=O)Oc1cc(ccc1)C#N Amb25710411 [0,2,0,0,0,0|2,0,0]=4 8083 B13R1.81 CCC(=O)Oc1cccc(c1)CC Amb10807493 [0,2,0,0,0,0|2,0,0]=4 8084 B13R1.81 CCS(=O)Cc1cc(ccc1)C#N Amb25683092 [0,2,0,0,0,0|2,0,0]=4 8085 B13R1.81 CCc1cc(CC(=O)NC)ccc1 Amb24343103 [0,2,0,0,0,0|1,0,0]=3 8086 B13R1.81 CCc1cccc(NC(=O)OC)c1 Amb17790835 [0,2,0,0,0,0|1,0,0]=3 8087 B13R1.81 CNC(=O)Cc1cc(ccc1)C#N Amb25845851 [0,2,0,0,0,0|1,0,0]=3 8088 B13R1.81 CNC(=O)Cc1cccc(c1)OC Amb13957949 [0,2,0,0,0,0|1,0,0]=3 8089 B13R1.81 CNC(=O)Nc1cc(C=O)ccc1 Amb25324506 [0,2,0,0,0,0|2,0,0]=4 8090 B13R1.81 CNC(=O)Nc1cc(CBr)ccc1 Amb22499049 [0,2,0,0,0,0|2,0,0]=4 8091 B13R1.81 CNC(=O)Nc1cc(CO)ccc1 Amb25801283 [0,2,0,0,0,0|2,0,0]=4 8092 B13R1.81 CNC(=O)Nc1cc(ccc1)C#N Amb25123002 [0,2,0,0,0,0|2,0,0]=4 8093 B13R1.81 CNC(=O)Nc1cc(ccc1)SC Amb25072602 [0,2,0,0,0,0|2,0,0]=4 8094 B13R1.81 CNC(=O)Oc1cc(ccc1)C#N Amb25733059 [0,2,0,0,0,0|2,0,0]=4 8095 B13R1.81 CNC(=O)Oc1cc(ccc1)C=O Amb25835638 [0,2,0,0,0,0|2,0,0]=4 8096 B13R1.81 CNC(=O)Oc1cccc(CCl)c1 Amb24366000 [0,2,0,0,0,0|2,0,0]=4 8097 B13R1.81 CNC(=O)Oc1cccc(CN)c1 Amb25311874 [0,2,0,0,0,0|2,0,0]=4 8098 B13R1.81 CNC(=O)Oc1cccc(CO)c1 Amb25270063 [0,2,0,0,0,0|2,0,0]=4 8099 B13R1.81 CNc1[n]c(CC(=O)OC)cc[n]1 Amb25668587 [0,2,0,0,0,0|2,0,0]=4 8100 B13R1.81 CNc1cc(ccc1)NC(=O)OC Amb18303184 [0,2,0,0,0,0|1,0,0]=3 8101 B13R1.81 CNc1cccc(CC(=O)OC)[n]1 Amb25157339 [0,2,0,0,0,0|1,0,0]=3 8102 B13R1.81 CNc1cccc(CC(=O)OC)c1 Amb24468290 [0,2,0,0,0,0|0,0,0]=2 8103 B13R1.81 COC(=O)C[n+]1cccc(c1)CF Amb2228083 [0,2,0,0,0,0|1,0,0]=3 8104 B13R1.81 COC(=O)Cc1cc(C#C)[n]cc1 Amb24415355 [0,2,0,0,0,0|1,0,0]=3 8105 B13R1.81 COC(=O)Cc1cc(CBr)ccc1 Amb22284359 [0,2,0,0,0,0|0,0,0]=2 8106 B13R1.81 COC(=O)Cc1cc([n]c[n]1)SC Amb22495961 [0,2,0,0,0,0|2,0,0]=4 8107 B13R1.81 COC(=O)Cc1cc(ccc1)C=O Amb22753101 [0,2,0,0,0,0|0,0,0]=2 8108 B13R1.81 COC(=O)Cc1cccc(C#N)[n]1 Amb24692604 [0,2,0,0,0,0|1,0,0]=3 8109 B13R1.81 COC(=O)Nc1cc(cc[n]1)OC Amb24510060 [0,2,0,0,0,0|2,0,0]=4 8110 B13R1.81 COC(=O)Nc1cc(ccc1)C#C Amb18178163 [0,2,0,0,0,0|1,0,0]=3 8111 B13R1.81 COC(=O)Nc1cc(ccc1)C=O Amb25073148 [0,2,0,0,0,0|1,0,0]=3 8112 B13R1.81 COC(=O)Nc1cccc(CO)[n]1 Amb25372679 [0,2,0,0,0,0|2,0,0]=4 8113 B13R1.81 COC(=O)Nc1cccc(CO)c1 Amb18796407 [0,2,0,0,0,0|1,0,0]=3 8114 B13R1.81 COC(=O)Nc1cccc(c1)SC Amb2441162 [0,2,0,0,0,0|1,0,0]=3 8115 B13R1.81 COc1cc(CC(=O)CO)ccc1 Amb18065905 [0,2,0,0,0,0|2,0,0]=4 8116 B13R1.81 COc1cc(cc[n]1)NC(=O)OC Amb25087536 [0,2,0,0,0,0|2,0,0]=4 8117 B13R1.81 COc1cccc(CC(=O)C#C)c1 Amb24680602 [0,2,0,0,0,0|1,0,1]=4 8118 B13R1.81 COc1cccc(CC(=O)CBr)c1 Amb20621487 [0,2,0,0,0,0|2,0,0]=4 8119 B13R1.81 CSC(=O)Nc1cc(ccc1)C#N Amb22486983 [0,2,0,0,0,0|1,1,0]=4 8120 B13R1.81 ClCC(=O)Cc1cccc(c1)OC Amb17139727 [0,2,0,0,0,0|2,0,0]=4 8121 B13R1.146 CC\C(=C/c1cccc(c1)Br)\C=O Amb17347961 [0,2,0,0,0,0|1,0,1]=4 8122 B13R1.146 CC\C(=C/c1cccc(c1)C)\C=O Amb17334990 [0,2,0,0,0,0|1,0,1]=4 8123 B13R1.146 CC\C(=C/c1cccc(c1)Cl)\C=O Amb17336898 [0,2,0,0,0,0|1,0,1]=4 8124 B13R1.146 CC\C(=C/c1cccc(c1)O)\C=O Amb17335121 [0,2,0,0,0,0|1,0,1]=4 8125 B13R1.146 CC\C(\C=O)=C\c1cccc(Br)c1 Amb25204038 [0,2,0,0,0,0|1,0,1]=4 8126 B13R1.146 CC\C(\C=O)=C\c1cccc(Cl)c1 Amb24489764 [0,2,0,0,0,0|1,0,1]=4 8127 B13R1.146 CNC(Cc1cc(Cl)ccc1)=NN Amb19083272 [0,2,0,0,0,0|2,0,0]=4 8128 B13R1.146 CN\C(\Cc1cc(F)ccc1)=N/N Amb18791234 [0,2,0,0,0,0|2,0,0]=4 8129 B13R1.146 COC(Cc1cccc(Cl)c1)OC Amb19373689 [0,2,0,0,0,0|0,0,2]=4 8130 B13R1.146 COC(Cc1cccc(F)c1)OC Amb19329171 [0,2,0,0,0,0|0,0,2]=4 8131 B13R1.146 Cc1cc(CC(NC)=NN)ccc1 Amb18184220 [0,2,0,0,0,0|2,0,0]=4 8132 B13R1.146 Cc1cc(\C=C(\CC)/C=O)ccc1 Amb25180750 [0,2,0,0,0,0|1,0,1]=4 8133 B13R1.250 CNS(=O)(=O)Cc1cccc(Br)c1 Amb25687206 [0,2,0,0,0,0|2,0,0]=4 8134 B13R1.250 CNS(=O)(=O)Cc1cccc(F)c1 Amb22301450 [0,2,0,0,0,0|2,0,0]=4 8135 B13R1.250 CNS(=O)(=O)Cc1cccc(I)c1 Amb24596034 [0,2,0,0,0,0|2,0,0]=4 8136 B13R1.250 Cc1cccc(CS(=O)(=O)CC)c1 Amb24474858 [0,2,0,0,0,0|2,0,0]=4 8137 B13R1.2872 C=CC(=O)Cc1cc(Cl)ccc1Cl Amb25753360 [0,2,0,0,0,0|1,0,1]=4 8138 B13R1.2872 C=CC(=O)Cc1cc(Cl)ccc1F Amb24496370 [0,2,0,0,0,0|1,0,1]=4 8139 B13R1.2872 C=CC(=O)Cc1cc(F)ccc1Cl Amb25703512 [0,2,0,0,0,0|1,0,1]=4 8140 B13R1.2872 C=CC(=O)Cc1cc(F)ccc1F Amb25805553 [0,2,0,0,0,0|1,0,1]=4 8141 B13R1.2872 CC=1C=CC(=O)N(CC(=O)NC)C1 Amb18404912 [0,2,0,0,0,0|2,0,0]=4 8142 B13R1.2872 CC=1C=CC(=O)N(CC(=O)OC)C1 Amb18404864 [0,2,0,0,0,0|1,0,0]=3 8143 B13R1.2872 CC=1C=CC(=O)N(CC(=O)OC)N1 Amb18179254 [0,2,0,0,0,0|2,0,0]=4 8144 B13R1.2872 CC=1C=NC(=O)N(CC(=O)OC)C1 Amb24748927 [0,2,0,0,0,0|2,0,0]=4 8145 B13R1.2872 CCC(=O)CN1C=C(Br)C=CC1=O Amb24588012 [0,2,0,0,0,0|2,0,0]=4 8146 B13R1.2872 CCC(=O)CN1C=C(F)C=CC1=O Amb25348926 [0,2,0,0,0,0|2,0,0]=4 8147 B13R1.2872 CCC(=O)Cc1cc(C)ccc1C Amb18795832 [0,2,0,0,0,0|1,0,0]=3 8148 B13R1.2872 CCC(=O)Cc1cc(Cl)ccc1Cl Amb24661706 [0,2,0,0,0,0|1,0,0]=3 8149 B13R1.2872 CCC(=O)Cc1cc(Cl)ccc1F Amb25052474 [0,2,0,0,0,0|1,0,0]=3 8150 B13R1.2872 CCC(=O)Cc1cc(F)ccc1F Amb18326239 [0,2,0,0,0,0|1,0,0]=3 8151 B13R1.2872 CCC(=O)NC1=CC(=O)C=CC1=O Amb24072108 [0,2,0,0,0,0|2,0,0]=4 8152 B13R1.2872 CCC(=O)Nc1cc(Br)ccc1Br Amb25815231 [0,2,0,0,0,0|2,0,0]=4 8153 B13R1.2872 CCC(=O)Nc1cc(Br)ccc1Cl Amb25784537 [0,2,0,0,0,0|2,0,0]=4 8154 B13R1.2872 CCC(=O)Nc1cc(Br)ccc1I Amb11191953 [0,2,0,0,0,0|2,0,0]=4 8155 B13R1.2872 CCC(=O)Nc1cc(Br)ccc1O Amb22456038 [0,2,0,0,0,0|2,0,0]=4 8156 B13R1.2872 CCC(=O)Nc1cc(Cl)ccc1Br Amb24558110 [0,2,0,0,0,0|2,0,0]=4 8157 B13R1.2872 CCC(=O)Nc1cc(Cl)ccc1Cl Amb2308547 [0,2,0,0,0,0|2,0,0]=4 8158 B13R1.2872 CCC(=O)Nc1cc(Cl)ccc1N Amb1115193 [0,2,0,0,0,0|2,0,0]=4 8159 B13R1.2872 CCC(=O)Nc1cc(F)ccc1Br Amb25157470 [0,2,0,0,0,0|2,0,0]=4 8160 B13R1.2872 CCC(=O)Nc1cc(F)ccc1Cl Amb24657144 [0,2,0,0,0,0|2,0,0]=4 8161 B13R1.2872 CCC(=O)Nc1cc(F)ccc1O Amb25105676 [0,2,0,0,0,0|2,0,0]=4 8162 B13R1.2872 CCC(=O)Nc1cc(I)ccc1O Amb24688850 [0,2,0,0,0,0|2,0,0]=4 8163 B13R1.2872 CCC(=O)Nc1cc(N)ccc1F Amb1117871 [0,2,0,0,0,0|2,0,0]=4 8164 B13R1.2872 CCC(=O)Nc1cc(N)ccc1O Amb25733403 [0,2,0,0,0,0|2,0,0]=4 8165 B13R1.2872 CCC(=O)Nc1cc(O)ccc1N Amb25841768 [0,2,0,0,0,0|2,0,0]=4 8166 B13R1.2872 CCC(=O)Oc1cc(F)ccc1Cl Amb25345801 [0,2,0,0,0,0|2,0,0]=4 8167 B13R1.2872 CCC(=O)Oc1cc(F)ccc1F Amb25237343 [0,2,0,0,0,0|2,0,0]=4 8168 B13R1.2872 CCC(=O)Oc1cc(O)ccc1Cl Amb24722877 [0,2,0,0,0,0|2,0,0]=4 8169 B13R1.2872 CCS(=O)Cc1cc(Br)ccc1Cl Amb24576439 [0,2,0,0,0,0|2,0,0]=4 8170 B13R1.2872 CCS(=O)Cc1cc(Cl)ccc1Cl Amb24510264 [0,2,0,0,0,0|2,0,0]=4 8171 B13R1.2872 CCS(=O)Cc1cc(F)ccc1F Amb24749516 [0,2,0,0,0,0|2,0,0]=4 8172 B13R1.2872 CCS(=O)Cc1cc(F)ccc1N Amb18974550 [0,2,0,0,0,0|2,0,0]=4 8173 B13R1.2872 CCS(=O)Cc1cc(N)ccc1Cl Amb18290933 [0,2,0,0,0,0|2,0,0]=4 8174 B13R1.2872 CN(Cc1cc(Br)ccc1Cl)OC Amb24719277 [0,2,0,0,0,0|2,0,0]=4 8175 B13R1.2872 CN(Cc1cc(Cl)ccc1Br)OC Amb24705358 [0,2,0,0,0,0|2,0,0]=4 8176 B13R1.2872 CN(Cc1cc(Cl)ccc1N)OC Amb25719693 [0,2,0,0,0,0|2,0,0]=4 8177 B13R1.2872 CN(Cc1cc(F)ccc1Br)OC Amb24335063 [0,2,0,0,0,0|2,0,0]=4 8178 B13R1.2872 CN(Cc1cc(F)ccc1Cl)OC Amb24335044 [0,2,0,0,0,0|2,0,0]=4 8179 B13R1.2872 CN(Cc1cc(N)ccc1Br)OC Amb25161035 [0,2,0,0,0,0|2,0,0]=4 8180 B13R1.2872 CNC(=O)CN1C=C(Br)C=CC1=O Amb18404467 [0,2,0,0,0,0|2,0,0]=4 8181 B13R1.2872 CNC(=O)CN1C=C(Cl)C=CC1=O Amb18405100 [0,2,0,0,0,0|2,0,0]=4 8182 B13R1.2872 CNC(=O)CN1C=C(F)C=CC1=O Amb18405322 [0,2,0,0,0,0|2,0,0]=4 8183 B13R1.2872 CNC(=O)CN1C=C(N)C=CC1=O Amb18030100 [0,2,0,0,0,0|2,0,0]=4 8184 B13R1.2872 CNC(=O)Cc1cc(Br)ccc1F Amb24352769 [0,2,0,0,0,0|1,0,0]=3 8185 B13R1.2872 CNC(=O)Cc1cc(Cl)ccc1O Amb24490055 [0,2,0,0,0,0|1,0,0]=3 8186 B13R1.2872 CNC(=O)Cc1cc(F)ccc1F Amb24352770 [0,2,0,0,0,0|1,0,0]=3 8187 B13R1.2872 CNC(=O)Cc1cc(O)ccc1O Amb18128828 [0,2,0,0,0,0|1,0,0]=3 8188 B13R1.2872 CNC(=O)Nc1cc(Br)ccc1Cl Amb25236441 [0,2,0,0,0,0|2,0,0]=4 8189 B13R1.2872 CNC(=O)Nc1cc(Br)ccc1F Amb25047120 [0,2,0,0,0,0|2,0,0]=4 8190 B13R1.2872 CNC(=O)Nc1cc(Br)ccc1I Amb11551100 [0,2,0,0,0,0|2,0,0]=4 8191 B13R1.2872 CNC(=O)Nc1cc(C)ccc1C Amb22346446 [0,2,0,0,0,0|2,0,0]=4 8192 B13R1.2872 CNC(=O)Nc1cc(C)ccc1F Amb2444099 [0,2,0,0,0,0|2,0,0]=4 8193 B13R1.2872 CNC(=O)Nc1cc(Cl)ccc1F Amb24682780 [0,2,0,0,0,0|2,0,0]=4 8194 B13R1.2872 CNC(=O)Nc1cc(Cl)ccc1O Amb24605052 [0,2,0,0,0,0|2,0,0]=4 8195 B13R1.2872 CNC(=O)Nc1cc(F)ccc1Cl Amb24411762 [0,2,0,0,0,0|2,0,0]=4 8196 B13R1.2872 CNC(=O)Nc1cc(I)ccc1Br Amb24650529 [0,2,0,0,0,0|2,0,0]=4 8197 B13R1.2872 CNC(=O)Nc1cc(N)ccc1Br Amb25307223 [0,2,0,0,0,0|2,0,0]=4 8198 B13R1.2872 CNC(=O)Nc1cc(O)ccc1N Amb24730013 [0,2,0,0,0,0|2,0,0]=4 8199 B13R1.2872 CNC(=O)Oc1cc(N)ccc1Br Amb25346827 [0,2,0,0,0,0|2,0,0]=4 8200 B13R1.2872 CNC(=O)Oc1cc(N)ccc1Cl Amb24442139 [0,2,0,0,0,0|2,0,0]=4 8201 B13R1.2872 COC(=O)CN1C=C(Cl)C=CC1=O Amb18405062 [0,2,0,0,0,0|1,0,0]=3 8202 B13R1.2872 COC(=O)CN1C=C(F)C=CC1=O Amb18405259 [0,2,0,0,0,0|1,0,0]=3 8203 B13R1.2872 COC(=O)CN1C=C(N)C=CC1=O Amb18999389 [0,2,0,0,0,0|1,0,0]=3 8204 B13R1.2872 COC(=O)CN1NC(=O)C=CC1=O Amb18328416 [0,2,0,0,0,0|2,0,0]=4 8205 B13R1.2872 COC(=O)Cc1[n]c(Cl)ccc1F Amb24528377 [0,2,0,0,0,0|1,0,0]=3 8206 B13R1.2872 COC(=O)Cc1[n]c(Cl)ccc1O Amb24528287 [0,2,0,0,0,0|1,0,0]=3 8207 B13R1.2872 COC(=O)Cc1[n]c(F)ccc1Cl Amb24541080 [0,2,0,0,0,0|1,0,0]=3 8208 B13R1.2872 COC(=O)Cc1[n]c(F)ccc1I Amb24696924 [0,2,0,0,0,0|1,0,0]=3 8209 B13R1.2872 COC(=O)Cc1[n]c(N)ccc1Br Amb24501488 [0,2,0,0,0,0|1,0,0]=3 8210 B13R1.2872 COC(=O)Cc1cc(Br)[n]cc1Cl Amb25287476 [0,2,0,0,0,0|1,0,0]=3 8211 B13R1.2872 COC(=O)Cc1cc(Br)[n]cc1N Amb24753281 [0,2,0,0,0,0|1,0,0]=3 8212 B13R1.2872 COC(=O)Cc1cc(Br)c[n]c1N Amb25110754 [0,2,0,0,0,0|1,0,0]=3 8213 B13R1.2872 COC(=O)Cc1cc(Br)c[n]c1O Amb25287612 [0,2,0,0,0,0|1,0,0]=3 8214 B13R1.2872 COC(=O)Cc1cc(Br)ccc1Cl Amb15690934 [0,2,0,0,0,0|0,0,0]=2 8215 B13R1.2872 COC(=O)Cc1cc(Br)ccc1F Amb18940356 [0,2,0,0,0,0|0,0,0]=2 8216 B13R1.2872 COC(=O)Cc1cc(Br)ccc1N Amb25078208 [0,2,0,0,0,0|0,0,0]=2 8217 B13R1.2872 COC(=O)Cc1cc(Br)ccc1O Amb10975878 [0,2,0,0,0,0|0,0,0]=2 8218 B13R1.2872 COC(=O)Cc1cc(Cl)[n]cc1Br Amb25291111 [0,2,0,0,0,0|1,0,0]=3 8219 B13R1.2872 COC(=O)Cc1cc(Cl)[n]cc1F Amb24696751 [0,2,0,0,0,0|1,0,0]=3 8220 B13R1.2872 COC(=O)Cc1cc(Cl)c[n]c1Br Amb25233635 [0,2,0,0,0,0|1,0,0]=3 8221 B13R1.2872 COC(=O)Cc1cc(Cl)c[n]c1O Amb25252971 [0,2,0,0,0,0|1,0,0]=3 8222 B13R1.2872 COC(=O)Cc1cc(Cl)ccc1Br Amb22001696 [0,2,0,0,0,0|0,0,0]=2 8223 B13R1.2872 COC(=O)Cc1cc(Cl)ccc1Cl Amb18275091 [0,2,0,0,0,0|0,0,0]=2 8224 B13R1.2872 COC(=O)Cc1cc(Cl)ccc1F Amb25063102 [0,2,0,0,0,0|0,0,0]=2 8225 B13R1.2872 COC(=O)Cc1cc(Cl)ccc1I Amb24756429 [0,2,0,0,0,0|0,0,0]=2 8226 B13R1.2872 COC(=O)Cc1cc(Cl)ccc1N Amb25794232 [0,2,0,0,0,0|0,0,0]=2 8227 B13R1.2872 COC(=O)Cc1cc(Cl)ccc1O Amb18940934 [0,2,0,0,0,0|0,0,0]=2 8228 B13R1.2872 COC(=O)Cc1cc(F)[n]cc1F Amb25092025 [0,2,0,0,0,0|1,0,0]=3 8229 B13R1.2872 COC(=O)Cc1cc(F)c[n]c1N Amb25247004 [0,2,0,0,0,0|1,0,0]=3 8230 B13R1.2872 COC(=O)Cc1cc(F)ccc1Br Amb24271298 [0,2,0,0,0,0|0,0,0]=2 8231 B13R1.2872 COC(=O)Cc1cc(F)ccc1F Amb18942903 [0,2,0,0,0,0|0,0,0]=2 8232 B13R1.2872 COC(=O)Cc1cc(F)ccc1O Amb18941518 [0,2,0,0,0,0|0,0,0]=2 8233 B13R1.2872 COC(=O)Cc1cc(I)c[n]c1F Amb24638237 [0,2,0,0,0,0|1,0,0]=3 8234 B13R1.2872 COC(=O)Cc1cc(I)ccc1Cl Amb25289304 [0,2,0,0,0,0|0,0,0]=2 8235 B13R1.2872 COC(=O)Cc1cc(I)ccc1N Amb25082628 [0,2,0,0,0,0|0,0,0]=2 8236 B13R1.2872 COC(=O)Cc1cc(N)[n]cc1Br Amb25691066 [0,2,0,0,0,0|1,0,0]=3 8237 B13R1.2872 COC(=O)Cc1cc(N)c[n]c1Br Amb25276795 [0,2,0,0,0,0|1,0,0]=3 8238 B13R1.2872 COC(=O)Cc1cc(N)c[n]c1F Amb24594189 [0,2,0,0,0,0|1,0,0]=3 8239 B13R1.2872 COC(=O)Cc1cc(N)ccc1F Amb25070477 [0,2,0,0,0,0|0,0,0]=2 8240 B13R1.2872 COC(=O)Cc1cc(N)ccc1O Amb25270095 [0,2,0,0,0,0|0,0,0]=2 8241 B13R1.2872 COC(=O)Cc1cc(O)[n]cc1Br Amb25683525 [0,2,0,0,0,0|1,0,0]=3 8242 B13R1.2872 COC(=O)Cc1cc(O)[n]cc1Cl Amb25780213 [0,2,0,0,0,0|1,0,0]=3 8243 B13R1.2872 COC(=O)Cc1cc(O)[n]cc1F Amb25312642 [0,2,0,0,0,0|1,0,0]=3 8244 B13R1.2872 COC(=O)Cc1cc(O)c[n]c1Br Amb24374918 [0,2,0,0,0,0|1,0,0]=3 8245 B13R1.2872 COC(=O)Cc1cc(O)ccc1Br Amb24459707 [0,2,0,0,0,0|0,0,0]=2 8246 B13R1.2872 COC(=O)Cc1cc(O)ccc1O Amb18128971 [0,2,0,0,0,0|0,0,0]=2 8247 B13R1.2872 COC(=O)Nc1cc(Br)ccc1I Amb24415672 [0,2,0,0,0,0|1,0,0]=3 8248 B13R1.2872 COC(=O)Nc1cc(C)ccc1C Amb17737222 [0,2,0,0,0,0|1,0,0]=3 8249 B13R1.2872 COC(=O)Nc1cc(F)ccc1Br Amb25304328 [0,2,0,0,0,0|1,0,0]=3 8250 B13R1.2872 COC(=O)Nc1cc(F)ccc1F Amb24466733 [0,2,0,0,0,0|1,0,0]=3 8251 B13R1.2872 COC(=O)Nc1cc(F)ccc1N Amb25683922 [0,2,0,0,0,0|1,0,0]=3 8252 B13R1.2872 COC(=O)Nc1cc(N)ccc1Br Amb25300214 [0,2,0,0,0,0|1,0,0]=3 8253 B13R1.2872 COC(=O)Nc1cc(O)ccc1F Amb25255742 [0,2,0,0,0,0|1,0,0]=3 8254 B13R1.2872 COC(=O)Oc1cc(Cl)ccc1Cl Amb25717469 [0,2,0,0,0,0|1,0,0]=3 8255 B13R1.2872 COC(=O)Oc1cc(N)ccc1Br Amb24662846 [0,2,0,0,0,0|1,0,0]=3 8256 B13R1.2872 CON(C)Cc1cc(Cl)ccc1Cl Amb24335443 [0,2,0,0,0,0|2,0,0]=4 8257 B13R1.2872 C\C(\Cc1cc(F)ccc1O)=C/C Amb25034267 [0,2,0,0,0,0|2,0,0]=4 8258 B13R1.2872 Cc1c[n]c(N)cc1CC(=O)OC Amb24638253 [0,2,0,0,0,0|1,0,0]=3 8259 B13R1.2872 Cc1cc(CC(=N)OC)c(C)cc1 Amb18065711 [0,2,0,0,0,0|1,0,0]=3 8260 B13R1.2872 Cc1cc(CC(=O)C=C)c(C)cc1 Amb24360292 [0,2,0,0,0,0|1,0,1]=4 8261 B13R1.2872 Cc1cc(CC(=O)CBr)c(Cl)cc1 Amb25364305 [0,2,0,0,0,0|2,0,0]=4 8262 B13R1.2872 Cc1cc(CC(=O)CBr)c(N)cc1 Amb24727530 [0,2,0,0,0,0|2,0,0]=4 8263 B13R1.2872 Cc1cc(CC(=O)CCl)c(C)cc1 Amb25069075 [0,2,0,0,0,0|2,0,0]=4 8264 B13R1.2872 Cc1cc(CC(=O)CN)c(C)cc1 Amb18252379 [0,2,0,0,0,0|2,0,0]=4 8265 B13R1.2872 Cc1cc(CC(=O)CO)c(C)cc1 Amb18065755 [0,2,0,0,0,0|2,0,0]=4 8266 B13R1.2872 Cc1cc(CC(=O)NO)c(C)cc1 Amb18186346 [0,2,0,0,0,0|2,0,0]=4 8267 B13R1.2872 Cc1cc(CC(=O)OC)c(Br)c[n]1 Amb25350738 [0,2,0,0,0,0|1,0,0]=3 8268 B13R1.2872 Cc1cc(CC(=O)OC)c(C)[n][n]1 Amb23560286 [0,2,0,0,0,0|2,0,0]=4 8269 B13R1.2872 Cc1cc(CC(=O)OC)c(O)c[n]1 Amb24760575 [0,2,0,0,0,0|1,0,0]=3 8270 B13R1.2872 Cc1cc(OC(=O)CC)c(C)cc1 Amb25161175 [0,2,0,0,0,0|2,0,0]=4 8271 B13R1.2872 Cc1ccc(Br)c(CC(=O)OC)[n]1 Amb24720594 [0,2,0,0,0,0|1,0,0]=3 8272 B13R1.2872 Cc1ccc(Br)c(c1)NC(=O)CC Amb24619101 [0,2,0,0,0,0|2,0,0]=4 8273 B13R1.2872 Cc1ccc(Br)c(c1)NC(=O)OC Amb24492011 [0,2,0,0,0,0|1,0,0]=3 8274 B13R1.2872 Cc1ccc(Br)cc1CC(=O)C=C Amb24398227 [0,2,0,0,0,0|1,0,1]=4 8275 B13R1.2872 Cc1ccc(Br)cc1CC(=O)CN Amb24634672 [0,2,0,0,0,0|2,0,0]=4 8276 B13R1.2872 Cc1ccc(Br)cc1CN(C)OC Amb24714038 [0,2,0,0,0,0|2,0,0]=4 8277 B13R1.2872 Cc1ccc(Cl)[n]c1CC(=O)OC Amb24496798 [0,2,0,0,0,0|1,0,0]=3 8278 B13R1.2872 Cc1ccc(Cl)[n]c1NC(=O)OC Amb25786214 [0,2,0,0,0,0|2,0,0]=4 8279 B13R1.2872 Cc1ccc(Cl)c(c1)NC(=O)OC Amb25782782 [0,2,0,0,0,0|1,0,0]=3 8280 B13R1.2872 Cc1ccc(Cl)c(c1)OC(=O)OC Amb25133968 [0,2,0,0,0,0|1,0,0]=3 8281 B13R1.2872 Cc1ccc(Cl)cc1OC(=O)CC Amb25344686 [0,2,0,0,0,0|2,0,0]=4 8282 B13R1.2872 Cc1ccc(F)c(CC(=O)OC)c1 Amb25720968 [0,2,0,0,0,0|0,0,0]=2 8283 B13R1.2872 Cc1ccc(F)cc1CC(=O)CBr Amb25248693 [0,2,0,0,0,0|2,0,0]=4 8284 B13R1.2872 Cc1ccc(F)cc1CC(=O)CN Amb24357664 [0,2,0,0,0,0|2,0,0]=4 8285 B13R1.2872 Cc1ccc(I)c(CC(=O)OC)c1 Amb25180600 [0,2,0,0,0,0|0,0,0]=2 8286 B13R1.2872 Cc1ccc(I)c(c1)OC(=O)CC Amb24354216 [0,2,0,0,0,0|2,0,0]=4 8287 B13R1.2872 Cc1ccc(I)cc1CC(=O)CCl Amb24567246 [0,2,0,0,0,0|2,0,0]=4 8288 B13R1.2872 Cc1ccc(I)cc1CC(=O)OC Amb22495484 [0,2,0,0,0,0|0,0,0]=2 8289 B13R1.2872 Cc1ccc(N)c(CC(=O)NC)c1 Amb22913642 [0,2,0,0,0,0|1,0,0]=3 8290 B13R1.2872 Cc1ccc(N)c(CC(=O)OC)c1 Amb22913628 [0,2,0,0,0,0|0,0,0]=2 8291 B13R1.2872 Cc1ccc(N)c(c1)OC(=O)OC Amb24416859 [0,2,0,0,0,0|1,0,0]=3 8292 B13R1.2872 Cc1ccc(N)cc1CC(=O)CCl Amb24697002 [0,2,0,0,0,0|2,0,0]=4 8293 B13R1.2872 Cc1ccc(N)cc1OC(=O)OC Amb24470772 [0,2,0,0,0,0|1,0,0]=3 8294 B13R1.2872 Cc1ccc(O)c(CC(=O)OC)c1 Amb18274454 [0,2,0,0,0,0|0,0,0]=2 8295 B13R1.2872 Cc1ccc(O)c(c1)NC(=O)NC Amb24510110 [0,2,0,0,0,0|2,0,0]=4 8296 B13R1.2872 Cc1ccc(O)c(c1)NC(=O)OC Amb25378996 [0,2,0,0,0,0|1,0,0]=3 8297 B13R1.2872 Cc1ccc(O)cc1CC(=O)CBr Amb25270403 [0,2,0,0,0,0|2,0,0]=4 8298 B13R1.2872 Cc1ccc(cc1CC(=O)NN)C Amb1921792 [0,2,0,0,0,0|2,0,0]=4 8299 B13R1.2872 Cc1ccc(cc1NC(=O)CC)N Amb1117358 [0,2,0,0,0,0|2,0,0]=4 8300 B13R1.2872 Cc1ccc(cc1NC(=O)NC)Br Amb11400931 [0,2,0,0,0,0|2,0,0]=4 8301 B13R1.2872 NCC(=O)Cc1cc(Br)ccc1Cl Amb25326730 [0,2,0,0,0,0|2,0,0]=4 8302 B13R1.2872 NCC(=O)Cc1cc(Cl)ccc1Br Amb25713945 [0,2,0,0,0,0|2,0,0]=4 8303 B13R1.2872 NCC(=O)Cc1cc(Cl)ccc1Cl Amb24671036 [0,2,0,0,0,0|2,0,0]=4 8304 B13R1.2872 NCC(=O)Cc1cc(Cl)ccc1F Amb25778320 [0,2,0,0,0,0|2,0,0]=4 8305 B13R1.2872 NCC(=O)Cc1cc(F)ccc1Cl Amb18177063 [0,2,0,0,0,0|2,0,0]=4 8306 B13R1.2872 NCC(=O)Cc1cc(F)ccc1F Amb18252891 [0,2,0,0,0,0|2,0,0]=4 8307 B13R1.2872 Nc1cc(CC(=O)CBr)c(F)cc1 Amb24656468 [0,2,0,0,0,0|2,0,0]=4 8308 B13R1.2872 Nc1cc(CC(=O)CBr)c(N)cc1 Amb24743769 [0,2,0,0,0,0|2,0,0]=4 8309 B13R1.2872 Nc1ccc(F)cc1CC(=O)NN Amb22756102 [0,2,0,0,0,0|2,0,0]=4 8310 B13R1.2872 Nc1ccc(O)cc1CC(=O)CBr Amb24537054 [0,2,0,0,0,0|2,0,0]=4 8311 B13R1.2872 Nc1ccc(S)cc1CC(=O)CBr Amb24537084 [0,2,0,0,0,0|2,0,0]=4 8312 B13R1.2872 O=C(CBr)Cc1cc(Cl)ccc1I Amb25376275 [0,2,0,0,0,0|2,0,0]=4 8313 B13R1.2872 O=C(CBr)Cc1cc(F)ccc1F Amb24549378 [0,2,0,0,0,0|2,0,0]=4 8314 B13R1.2872 O=C(CBr)Cc1cc(I)ccc1F Amb25209321 [0,2,0,0,0,0|2,0,0]=4 8315 B13R1.2872 O=C(CCl)Cc1cc(F)ccc1I Amb24575007 [0,2,0,0,0,0|2,0,0]=4 8316 B13R1.2872 O=C(CCl)Cc1cc(I)ccc1F Amb25224741 [0,2,0,0,0,0|2,0,0]=4 8317 B13R1.2872 O=C(Cc1cc(Br)ccc1Cl)CBr Amb24536987 [0,2,0,0,0,0|2,0,0]=4 8318 B13R1.2872 O=C(Cc1cc(Br)ccc1Cl)CCl Amb24536992 [0,2,0,0,0,0|2,0,0]=4 8319 B13R1.2872 O=C(Cc1cc(Cl)ccc1Br)CCl Amb24536991 [0,2,0,0,0,0|2,0,0]=4 8320 B13R1.2872 O=C(Cc1cc(F)ccc1Cl)CBr Amb24695639 [0,2,0,0,0,0|2,0,0]=4 8321 B13R1.2872 O=C(Cc1cc(I)ccc1Br)CBr Amb24541293 [0,2,0,0,0,0|2,0,0]=4 8322 B13R1.2872 O=C(Cc1cc(S)ccc1Br)CBr Amb25301592 [0,2,0,0,0,0|2,0,0]=4 8323 B13R1.2872 O=C(Cc1cc(S)ccc1F)CBr Amb24578902 [0,2,0,0,0,0|2,0,0]=4 8324 B13R1.2872 ONC(=O)Cc1cc(Cl)ccc1Cl Amb25122507 [0,2,0,0,0,0|2,0,0]=4 8325 B13R1.2872 ONC(=O)Cc1cc(F)ccc1F Amb25072118 [0,2,0,0,0,0|2,0,0]=4 8326 B13R1.2872 Oc1cc(CC(=O)CBr)c(S)cc1 Amb24561245 [0,2,0,0,0,0|2,0,0]=4 8327 B13R1.2872 Oc1cc(CC(=O)CCl)c(F)cc1 Amb24656453 [0,2,0,0,0,0|2,0,0]=4 8328 B13R1.2872 Oc1ccc(Br)c(CC(=O)CBr)c1 Amb25208752 [0,2,0,0,0,0|2,0,0]=4 8329 B13R1.2872 Oc1ccc(F)cc1CC(=O)CBr Amb24605691 [0,2,0,0,0,0|2,0,0]=4 8330 B13R1.2872 Oc1ccc(I)c(CC(=O)CBr)c1 Amb24623678 [0,2,0,0,0,0|2,0,0]=4 8331 B13R1.2872 Oc1ccc(I)cc1CC(=O)CBr Amb24603455 [0,2,0,0,0,0|2,0,0]=4 8332 B13R1.2874 C#CC(=O)Cc1cc(F)cc(F)c1 Amb24446763 [0,2,0,0,0,0|1,0,1]=4 8333 B13R1.2874 CC=1NC(=O)C=C(CC(=O)OC)N1 Amb21962007 [0,2,0,0,0,0|2,0,0]=4 8334 B13R1.2874 CCC(=O)Cc1cc(Br)cc(F)c1 Amb24369124 [0,2,0,0,0,0|1,0,0]=3 8335 B13R1.2874 CCC(=O)Cc1cc(C)cc(C)c1 Amb18180613 [0,2,0,0,0,0|1,0,0]=3 8336 B13R1.2874 CCC(=O)Cc1cc(F)cc(F)c1 Amb18322781 [0,2,0,0,0,0|1,0,0]=3 8337 B13R1.2874 CCC(=O)Nc1cc(C)cc(c1)Br Amb16981795 [0,2,0,0,0,0|2,0,0]=4 8338 B13R1.2874 CCC(=O)Nc1cc(Cl)cc(Br)c1 Amb25165530 [0,2,0,0,0,0|2,0,0]=4 8339 B13R1.2874 CCC(=O)Nc1cc(I)cc(I)c1 Amb24403615 [0,2,0,0,0,0|2,0,0]=4 8340 B13R1.2874 CCC(=O)Nc1cc(N)cc(N)c1 Amb23571440 [0,2,0,0,0,0|2,0,0]=4 8341 B13R1.2874 CCC(=O)Oc1cc(Cl)cc(Cl)c1 Amb24689158 [0,2,0,0,0,0|2,0,0]=4 8342 B13R1.2874 CCC(=O)Oc1cc(F)cc(F)c1 Amb24431472 [0,2,0,0,0,0|2,0,0]=4 8343 B13R1.2874 CCC(=O)Oc1cc(F)cc(I)c1 Amb25037102 [0,2,0,0,0,0|2,0,0]=4 8344 B13R1.2874 CCS(=O)Cc1cc(F)cc(N)c1 Amb25264260 [0,2,0,0,0,0|2,0,0]=4 8345 B13R1.2874 CNC(=N)Cc1cc(C)cc(C)c1 Amb24629026 [0,2,0,0,0,0|2,0,0]=4 8346 B13R1.2874 CNC(=O)Nc1cc(Cl)cc(F)c1 Amb25157326 [0,2,0,0,0,0|2,0,0]=4 8347 B13R1.2874 CNC(=O)Nc1cc(Cl)cc(c1)Cl Amb11258985 [0,2,0,0,0,0|2,0,0]=4 8348 B13R1.2874 CNC(=O)Nc1cc(F)cc(F)c1 Amb24691343 [0,2,0,0,0,0|2,0,0]=4 8349 B13R1.2874 CNC(=O)Nc1cc(F)cc(N)c1 Amb24467184 [0,2,0,0,0,0|2,0,0]=4 8350 B13R1.2874 CNC(=O)Nc1cc(I)cc(I)c1 Amb25706659 [0,2,0,0,0,0|2,0,0]=4 8351 B13R1.2874 CNC(=O)Oc1cc(C)cc(C)c1 Amb22274542 [0,2,0,0,0,0|2,0,0]=4 8352 B13R1.2874 CNC(=O)Oc1cc(N)cc(Br)c1 Amb25233864 [0,2,0,0,0,0|2,0,0]=4 8353 B13R1.2874 COC(=N)Cc1cc(C)cc(C)c1 Amb18184181 [0,2,0,0,0,0|1,0,0]=3 8354 B13R1.2874 COC(=N)Cc1cc(Cl)cc(Cl)c1 Amb24760795 [0,2,0,0,0,0|1,0,0]=3 8355 B13R1.2874 COC(=N)Cc1cc(F)cc(F)c1 Amb19057849 [0,2,0,0,0,0|1,0,0]=3 8356 B13R1.2874 COC(=O)CC1=CC(=O)N=C(N)S1 Amb24418470 [0,2,0,0,0,0|2,0,0]=4 8357 B13R1.2874 COC(=O)CC1=CC(=O)NC(=S)N1 Amb19394295 [0,2,0,0,0,0|2,0,0]=4 8358 B13R1.2874 COC(=O)CC1=CC(=O)NC(N)=N1 Amb20093613 [0,2,0,0,0,0|2,0,0]=4 8359 B13R1.2874 COC(=O)CC1=CC(=O)NC(S)=N1 Amb20636097 [0,2,0,0,0,0|2,0,0]=4 8360 B13R1.2874 COC(=O)CC=1C=C(Br)NC(=O)C1 Amb19133083 [0,2,0,0,0,0|1,0,0]=3 8361 B13R1.2874 COC(=O)Cc1cc(Br)cc(Cl)[n]1 Amb24527907 [0,2,0,0,0,0|1,0,0]=3 8362 B13R1.2874 COC(=O)Cc1cc(Br)cc(N)[n]1 Amb25686100 [0,2,0,0,0,0|1,0,0]=3 8363 B13R1.2874 COC(=O)Cc1cc(Br)cc(O)[n]1 Amb25110313 [0,2,0,0,0,0|1,0,0]=3 8364 B13R1.2874 COC(=O)Cc1cc(C)[n]c(C)c1 Amb23441229 [0,2,0,0,0,0|1,0,0]=3 8365 B13R1.2874 COC(=O)Cc1cc(C)cc(C)c1 Amb24439859 [0,2,0,0,0,0|0,0,0]=2 8366 B13R1.2874 COC(=O)Cc1cc(Cl)[nH]c(=O)c1 Amb24063793 [0,2,0,0,0,0|1,0,0]=3 8367 B13R1.2874 COC(=O)Cc1cc(Cl)[n]c(Cl)[n]1 Amb22756261 [0,2,0,0,0,0|2,0,0]=4 8368 B13R1.2874 COC(=O)Cc1cc(Cl)[n]c(N)[n]1 Amb25785601 [0,2,0,0,0,0|2,0,0]=4 8369 B13R1.2874 COC(=O)Cc1cc(Cl)cc(Br)[n]1 Amb24564498 [0,2,0,0,0,0|1,0,0]=3 8370 B13R1.2874 COC(=O)Cc1cc(Cl)cc(F)[n]1 Amb24696752 [0,2,0,0,0,0|1,0,0]=3 8371 B13R1.2874 COC(=O)Cc1cc(Cl)cc(O)[n]1 Amb25269869 [0,2,0,0,0,0|1,0,0]=3 8372 B13R1.2874 COC(=O)Cc1cc(F)[n]c(Cl)c1 Amb25248722 [0,2,0,0,0,0|1,0,0]=3 8373 B13R1.2874 COC(=O)Cc1cc(F)cc(Br)c1 Amb24099080 [0,2,0,0,0,0|0,0,0]=2 8374 B13R1.2874 COC(=O)Cc1cc(F)cc(Cl)[n]1 Amb24528373 [0,2,0,0,0,0|1,0,0]=3 8375 B13R1.2874 COC(=O)Cc1cc(F)cc(Cl)c1 Amb25312085 [0,2,0,0,0,0|0,0,0]=2 8376 B13R1.2874 COC(=O)Cc1cc(F)cc(F)c1 Amb19944609 [0,2,0,0,0,0|0,0,0]=2 8377 B13R1.2874 COC(=O)Cc1cc(F)cc(I)[n]1 Amb25364336 [0,2,0,0,0,0|1,0,0]=3 8378 B13R1.2874 COC(=O)Cc1cc(F)cc(I)c1 Amb24637764 [0,2,0,0,0,0|0,0,0]=2 8379 B13R1.2874 COC(=O)Cc1cc(I)cc(F)[n]1 Amb25208608 [0,2,0,0,0,0|1,0,0]=3 8380 B13R1.2874 COC(=O)Cc1cc(N)[n]c(Br)c1 Amb25800142 [0,2,0,0,0,0|1,0,0]=3 8381 B13R1.2874 COC(=O)Cc1cc(N)cc(Cl)c1 Amb25830480 [0,2,0,0,0,0|0,0,0]=2 8382 B13R1.2874 COC(=O)Cc1cc(N)cc(F)c1 Amb24393503 [0,2,0,0,0,0|0,0,0]=2 8383 B13R1.2874 COC(=O)Cc1cc(N)cc(I)c1 Amb25155463 [0,2,0,0,0,0|0,0,0]=2 8384 B13R1.2874 COC(=O)Cc1cc(N)cc(O)c1 Amb25316084 [0,2,0,0,0,0|0,0,0]=2 8385 B13R1.2874 COC(=O)Cc1cc(O)cc(Br)c1 Amb25800166 [0,2,0,0,0,0|0,0,0]=2 8386 B13R1.2874 COC(=O)Cc1cc(O)cc(Cl)c1 Amb25252637 [0,2,0,0,0,0|0,0,0]=2 8387 B13R1.2874 COC(=O)NC1=CC(O)=CC(=O)O1 Amb20662225 [0,2,0,0,0,0|2,0,0]=4 8388 B13R1.2874 COC(=O)Nc1cc(C)cc(C)c1 Amb17869861 [0,2,0,0,0,0|1,0,0]=3 8389 B13R1.2874 COC(=O)Nc1cc(C)cc(c1)Br Amb16981830 [0,2,0,0,0,0|1,0,0]=3 8390 B13R1.2874 COC(=O)Nc1cc(F)cc(Br)c1 Amb24510043 [0,2,0,0,0,0|1,0,0]=3 8391 B13R1.2874 COC(=O)Nc1cc(F)cc(F)c1 Amb22487812 [0,2,0,0,0,0|1,0,0]=3 8392 B13R1.2874 COC(=O)Nc1cc(I)cc(I)c1 Amb24388262 [0,2,0,0,0,0|1,0,0]=3 8393 B13R1.2874 COC(=O)Oc1cc(Cl)cc(Cl)c1 Amb24631787 [0,2,0,0,0,0|1,0,0]=3 8394 B13R1.2874 CON(C)Cc1cc(C)cc(C)c1 Amb24335442 [0,2,0,0,0,0|2,0,0]=4 8395 B13R1.2874 CON(C)Cc1cc(F)cc(Br)c1 Amb25356872 [0,2,0,0,0,0|2,0,0]=4 8396 B13R1.2874 CON(C)Cc1cc(F)cc(F)c1 Amb25135921 [0,2,0,0,0,0|2,0,0]=4 8397 B13R1.2874 CON(C)Cc1cc(N)cc(Br)c1 Amb24439371 [0,2,0,0,0,0|2,0,0]=4 8398 B13R1.2874 CON(C)Cc1cc(N)cc(Cl)c1 Amb24689951 [0,2,0,0,0,0|2,0,0]=4 8399 B13R1.2874 Cc1[n]c(CC(=O)OC)cc(O)[n]1 Amb20240834 [0,2,0,0,0,0|2,0,0]=4 8400 B13R1.2874 Cc1cc(Br)cc(CC(=O)OC)[n]1 Amb25195143 [0,2,0,0,0,0|1,0,0]=3 8401 B13R1.2874 Cc1cc(CC(=O)C#C)cc(C)c1 Amb25340294 [0,2,0,0,0,0|1,0,1]=4 8402 B13R1.2874 Cc1cc(CC(=O)C=C)cc(C)c1 Amb25113698 [0,2,0,0,0,0|1,0,1]=4 8403 B13R1.2874 Cc1cc(CC(=O)CBr)cc(S)c1 Amb25207334 [0,2,0,0,0,0|2,0,0]=4 8404 B13R1.2874 Cc1cc(CC(=O)CN)cc(C)c1 Amb18195908 [0,2,0,0,0,0|2,0,0]=4 8405 B13R1.2874 Cc1cc(CC(=O)OC)[n]c(C)c1 Amb22750288 [0,2,0,0,0,0|1,0,0]=3 8406 B13R1.2874 Cc1cc(CC(=O)OC)[n]c(F)c1 Amb25196041 [0,2,0,0,0,0|1,0,0]=3 8407 B13R1.2874 Cc1cc(CC(=O)OC)cc(Br)[n]1 Amb24610842 [0,2,0,0,0,0|1,0,0]=3 8408 B13R1.2874 Cc1cc(CC(=O)OC)cc(Cl)[n]1 Amb25374072 [0,2,0,0,0,0|1,0,0]=3 8409 B13R1.2874 Cc1cc(CC(=O)OC)cc(Cl)c1 Amb25703910 [0,2,0,0,0,0|0,0,0]=2 8410 B13R1.2874 Cc1cc(CC(=O)OC)cc(O)c1 Amb25363579 [0,2,0,0,0,0|0,0,0]=2 8411 B13R1.2874 Cc1cc(Cl)[n]c(CC(=O)OC)[n]1 Amb25733652 [0,2,0,0,0,0|2,0,0]=4 8412 B13R1.2874 Cc1cc(F)cc(CC(=O)OC)[n]1 Amb25352178 [0,2,0,0,0,0|1,0,0]=3 8413 B13R1.2874 Cc1cc(I)cc(CC(=O)CBr)c1 Amb25247796 [0,2,0,0,0,0|2,0,0]=4 8414 B13R1.2874 Cc1cc(I)cc(CC(=O)CCl)c1 Amb24567245 [0,2,0,0,0,0|2,0,0]=4 8415 B13R1.2874 Cc1cc(O)[n]c(CC(=O)OC)[n]1 Amb25298619 [0,2,0,0,0,0|2,0,0]=4 8416 B13R1.2874 Cc1cc(cc(Br)c1)NC(=O)NC Amb25793761 [0,2,0,0,0,0|2,0,0]=4 8417 B13R1.2874 Cc1cc(cc(F)c1)NC(=O)CC Amb25191914 [0,2,0,0,0,0|2,0,0]=4 8418 B13R1.2874 Cc1cc(cc(F)c1)NC(=O)NC Amb25131042 [0,2,0,0,0,0|2,0,0]=4 8419 B13R1.2874 Cc1cc(cc(I)c1)NC(=O)OC Amb24422090 [0,2,0,0,0,0|1,0,0]=3 8420 B13R1.2874 Cc1cc(cc(N)c1)OC(=O)NC Amb25060641 [0,2,0,0,0,0|2,0,0]=4 8421 B13R1.2874 NCC(=O)Cc1cc(Br)cc(F)c1 Amb25265198 [0,2,0,0,0,0|2,0,0]=4 8422 B13R1.2874 Nc1cc(CC(=O)CBr)cc(Cl)c1 Amb24727420 [0,2,0,0,0,0|2,0,0]=4 8423 B13R1.2874 Nc1cc(CC(=O)CBr)cc(F)c1 Amb25247668 [0,2,0,0,0,0|2,0,0]=4 8424 B13R1.2874 Nc1cc(CC(=O)CBr)cc(N)c1 Amb24541295 [0,2,0,0,0,0|2,0,0]=4 8425 B13R1.2874 Nc1cc(CC(=O)CBr)cc(O)c1 Amb24537055 [0,2,0,0,0,0|2,0,0]=4 8426 B13R1.2874 Nc1cc(Cl)cc(CC(=O)CCl)c1 Amb24574344 [0,2,0,0,0,0|2,0,0]=4 8427 B13R1.2874 O=C(CCl)Cc1cc(F)cc(F)c1 Amb20673440 [0,2,0,0,0,0|2,0,0]=4 8428 B13R1.2874 O=C(CCl)Cc1cc(I)cc(S)c1 Amb25278639 [0,2,0,0,0,0|2,0,0]=4 8429 B13R1.2874 O=C(Cc1cc(Br)cc(Cl)c1)CBr Amb24536986 [0,2,0,0,0,0|2,0,0]=4 8430 B13R1.2874 Oc1cc(CC(=O)CBr)cc(S)c1 Amb24579733 [0,2,0,0,0,0|2,0,0]=4 8431 B13R1.2874 Oc1cc(Cl)cc(CC(=O)CCl)c1 Amb24541065 [0,2,0,0,0,0|2,0,0]=4 8432 B13R1.2874 Oc1cc(I)cc(CC(=O)CCl)c1 Amb24527884 [0,2,0,0,0,0|2,0,0]=4 8433 B13R1.335 CC\C(=C/c1ccccc1C)\C=O Amb17334989 [0,2,0,0,0,0|1,0,1]=4 8434 B13R1.335 CC\C(=C/c1ccccc1Cl)\C=O Amb17336897 [0,2,0,0,0,0|1,0,1]=4 8435 B13R1.335 CC\C(=C/c1ccccc1F)\C=O Amb17335219 [0,2,0,0,0,0|1,0,1]=4 8436 B13R1.335 CC\C(\C=O)=C\c1ccccc1F Amb25209879 [0,2,0,0,0,0|1,0,1]=4 8437 B13R1.335 CN\C(\Cc1ccccc1Cl)=N/N Amb18318337 [0,2,0,0,0,0|2,0,0]=4 8438 B13R1.335 CN\C(\Cc1ccccc1F)=N/N Amb18791235 [0,2,0,0,0,0|2,0,0]=4 8439 B13R1.335 COC(Cc1ccccc1F)OC Amb19419528 [0,2,0,0,0,0|0,0,2]=4 8440 B13R1.335 Cc1ccccc1C\C(\C=O)=C/C Amb25669371 [0,2,0,0,0,0|1,0,0]=3 8441 B13R1.335 Cc1ccccc1C\C(\NC)=N\N Amb18790850 [0,2,0,0,0,0|2,0,0]=4 8442 B13R1.335 Cc1ccccc1\C=C(\CC)/C=O Amb24489763 [0,2,0,0,0,0|1,0,1]=4 8443 B13R1.3080 COP(=O)(Cc1ccccc1)OC Amb10604147 [0,2,0,0,0,0|1,0,0]=3 8444 B13R1.275 CCS(=O)(=O)Cc1ccccc1Cl Amb24748013 [0,2,0,0,0,0|2,0,0]=4 8445 B13R1.275 CCS(=O)(=O)Cc1ccccc1F Amb25681201 [0,2,0,0,0,0|2,0,0]=4 8446 B13R1.275 CCS(=O)(=O)Cc1ccccc1O Amb18130701 [0,2,0,0,0,0|2,0,0]=4 8447 B13R1.275 CNS(=O)(=O)Cc1ccccc1I Amb24517070 [0,2,0,0,0,0|2,0,0]=4 8448 B13R1.275 CNS(=O)(=O)Cc1ccccc1N Amb18984816 [0,2,0,0,0,0|2,0,0]=4 8449 B13R1.275 COP(O)(=O)Nc1ccccc1N Amb25678626 [0,2,0,0,0,0|2,0,0]=4 8450 B13R1.275 COP(O)(=O)Nc1ccccc1O Amb24344023 [0,2,0,0,0,0|2,0,0]=4 8451 B13R1.275 Cc1ccccc1CS(=O)(=O)CC Amb24705445 [0,2,0,0,0,0|2,0,0]=4 8452 B13R1.275 Cc1ccccc1CS(=O)(=O)NC Amb22301451 [0,2,0,0,0,0|2,0,0]=4 8453 B13R1.91 CCC(=O)Cc1ccccc1C#N Amb24492652 [0,2,0,0,0,0|1,0,0]=3 8454 B13R1.91 CCC(=O)Nc1ccccc1C#N Amb1672889 [0,2,0,0,0,0|2,0,0]=4 8455 B13R1.91 CCC(=O)Nc1ccccc1C=O Amb24611733 [0,2,0,0,0,0|2,0,0]=4 8456 B13R1.91 CCC(=O)Nc1ccccc1CBr Amb24407753 [0,2,0,0,0,0|2,0,0]=4 8457 B13R1.91 CCC(=O)Nc1ccccc1CN Amb1111778 [0,2,0,0,0,0|2,0,0]=4 8458 B13R1.91 CCC(=O)Oc1ccccc1C#N Amb24121412 [0,2,0,0,0,0|2,0,0]=4 8459 B13R1.91 CCC(=O)Oc1ccccc1C=O Amb17129203 [0,2,0,0,0,0|2,0,0]=4 8460 B13R1.91 CCc1ccccc1NC(=O)OC Amb17797921 [0,2,0,0,0,0|1,0,0]=3 8461 B13R1.91 CNC(=O)Cc1ccccc1C#C Amb24356658 [0,2,0,0,0,0|1,0,0]=3 8462 B13R1.91 CNC(=O)Cc1ccccc1CN Amb24359928 [0,2,0,0,0,0|1,0,0]=3 8463 B13R1.91 CNC(=O)Cc1ccccc1NC Amb18303208 [0,2,0,0,0,0|1,0,0]=3 8464 B13R1.91 CNC(=O)Nc1ccccc1C=O Amb25082846 [0,2,0,0,0,0|2,0,0]=4 8465 B13R1.91 CNC(=O)Nc1ccccc1CN Amb18909100 [0,2,0,0,0,0|2,0,0]=4 8466 B13R1.91 CNC(=O)Nc1ccccc1CO Amb25794726 [0,2,0,0,0,0|2,0,0]=4 8467 B13R1.91 CNC(=O)Oc1ccccc1CO Amb23440453 [0,2,0,0,0,0|2,0,0]=4 8468 B13R1.91 CNC(=O)Oc1ccccc1SC Amb25054788 [0,2,0,0,0,0|2,0,0]=4 8469 B13R1.91 CNc1ccccc1CC(C)OC Amb24489110 [0,2,0,0,0,0|1,0,1]=4 8470 B13R1.91 COC(=O)Cc1c[n]ccc1C#N Amb25129495 [0,2,0,0,0,0|1,0,0]=3 8471 B13R1.91 COC(=O)Cc1cc[n]cc1C#N Amb19958640 [0,2,0,0,0,0|1,0,0]=3 8472 B13R1.91 COC(=O)Cc1ccc[n]c1C#N Amb25794190 [0,2,0,0,0,0|1,0,0]=3 8473 B13R1.91 COC(=O)Cc1ccccc1C#C Amb10603119 [0,2,0,0,0,0|0,0,0]=2 8474 B13R1.91 COC(=O)Cc1ccccc1C=O Amb16233254 [0,2,0,0,0,0|0,0,0]=2 8475 B13R1.91 COC(=O)Cc1ccccc1CBr Amb20621573 [0,2,0,0,0,0|0,0,0]=2 8476 B13R1.91 COC(=O)Cc1ccccc1CO Amb22751847 [0,2,0,0,0,0|0,0,0]=2 8477 B13R1.91 COC(=O)Cc1ccccc1OC Amb2209405 [0,2,0,0,0,0|0,0,0]=2 8478 B13R1.91 COC(=O)Nc1[n]cccc1OC Amb24476322 [0,2,0,0,0,0|2,0,0]=4 8479 B13R1.91 COC(=O)Nc1c[n]ccc1C=O Amb24095877 [0,2,0,0,0,0|2,0,0]=4 8480 B13R1.91 COC(=O)Nc1c[n]ccc1OC Amb25143853 [0,2,0,0,0,0|2,0,0]=4 8481 B13R1.91 COC(=O)Nc1c[n]ccc1SC Amb24448844 [0,2,0,0,0,0|2,0,0]=4 8482 B13R1.91 COC(=O)Nc1ccccc1C#N Amb2125353 [0,2,0,0,0,0|1,0,0]=3 8483 B13R1.91 COC(=O)Nc1ccccc1C=C Amb25270045 [0,2,0,0,0,0|1,0,0]=3 8484 B13R1.91 COC(=O)Nc1ccccc1C=O Amb24095849 [0,2,0,0,0,0|1,0,0]=3 8485 B13R1.91 COC(=O)Nc1ccccc1CN Amb18252542 [0,2,0,0,0,0|1,0,0]=3 8486 B13R1.91 COC(=O)Nc1ccccc1CO Amb18181289 [0,2,0,0,0,0|1,0,0]=3 8487 B13R1.91 COC(=O)Nc1ccccc1OC Amb17788260 [0,2,0,0,0,0|1,0,0]=3 8488 B13R1.91 COC(=O)Nc1ccccc1SC Amb24365704 [0,2,0,0,0,0|1,0,0]=3 8489 B13R1.91 COC(=O)Oc1ccccc1C#N Amb25821094 [0,2,0,0,0,0|1,0,0]=3 8490 B13R1.91 COc1[n]cccc1NC(=O)OC Amb25717516 [0,2,0,0,0,0|2,0,0]=4 8491 B13R1.91 COc1ccccc1CC(=O)CO Amb18065904 [0,2,0,0,0,0|2,0,0]=4 8492 B13R1.91 COc1ccccc1OC(=O)CC Amb24079979 [0,2,0,0,0,0|2,0,0]=4 8493 B13R1.91 CSc1ccccc1CC(=O)NO Amb25807312 [0,2,0,0,0,0|2,0,0]=4 8494 B13R1.91 ClCC(=O)Cc1ccccc1OC Amb17139726 [0,2,0,0,0,0|2,0,0]=4 8495 B13R1.91 N#Cc1ccccc1CC(=O)CO Amb25841432 [0,2,0,0,0,0|2,0,0]=4 8496 B13R1.91 NNC(=O)Cc1ccccc1CO Amb24678666 [0,2,0,0,0,0|2,0,0]=4 8497 B13R1.91 [C-]#[N+]c1ccccc1NC(=O)OC Amb25844394 [0,2,0,0,0,0|1,0,0]=3 8498 B13R1.2878 COC(=O)CC1=CC=CCC1(C)C Amb24605732 [0,2,0,0,0,0|0,0,2]=4 8499 B13R1.4928 C=CC(=O)Cc1c(F)cccc1Cl Amb25155186 [0,2,0,0,0,0|1,0,1]=4 8500 B13R1.4928 CC1=CC=CC(=O)N1CC(=O)CC Amb18186330 [0,2,0,0,0,0|2,0,0]=4 8501 B13R1.4928 CC1=CC=CC(=O)N1CC(=O)NC Amb18402918 [0,2,0,0,0,0|2,0,0]=4 8502 B13R1.4928 CC1=CC=CC(=O)N1CC(=O)OC Amb18181284 [0,2,0,0,0,0|1,0,0]=3 8503 B13R1.4928 CC=1C=CNC(=O)C1CC(=O)OC Amb24461765 [0,2,0,0,0,0|1,0,0]=3 8504 B13R1.4928 CCC(=O)Cc1c(Cl)cccc1Cl Amb17477635 [0,2,0,0,0,0|1,0,0]=3 8505 B13R1.4928 CCC(=O)Cc1c(F)cccc1Cl Amb18320501 [0,2,0,0,0,0|1,0,0]=3 8506 B13R1.4928 CCC(=O)Nc1c(F)cccc1Br Amb25158343 [0,2,0,0,0,0|2,0,0]=4 8507 B13R1.4928 CCC(=O)Nc1c(F)cccc1Cl Amb24513561 [0,2,0,0,0,0|2,0,0]=4 8508 B13R1.4928 CCC(=O)Nc1c(F)cccc1F Amb1933074 [0,2,0,0,0,0|2,0,0]=4 8509 B13R1.4928 CCC(=O)Nc1c(N)cccc1Cl Amb18958786 [0,2,0,0,0,0|2,0,0]=4 8510 B13R1.4928 CCC(=O)Nc1c(O)cccc1F Amb25120467 [0,2,0,0,0,0|2,0,0]=4 8511 B13R1.4928 CCC(=O)Oc1c(F)cccc1F Amb24455677 [0,2,0,0,0,0|2,0,0]=4 8512 B13R1.4928 CCS(=O)Cc1c(N)cccc1Br Amb24428453 [0,2,0,0,0,0|2,0,0]=4 8513 B13R1.4928 CCS(=O)Cc1c(N)cccc1F Amb24715331 [0,2,0,0,0,0|2,0,0]=4 8514 B13R1.4928 CN(Cc1c(F)cccc1Br)OC Amb25295955 [0,2,0,0,0,0|2,0,0]=4 8515 B13R1.4928 CN(Cc1c(F)cccc1Cl)OC Amb25295956 [0,2,0,0,0,0|2,0,0]=4 8516 B13R1.4928 CNC(=N)Cc1c(Cl)cccc1Cl Amb24669780 [0,2,0,0,0,0|2,0,0]=4 8517 B13R1.4928 CNC(=O)CN1C(Cl)=CC=CC1=O Amb25078958 [0,2,0,0,0,0|2,0,0]=4 8518 B13R1.4928 CNC(=O)Cc1c(C)cccc1C Amb25345789 [0,2,0,0,0,0|1,0,0]=3 8519 B13R1.4928 CNC(=O)Cc1c(F)cccc1F Amb25050017 [0,2,0,0,0,0|1,0,0]=3 8520 B13R1.4928 CNC(=O)Nc1c(F)cccc1Cl Amb24412873 [0,2,0,0,0,0|2,0,0]=4 8521 B13R1.4928 CNC(=O)Nc1c(F)cccc1F Amb25107556 [0,2,0,0,0,0|2,0,0]=4 8522 B13R1.4928 CNC(=O)Nc1c(N)cccc1Cl Amb25257010 [0,2,0,0,0,0|2,0,0]=4 8523 B13R1.4928 CNC(=O)Nc1c(N)cccc1O Amb25700907 [0,2,0,0,0,0|2,0,0]=4 8524 B13R1.4928 CNC(=O)Oc1c(N)cccc1Br Amb25066600 [0,2,0,0,0,0|2,0,0]=4 8525 B13R1.4928 COC(=N)Cc1c(Cl)cccc1Cl Amb24411270 [0,2,0,0,0,0|1,0,0]=3 8526 B13R1.4928 COC(=O)CN1C(=O)C=CCC1=O Amb25845870 [0,2,0,0,0,0|1,0,1]=4 8527 B13R1.4928 COC(=O)Cc1c(Br)c[n]cc1Br Amb25040153 [0,2,0,0,0,0|1,0,0]=3 8528 B13R1.4928 COC(=O)Cc1c(Br)cccc1Br Amb23402717 [0,2,0,0,0,0|0,0,0]=2 8529 B13R1.4928 COC(=O)Cc1c(C)[n]c[n]c1C Amb25859216 [0,2,0,0,0,0|2,0,0]=4 8530 B13R1.4928 COC(=O)Cc1c(Cl)[n]c[n]c1Cl Amb19958458 [0,2,0,0,0,0|2,0,0]=4 8531 B13R1.4928 COC(=O)Cc1c(Cl)c[n]cc1Br Amb25269634 [0,2,0,0,0,0|1,0,0]=3 8532 B13R1.4928 COC(=O)Cc1c(Cl)c[n]cc1Cl Amb25223731 [0,2,0,0,0,0|1,0,0]=3 8533 B13R1.4928 COC(=O)Cc1c(Cl)cccc1Br Amb24696483 [0,2,0,0,0,0|0,0,0]=2 8534 B13R1.4928 COC(=O)Cc1c(F)[n]ccc1Cl Amb25238774 [0,2,0,0,0,0|1,0,0]=3 8535 B13R1.4928 COC(=O)Cc1c(F)[n]ccc1F Amb25195658 [0,2,0,0,0,0|1,0,0]=3 8536 B13R1.4928 COC(=O)Cc1c(F)cccc1Br Amb25142151 [0,2,0,0,0,0|0,0,0]=2 8537 B13R1.4928 COC(=O)Cc1c(N)[n]c[n]c1Cl Amb25311901 [0,2,0,0,0,0|2,0,0]=4 8538 B13R1.4928 COC(=O)Cc1c(N)[n]ccc1Br Amb24391805 [0,2,0,0,0,0|1,0,0]=3 8539 B13R1.4928 COC(=O)Cc1c(N)c[n]cc1Br Amb24501479 [0,2,0,0,0,0|1,0,0]=3 8540 B13R1.4928 COC(=O)Cc1c(N)cc[n]c1Br Amb24501480 [0,2,0,0,0,0|1,0,0]=3 8541 B13R1.4928 COC(=O)Cc1c(N)cc[n]c1F Amb25212650 [0,2,0,0,0,0|1,0,0]=3 8542 B13R1.4928 COC(=O)Cc1c(N)cccc1Br Amb25238718 [0,2,0,0,0,0|0,0,0]=2 8543 B13R1.4928 COC(=O)Cc1c(N)cccc1I Amb25706222 [0,2,0,0,0,0|0,0,0]=2 8544 B13R1.4928 COC(=O)Cc1c(N)cccc1N Amb25324621 [0,2,0,0,0,0|0,0,0]=2 8545 B13R1.4928 COC(=O)Cc1c(O)[n]c[n]c1O Amb22235186 [0,2,0,0,0,0|2,0,0]=4 8546 B13R1.4928 COC(=O)Cc1c(O)cc[n]c1Cl Amb25269868 [0,2,0,0,0,0|1,0,0]=3 8547 B13R1.4928 COC(=O)Nc1c(Cl)c[n]cc1Cl Amb22454621 [0,2,0,0,0,0|2,0,0]=4 8548 B13R1.4928 COC(=O)Nc1c(Cl)cccc1Cl Amb17798461 [0,2,0,0,0,0|1,0,0]=3 8549 B13R1.4928 COC(=O)Nc1c(F)cccc1Br Amb24739432 [0,2,0,0,0,0|1,0,0]=3 8550 B13R1.4928 COC(=O)Nc1c(F)cccc1Cl Amb25122648 [0,2,0,0,0,0|1,0,0]=3 8551 B13R1.4928 COC(=O)Nc1c(N)cccc1Cl Amb18958503 [0,2,0,0,0,0|1,0,0]=3 8552 B13R1.4928 COC(=O)Nc1c(N)cccc1O Amb24626577 [0,2,0,0,0,0|1,0,0]=3 8553 B13R1.4928 COC(=O)Nc1c(O)cccc1F Amb25133906 [0,2,0,0,0,0|1,0,0]=3 8554 B13R1.4928 CSC(=O)Nc1c(C)cccc1C Amb25072601 [0,2,0,0,0,0|1,1,0]=4 8555 B13R1.4928 Cc1[n]c[n]c(O)c1CC(=O)OC Amb24698946 [0,2,0,0,0,0|2,0,0]=4 8556 B13R1.4928 Cc1[n]ccc(O)c1CC(=O)OC Amb25365277 [0,2,0,0,0,0|1,0,0]=3 8557 B13R1.4928 Cc1c[n]cc(Br)c1CC(=O)OC Amb25217437 [0,2,0,0,0,0|1,0,0]=3 8558 B13R1.4928 Cc1cccc(Br)c1CC(=O)OC Amb25816822 [0,2,0,0,0,0|0,0,0]=2 8559 B13R1.4928 Cc1cccc(C)c1CC(=O)CBr Amb24615943 [0,2,0,0,0,0|2,0,0]=4 8560 B13R1.4928 Cc1cccc(C)c1CC(=O)CN Amb24763440 [0,2,0,0,0,0|2,0,0]=4 8561 B13R1.4928 Cc1cccc(Cl)c1CC(=O)NC Amb25357045 [0,2,0,0,0,0|1,0,0]=3 8562 B13R1.4928 Cc1cccc(Cl)c1CC(=O)NO Amb25032879 [0,2,0,0,0,0|2,0,0]=4 8563 B13R1.4928 Cc1cccc(Cl)c1NC(=O)NC Amb22346520 [0,2,0,0,0,0|2,0,0]=4 8564 B13R1.4928 Cc1cccc(F)c1NC(=O)NC Amb25155684 [0,2,0,0,0,0|2,0,0]=4 8565 B13R1.4928 Cc1cccc(I)c1CC(=O)CBr Amb25305827 [0,2,0,0,0,0|2,0,0]=4 8566 B13R1.4928 Cc1cccc(I)c1CC(=O)OC Amb24446563 [0,2,0,0,0,0|0,0,0]=2 8567 B13R1.4928 Cc1cccc(N)c1NC(=O)NC Amb24492393 [0,2,0,0,0,0|2,0,0]=4 8568 B13R1.4928 Cc1cccc(N)c1OC(=O)OC Amb24691085 [0,2,0,0,0,0|1,0,0]=3 8569 B13R1.4928 Cc1cccc(O)c1NC(=O)CC Amb25680368 [0,2,0,0,0,0|2,0,0]=4 8570 B13R1.4928 NCC(=O)Cc1c(Cl)cccc1Cl Amb25378417 [0,2,0,0,0,0|2,0,0]=4 8571 B13R1.4928 NCC(=O)Cc1c(F)cccc1Cl Amb18253406 [0,2,0,0,0,0|2,0,0]=4 8572 B13R1.4928 NCC(=O)Cc1c(F)cccc1F Amb18191437 [0,2,0,0,0,0|2,0,0]=4 8573 B13R1.4928 NNC(=O)Cc1c(F)cccc1F Amb19890165 [0,2,0,0,0,0|2,0,0]=4 8574 B13R1.4928 Nc1cccc(Br)c1CC(=O)CCl Amb24743855 [0,2,0,0,0,0|2,0,0]=4 8575 B13R1.4928 Nc1cccc(F)c1CC(=O)CBr Amb25270425 [0,2,0,0,0,0|2,0,0]=4 8576 B13R1.4928 Nc1cccc(N)c1CC(=O)CCl Amb24537170 [0,2,0,0,0,0|2,0,0]=4 8577 B13R1.4928 Nc1cccc(S)c1CC(=O)CCl Amb24537089 [0,2,0,0,0,0|2,0,0]=4 8578 B13R1.4928 O=C(CBr)Cc1c(Cl)cccc1Cl Amb25762074 [0,2,0,0,0,0|2,0,0]=4 8579 B13R1.4928 O=C(CCl)Cc1c(S)cccc1Br Amb24628206 [0,2,0,0,0,0|2,0,0]=4 8580 B13R1.4928 O=C(Cc1c(I)cccc1Cl)CCl Amb24696743 [0,2,0,0,0,0|2,0,0]=4 8581 B13R1.4928 OCC(=O)Cc1c(F)cccc1Cl Amb18566623 [0,2,0,0,0,0|2,0,0]=4 8582 B13R1.4928 Oc1cccc(O)c1CC(=O)CBr Amb24628070 [0,2,0,0,0,0|2,0,0]=4 8583 B11R1.59 COC(=O)[n]1cccc1C=O Amb25060182 [0,0,1,1,0,0|2,0,0]=4 8584 B11R1.59 COC(=O)c1c[nH]cc1C=C Amb25152730 [0,0,1,1,0,0|1,0,1]=4 8585 B11R1.59 COC(=O)c1ccoc1C=C Amb24678164 [0,0,1,1,0,0|1,0,1]=4 8586 B11R1.25 COC(=O)CC[n]1cccc1 Amb18799453 [0,0,1,1,0,0|1,0,1]=4 8587 B11R1.25 COC(=O)CCc1ccc[nH]1 Amb17617751 [0,0,1,1,0,0|1,0,1]=4 8588 B11R1.25 COC(=O)CN[n]1cccc1 Amb25379969 [0,0,1,1,0,0|2,0,0]=4 8589 B11R1.25 COC(=O)CSc1c[s]cc1 Amb24092455 [0,0,1,1,0,0|2,0,0]=4 8590 B11R1.25 COC(=O)\C=C/c1cccs1 Amb10069647 [0,0,1,1,0,0|1,0,1]=4 8591 B11R1.25 COC(=O)\C=C\c1cc[nH]c1 Amb21962731 [0,0,1,1,0,0|1,0,1]=4 8592 B11R1.25 COC(=O)\C=C\c1ccc[nH]1 Amb22728583 [0,0,1,1,0,0|1,0,1]=4 8593 B11R1.25 COC(=O)\C=C\c1cocc1 Amb24418960 [0,0,1,1,0,0|1,0,1]=4 8594 B11R1.212 CC=1C(=O)CCC1C=CC=C Amb25326724 [0,0,1,1,0,0|1,0,1]=4 8595 B11R1.212 CC=1C(=O)CCC1\C=C\C=C Amb24456633 [0,0,1,1,0,0|1,0,1]=4 8596 B11R1.852 CNC(=O)C1C=CC=CC=C1 Amb24381921 [0,0,1,1,0,0|1,0,0]=3 8597 B11R1.852 COC(=O)C1C=CCCC=C1 Amb25336455 [0,0,1,1,0,0|0,0,2]=4 8598 B11R1.852 COC(=O)C=1C=CC=C=CC1 Amb24060625 [0,0,1,1,0,0|0,0,2]=4 8599 B11R1.852 COC(=O)C=1C=CCC=CC1 Amb24450110 [0,0,1,1,0,0|0,0,2]=4 8600 B11R1.852 COC(=O)C=1C=CNC=CC1 Amb24078438 [0,0,1,1,0,0|1,0,1]=4 8601 B11R1.852 COC(=O)N1C=CC=CC=C1 Amb22364783 [0,0,1,1,0,0|1,0,0]=3 8602 B11R1.852 COC(=O)N1C=CC=CC=C1 Amb24078431 [0,0,1,1,0,0|1,0,0]=3 8603 B11R1.852 COC(=O)N1C=CC=CC=N1 Amb24422879 [0,0,1,1,0,0|2,0,0]=4 8604 B11R1.852 O=C(CCl)C1C=CC=CC=C1 Amb24104139 [0,0,1,1,0,0|2,0,0]=4 8605 B11R2.1 CC1=CCc2ccccc12 Amb17778909 [1,0,0,1,0,0|1,0,0]=3 8606 B11R2.1 CC1C=Cc2ccccc12 Amb17844052 [1,0,0,1,0,0|1,0,1]=4 8607 B11R2.1 CC1NCc2ccccc21 Amb20623497 [1,0,0,1,0,0|2,0,0]=4 8608 B11R2.1 CC1SCc2ccccc21 Amb24092837 [1,0,0,1,0,0|2,0,0]=4 8609 B11R2.1 CN1CCc2c1cccc2 Amb15691717 [1,0,0,1,0,0|1,0,1]=4 8610 B11R2.1 C[C@@H]1NCc2ccccc21 Amb25353679 [1,0,0,1,0,0|2,0,0]=4 8611 B11R2.1 C[N+]1=CCc2c1cccc2 Amb10553677 [1,0,0,1,0,0|1,0,0]=3 8612 B11R2.1 C[SiH]1CCc2ccccc12 Amb24065297 [1,0,0,1,0,0|1,0,1]=4 8613 B11R2.1 C[n+]1csc2c1cccc2 Amb1147462 [1,0,0,1,0,0|2,0,0]=4 8614 B11R2.1 Cc1c[nH]c2c1cccc2 Amb1786299 [1,0,0,1,0,0|2,0,0]=4 8615 B11R2.1 Cn1cnc2c1cccc2 Amb10562077 [1,0,0,1,0,0|2,0,0]=4 8616 B11R2.1 [O-][N+]1=CCc2ccccc12 Amb25338460 [1,0,0,1,0,0|2,0,0]=4 8617 B11R2.4 CC1CC1c2ccccc2 Amb16236859 [1,0,0,1,0,0|1,0,1]=4 8618 B11R2.4 CC1NC1c2ccccc2 Amb24056775 [1,0,0,1,0,0|2,0,0]=4 8619 B11R2.4 CC1OC1c2ccccc2 Amb1129298 [1,0,0,1,0,0|2,0,0]=4 8620 B11R2.4 CN1NC1c2ccccc2 Amb25766657 [1,0,0,1,0,0|2,0,0]=4 8621 B11R2.4 C[C@@H]1O[C@H]1c2ccccc2 Amb22367029 [1,0,0,1,0,0|2,0,0]=4 8622 B11R2.4 C[C@H]1O[C@@H]1c2ccccc2 Amb22224838 [1,0,0,1,0,0|2,0,0]=4 8623 B11R2.20 B1OCc2ccccc2O1 Amb25185117 [1,0,0,1,0,0|2,0,0]=4 8624 B11R2.20 C1=Cc2c(CC1)cccc2 Amb1162229 [1,0,0,1,0,0|1,0,1]=4 8625 B11R2.20 C1=Nc2c(CN1)cccc2 Amb10552960 [1,0,0,1,0,0|2,0,0]=4 8626 B11R2.20 C1C=CNc2ccccc21 Amb24700458 [1,0,0,1,0,0|2,0,0]=4 8627 B11R2.20 C1C=COc2ccccc21 Amb24715811 [1,0,0,1,0,0|2,0,0]=4 8628 B11R2.20 C1C=CSc2ccccc21 Amb25349026 [1,0,0,1,0,0|2,0,0]=4 8629 B11R2.20 C1CCCc2ccccc21 Amb22351371 [1,0,0,1,0,0|1,0,1]=4 8630 B11R2.20 C1N=CNc2ccccc21 Amb19374085 [1,0,0,1,0,0|2,0,0]=4 8631 B11R2.20 C1NNCc2ccccc21 Amb22497223 [1,0,0,1,0,0|2,0,0]=4 8632 B11R2.20 C1OC=Cc2c[n]ccc21 Amb24509709 [1,0,0,1,0,0|1,0,1]=4 8633 B11R2.20 C1OC=Nc2c[n]ccc21 Amb24410616 [1,0,0,1,0,0|2,0,0]=4 8634 B11R2.20 C1OC=Nc2cc[n]cc21 Amb25698104 [1,0,0,1,0,0|2,0,0]=4 8635 B11R2.20 C1OC=Nc2ccc[n]c21 Amb25724450 [1,0,0,1,0,0|2,0,0]=4 8636 B11R2.20 C1OCCc2ccc[n]c21 Amb24070918 [1,0,0,1,0,0|1,0,1]=4 8637 B11R2.20 C1OCOc2ccccc21 Amb24066080 [1,0,0,1,0,0|1,0,1]=4 8638 B11R2.20 C1ON=Cc2ccccc21 Amb25217160 [1,0,0,1,0,0|1,0,1]=4 8639 B11R2.20 C1SC=Cc2ccccc21 Amb25231190 [1,0,0,1,0,0|0,1,1]=4 8640 B11R2.20 C1SCCc2ccccc21 Amb24085482 [1,0,0,1,0,0|0,1,1]=4 8641 B11R2.20 C1SSCc2ccccc21 Amb25839327 [1,0,0,1,0,0|1,1,0]=4 8642 B11R2.20 N1CCc2c(C1)cccc2 Amb2383348 [1,0,0,1,0,0|1,0,1]=4 8643 B11R2.238 C(C1CC1)c2ccccc2 Amb22490220 [1,0,0,1,0,0|1,0,1]=4 8644 B11R2.238 C1CC1=Cc2ccccc2 Amb19515480 [1,0,0,1,0,0|1,0,1]=4 8645 B11R2.238 C1N=C1Cc2ccccc2 Amb22498074 [1,0,0,1,0,0|1,0,0]=3 8646 B11R2.238 C1OC1Cc2cc[n]cc2 Amb24677560 [1,0,0,1,0,0|1,0,1]=4 8647 B11R2.238 C1OC1Cc2cccc[n]2 Amb24649901 [1,0,0,1,0,0|1,0,1]=4 8648 B11R2.238 N1CC1Cc2ccccc2 Amb10072810 [1,0,0,1,0,0|1,0,1]=4 8649 B11R2.238 N1C[C@@H]1Cc2ccccc2 Amb15690958 [1,0,0,1,0,0|1,0,1]=4 8650 B11R2.238 N1C[C@H]1Cc2ccccc2 Amb10603217 [1,0,0,1,0,0|1,0,1]=4 8651 B11R2.239 C1CC(O1)c2ccccc2 Amb22298601 [1,0,0,1,0,0|2,0,0]=4 8652 B11R2.239 C1C[C@@H](O1)c2ccccc2 Amb24479262 [1,0,0,1,0,0|2,0,0]=4 8653 B11R2.239 C1C[C@H](O1)c2ccccc2 Amb25721124 [1,0,0,1,0,0|2,0,0]=4 8654 B11R2.239 C1OCC1c2cccc[n]2 Amb24100566 [1,0,0,1,0,0|1,0,1]=4 8655 B11R2.239 C1OCC1c2ccccc2 Amb21963191 [1,0,0,1,0,0|0,0,1]=3 8656 B11R2.239 N1CC(C1)c2ccccc2 Amb10603719 [1,0,0,1,0,0|1,0,1]=4 8657 B11R2.988 CCC1Cc2ccccc21 Amb24647895 [1,0,0,1,0,0|1,0,1]=4 8658 B11R2.988 COC1Cc2ccccc21 Amb24455687 [1,0,0,1,0,0|0,0,1]=3 8659 B11R2.10 Brc1[n]c2ccccc2o1 Amb19054929 [1,0,0,1,0,0|2,0,0]=4 8660 B11R2.10 C=C1Oc2ccccc2O1 Amb24665414 [1,0,0,1,0,0|2,0,0]=4 8661 B11R2.10 CC1=Cc2c(C1)cccc2 Amb15692403 [1,0,0,1,0,0|1,0,0]=3 8662 B11R2.10 CC1Cc2c(O1)cccc2 Amb10783206 [1,0,0,1,0,0|0,0,2]=4 8663 B11R2.10 CC1Cc2ccccc2C1 Amb20248354 [1,0,0,1,0,0|1,0,1]=4 8664 B11R2.10 CC1Cc2ccccc2S1 Amb17672854 [1,0,0,1,0,0|0,1,1]=4 8665 B11R2.10 CN1Cc2c(C1)cccc2 Amb10554435 [1,0,0,1,0,0|2,0,0]=4 8666 B11R2.10 C[C@@H]1Cc2ccccc2N1 Amb23439109 [1,0,0,1,0,0|1,0,1]=4 8667 B11R2.10 C[C@H]1Cc2ccccc2N1 Amb25294551 [1,0,0,1,0,0|1,0,1]=4 8668 B11R2.10 Cc1[nH+]c2ccccc2[s]1 Amb24096232 [1,0,0,1,0,0|1,1,0]=4 8669 B11R2.10 Cc1[nH]c2ccccc2[p]1 Amb25759070 [1,0,0,1,0,0|2,0,0]=4 8670 B11R2.10 Cc1[n]c2ccccc2[s]1 Amb24084608 [1,0,0,1,0,0|1,1,0]=4 8671 B11R2.10 Cc1cc2c(s1)cccc2 Amb2237023 [1,0,0,1,0,0|0,1,1]=4 8672 B11R2.10 Cc1cc2ccccc2[nH]1 Amb22926528 [1,0,0,1,0,0|1,0,1]=4 8673 B11R2.10 Cc1cc2ccccc2[nH]1 Amb22926529 [1,0,0,1,0,0|1,0,1]=4 8674 B11R2.10 Cc1cc2ccccc2o1 Amb20621560 [1,0,0,1,0,0|0,0,2]=4 8675 B11R2.10 Cc1nc2c([nH]1)cccc2 Amb1286779 [1,0,0,1,0,0|2,0,0]=4 8676 B11R2.10 Cc1sc2c([nH+]1)cccc2 Amb2243865 [1,0,0,1,0,0|1,1,0]=4 8677 B11R2.10 ClC=1Cc2ccccc2C1 Amb22752069 [1,0,0,1,0,0|1,0,1]=4 8678 B11R2.10 ClC=1Cc2ccccc2N1 Amb24061194 [1,0,0,1,0,0|2,0,0]=4 8679 B11R2.10 Clc1cc2ccccc2o1 Amb24104234 [1,0,0,1,0,0|1,0,1]=4 8680 B11R2.10 Clc1nc2c(o1)cccc2 Amb1106378 [1,0,0,1,0,0|2,0,0]=4 8681 B11R2.10 Fc1[n]c2ccccc2o1 Amb24565875 [1,0,0,1,0,0|2,0,0]=4 8682 B11R2.10 Fc1cc2ccccc2o1 Amb24648804 [1,0,0,1,0,0|1,0,1]=4 8683 B11R2.10 IC1Cc2ccccc2C1 Amb23401305 [1,0,0,1,0,0|1,0,1]=4 8684 B11R2.10 I[As]1Cc2ccccc2C1 Amb22346742 [1,0,0,1,0,0|2,0,0]=4 8685 B11R2.10 Ic1[n]c2ccccc2o1 Amb25111418 [1,0,0,1,0,0|2,0,0]=4 8686 B11R2.10 Ic1cc2ccccc2o1 Amb24482100 [1,0,0,1,0,0|1,0,1]=4 8687 B11R2.10 NC1Cc2c(C1)cccc2 Amb2182881 [1,0,0,1,0,0|1,0,1]=4 8688 B11R2.10 NN1Cc2ccccc2C1 Amb22586451 [1,0,0,1,0,0|2,0,0]=4 8689 B11R2.10 Nc1cc2ccccc2o1 Amb22011828 [1,0,0,1,0,0|1,0,1]=4 8690 B11R2.10 Nc1nc2c(o1)cccc2 Amb1153977 [1,0,0,1,0,0|2,0,0]=4 8691 B11R2.10 O=C1C=C2C=CC=CC2=N1 Amb24620213 [1,0,0,1,0,0|1,0,1]=4 8692 B11R2.10 O=C1C=C2C=COC=C2O1 Amb19132425 [1,0,0,1,0,0|1,0,1]=4 8693 B11R2.10 O=C1C=C2NC=CC=C2O1 Amb24718430 [1,0,0,1,0,0|1,0,1]=4 8694 B11R2.10 O=C1CC2=CNC=CC2=N1 Amb25708880 [1,0,0,1,0,0|2,0,0]=4 8695 B11R2.10 O=C1CN2C=CC=CC2=N1 Amb17679305 [1,0,0,1,0,0|2,0,0]=4 8696 B11R2.10 O=C1CN2C=CC=CC2=N1 Amb17680921 [1,0,0,1,0,0|2,0,0]=4 8697 B11R2.10 O=C1CN2C=CC=CC2=N1 Amb17731514 [1,0,0,1,0,0|2,0,0]=4 8698 B11R2.10 O=C1Cc2[n]cccc2N1 Amb22494989 [1,0,0,1,0,0|2,0,0]=4 8699 B11R2.10 O=C1Cc2[n]cccc2O1 Amb24093371 [1,0,0,1,0,0|1,0,0]=3 8700 B11R2.10 O=C1Cc2c(C1)cccc2 Amb1227714 [1,0,0,1,0,0|0,0,0]=2 8701 B11R2.10 O=C1Cc2c(N1)cccc2 Amb1351379 [1,0,0,1,0,0|1,0,0]=3 8702 B11R2.10 O=C1Cc2c[n]ccc2N1 Amb22494990 [1,0,0,1,0,0|2,0,0]=4 8703 B11R2.10 O=C1Cc2cc[n]cc2N1 Amb19929479 [1,0,0,1,0,0|2,0,0]=4 8704 B11R2.10 O=C1Cc2cc[n]cc2N1 Amb21964304 [1,0,0,1,0,0|2,0,0]=4 8705 B11R2.10 O=C1Cc2ccc[n]c2C1 Amb24083418 [1,0,0,1,0,0|1,0,0]=3 8706 B11R2.10 O=C1Cc2ccc[n]c2N1 Amb22405864 [1,0,0,1,0,0|2,0,0]=4 8707 B11R2.10 O=C1Cc2ccccc2S1 Amb24066372 [1,0,0,1,0,0|0,1,0]=3 8708 B11R2.10 O=C1N=C2C=CC=CC2=N1 Amb20247445 [1,0,0,1,0,0|2,0,0]=4 8709 B11R2.10 O=C1Nc2[n+](C1)cccc2 Amb10552755 [1,0,0,1,0,0|2,0,0]=4 8710 B11R2.10 O=C1Nc2[n]cccc2O1 Amb17933371 [1,0,0,1,0,0|2,0,0]=4 8711 B11R2.10 O=C1Nc2cc[n]cc2O1 Amb22233917 [1,0,0,1,0,0|2,0,0]=4 8712 B11R2.10 O=C1Nc2ccc[n]c2O1 Amb18560583 [1,0,0,1,0,0|2,0,0]=4 8713 B11R2.10 O=C1Nc2ccccc2N1 Amb18375774 [1,0,0,1,0,0|2,0,0]=4 8714 B11R2.10 O=C1Nc2ccccc2O1 Amb18043097 [1,0,0,1,0,0|1,0,0]=3 8715 B11R2.10 O=C1Nc2ccccc2S1 Amb17933260 [1,0,0,1,0,0|1,1,0]=4 8716 B11R2.10 O=C1O[n+]2ccccc2S1 Amb20662459 [1,0,0,1,0,0|2,0,0]=4 8717 B11R2.10 O=C1Oc2cccc[n+]2S1 Amb24472982 [1,0,0,1,0,0|2,0,0]=4 8718 B11R2.10 O=C1Oc2ccccc2O1 Amb19514273 [1,0,0,1,0,0|1,0,0]=3 8719 B11R2.10 O=C1Sc2ccccc2S1 Amb25108529 [1,0,0,1,0,0|1,1,0]=4 8720 B11R2.10 O=S1Cc2c(C1)cccc2 Amb10558516 [1,0,0,1,0,0|1,0,0]=3 8721 B11R2.10 O=[Ti]1Oc2ccccc2O1 Amb22733198 [1,0,0,1,0,0|2,0,0]=4 8722 B11R2.10 O=c1oc2c([nH]1)cccc2 Amb1149900 [1,0,0,1,0,0|1,0,0]=3 8723 B11R2.10 O=c1oc2c(s1)nccc2 Amb10552542 [1,0,0,1,0,0|2,0,0]=4 8724 B11R2.10 O=c1sc2c([nH]1)cccc2 Amb16205823 [1,0,0,1,0,0|1,1,0]=4 8725 B11R2.10 OC1Cc2ccccc2N1 Amb24090500 [1,0,0,1,0,0|1,0,1]=4 8726 B11R2.10 ON1Cc2ccccc2C1 Amb22493884 [1,0,0,1,0,0|1,0,1]=4 8727 B11R2.10 Oc1cc2c([nH]1)cccc2 Amb10561372 [1,0,0,1,0,0|1,0,1]=4 8728 B11R2.10 Oc1cc2ccccc2[s]1 Amb24518934 [1,0,0,1,0,0|0,1,1]=4 8729 B11R2.10 Oc1cc2ccccc2o1 Amb24065682 [1,0,0,1,0,0|0,0,2]=4 8730 B11R2.10 Oc1nc2c(o1)cccc2 Amb17593429 [1,0,0,1,0,0|1,0,1]=4 8731 B11R2.10 Oc1nc2c(s1)cccc2 Amb1814195 [1,0,0,1,0,0|1,1,0]=4 8732 B11R2.10 S=C1Cc2c(N1)cccc2 Amb1153150 [1,0,0,1,0,0|1,1,0]=4 8733 B11R2.10 S=C1Cc2ccccc2O1 Amb24089820 [1,0,0,1,0,0|0,1,0]=3 8734 B11R2.10 S=C1Nc2ccccc2O1 Amb18799383 [1,0,0,1,0,0|1,1,0]=4 8735 B11R2.10 S=C1Oc2ccccc2O1 Amb22363540 [1,0,0,1,0,0|1,1,0]=4 8736 B11R2.10 S=c1oc2c([nH]1)cccc2 Amb1157763 [1,0,0,1,0,0|1,1,0]=4 8737 B11R2.10 Sc1cc2ccccc2o1 Amb24061116 [1,0,0,1,0,0|0,1,1]=4 8738 B11R2.10 Sc1nc2c(o1)cccc2 Amb17570013 [1,0,0,1,0,0|1,1,0]=4 8739 B11R2.10 [NH3+]C1Cc2ccccc2C1 Amb24113669 [1,0,0,1,0,0|1,0,1]=4 8740 B11R2.10 [SH3]c1[n]c2ccccc2o1 Amb18046725 [1,0,0,1,0,0|1,1,0]=4 8741 B11R2.59 CC1(C)Cc2ccccc12 Amb17844031 [1,0,0,1,0,0|1,0,1]=4 8742 B11R2.59 CC1(O)Cc2ccccc12 Amb17844000 [1,0,0,1,0,0|0,0,2]=4 8743 B11R2.59 [2H]C1(O)Cc2ccccc12 Amb17778677 [1,0,0,1,0,0|1,0,1]=4 8744 B11R2.54 C[C-]1C(=O)c2cccc[n+]21 Amb24422427 [0,0,0,1,1,0|2,0,0]=4 8745 B11R2.54 O=C1C(Cl)c2ccccc21 Amb21948336 [0,0,0,1,1,0|2,0,0]=4 8746 B11R2.54 O=C1c2ccccc2C1=O Amb18048412 [0,0,0,1,1,0|2,0,0]=4 8747 B11R2.7 O=C1CCC1c2ccco2 Amb25358911 [0,0,0,1,1,0|2,0,0]=4 8748 B11R2.36 O=C1CCc2c(C1)cc[nH]2 Amb13883727 [0,0,0,1,1,0|2,0,0]=4 8749 B11R2.36 O=C1C[n]2cccc2CN1 Amb24444538 [0,0,0,1,1,0|2,0,0]=4 8750 B11R2.36 O=C1Cc2[s]ccc2CC1 Amb24707052 [0,0,0,1,1,0|2,0,0]=4 8751 B11R2.36 O=C1Cc2[s]ccc2CN1 Amb24574721 [0,0,0,1,1,0|2,0,0]=4 8752 B11R2.36 O=C1Cc2c[s]cc2CC1 Amb25145556 [0,0,0,1,1,0|2,0,0]=4 8753 B11R2.36 O=C1Cc2cc[nH]c2CN1 Amb25147601 [0,0,0,1,1,0|2,0,0]=4 8754 B11R2.36 O=C1Cc2cc[s]c2CN1 Amb25749193 [0,0,0,1,1,0|2,0,0]=4 8755 B11R2.36 O=C1Cc2ccc[n]2CC1 Amb18203103 [0,0,0,1,1,0|2,0,0]=4 8756 B11R2.36 O=C1Cc2cocc2CC1 Amb24377986 [0,0,0,1,1,0|2,0,0]=4 8757 B13R2.10 CC1=NC(CO1)c2ccccc2 Amb24754160 [0,0,0,1,0,1|1,0,0]=3 8758 B13R2.10 CC1N[C@H](CO1)c2ccccc2 Amb25150915 [0,0,0,1,0,1|1,0,1]=4 8759 B13R2.10 CC=1CP(CC1)c2ccccc2 Amb22734694 [0,0,0,1,0,1|2,0,0]=4 8760 B13R2.10 N=C1CC(CN1)c2ccccc2 Amb25363924 [0,0,0,1,0,1|2,0,0]=4 8761 B13R2.10 N=C1N[C@H](CO1)c2ccccc2 Amb25326051 [0,0,0,1,0,1|1,0,0]=3 8762 B13R2.10 NC1=NC(CO1)c2ccccc2 Amb17619912 [0,0,0,1,0,1|1,0,0]=3 8763 B13R2.10 NC1=NCC(O1)c2ccccc2 Amb17608294 [0,0,0,1,0,1|2,0,0]=4 8764 B13R2.10 NC1=NCC(S1)c2ccccc2 Amb25060735 [0,0,0,1,0,1|2,0,0]=4 8765 B13R2.10 NC=1CCC(N1)c2ccccc2 Amb24391515 [0,0,0,1,0,1|2,0,0]=4 8766 B13R2.10 O=C1C=C(CO1)c2ccccc2 Amb24633865 [0,0,0,1,0,1|0,0,1]=3 8767 B13R2.10 O=C1C=CC(N1)c2ccccc2 Amb25311888 [0,0,0,1,0,1|1,0,1]=4 8768 B13R2.10 O=C1C=CC(O1)c2ccccc2 Amb24090251 [0,0,0,1,0,1|1,0,1]=4 8769 B13R2.10 O=C1C=[N+]([N-]O1)c2ccccc2 Amb21934019 [0,0,0,1,0,1|1,0,1]=4 8770 B13R2.10 O=C1CC(=CN1)c2ccccc2 Amb24066196 [0,0,0,1,0,1|1,0,1]=4 8771 B13R2.10 O=C1CC(=CO1)c2ccccc2 Amb25697090 [0,0,0,1,0,1|0,0,1]=3 8772 B13R2.10 O=C1CC(=NO1)c2c[n]ccc2 Amb22496083 [0,0,0,1,0,1|2,0,0]=4 8773 B13R2.10 O=C1CCC(=C1)c2ccccc2 Amb10669546 [0,0,0,1,0,1|1,0,1]=4 8774 B13R2.10 O=C1CCC(C1)c2ccccc2 Amb17138497 [0,0,0,1,0,1|1,0,0]=3 8775 B13R2.10 O=C1CCC(C1)c2ccccn2 Amb17138526 [0,0,0,1,0,1|2,0,0]=4 8776 B13R2.10 O=C1CCC(C1)c2cccnc2 Amb17138527 [0,0,0,1,0,1|2,0,0]=4 8777 B13R2.10 O=C1CCC(C1)c2ccncc2 Amb17138528 [0,0,0,1,0,1|2,0,0]=4 8778 B13R2.10 O=C1CCC(N1)c2cccc[n]2 Amb25237487 [0,0,0,1,0,1|2,0,0]=4 8779 B13R2.10 O=C1CCC(N1)c2ccccc2 Amb17470413 [0,0,0,1,0,1|1,0,0]=3 8780 B13R2.10 O=C1CCC(N1)c2cccnc2 Amb17618670 [0,0,0,1,0,1|2,0,0]=4 8781 B13R2.10 O=C1CCC(O1)c2cccnc2 Amb17619714 [0,0,0,1,0,1|2,0,0]=4 8782 B13R2.10 O=C1CC[C@@H](N1)c2ccc[n]c2 Amb25233097 [0,0,0,1,0,1|2,0,0]=4 8783 B13R2.10 O=C1CN(C=N1)c2ccccc2 Amb24064867 [0,0,0,1,0,1|1,0,1]=4 8784 B13R2.10 O=C1CN(CC1)c2cc[n]cc2 Amb23449311 [0,0,0,1,0,1|2,0,0]=4 8785 B13R2.10 O=C1CN(CN1)c2ccccc2 Amb24079614 [0,0,0,1,0,1|1,0,0]=3 8786 B13R2.10 O=C1CN(NO1)c2ccccc2 Amb25736264 [0,0,0,1,0,1|1,0,0]=3 8787 B13R2.10 O=C1CNC(C1)c2ccccc2 Amb23437185 [0,0,0,1,0,1|2,0,0]=4 8788 B13R2.10 O=C1CNC(N1)c2ccccc2 Amb24342220 [0,0,0,1,0,1|2,0,0]=4 8789 B13R2.10 O=C1COC(C1)c2ccccc2 Amb25830079 [0,0,0,1,0,1|2,0,0]=4 8790 B13R2.10 O=C1COC(N1)c2ccccc2 Amb25766459 [0,0,0,1,0,1|2,0,0]=4 8791 B13R2.10 O=C1CO[C@@H](N1)c2ccccc2 Amb24366993 [0,0,0,1,0,1|2,0,0]=4 8792 B13R2.10 O=C1CSC(C1)c2ccccc2 Amb25702041 [0,0,0,1,0,1|2,0,0]=4 8793 B13R2.10 O=C1CSC(N1)c2ccccc2 Amb2221753 [0,0,0,1,0,1|2,0,0]=4 8794 B13R2.10 O=C1CSC(O1)c2ccccc2 Amb25793869 [0,0,0,1,0,1|2,0,0]=4 8795 B13R2.10 O=C1C[C@@H](CC1)c2ccccc2 Amb24323281 [0,0,0,1,0,1|1,0,0]=3 8796 B13R2.10 O=C1C[C@@H](CN1)c2ccccc2 Amb23401452 [0,0,0,1,0,1|1,0,0]=3 8797 B13R2.10 O=C1C[C@H](CC1)c2ccccc2 Amb24484347 [0,0,0,1,0,1|1,0,0]=3 8798 B13R2.10 O=C1C[C@H](CN1)c2ccccc2 Amb25277165 [0,0,0,1,0,1|1,0,0]=3 8799 B13R2.10 O=C1NC(=NO1)c2ccccc2 Amb18788105 [0,0,0,1,0,1|1,0,1]=4 8800 B13R2.10 O=C1NC(CO1)c2c[n]c[n]c2 Amb24609227 [0,0,0,1,0,1|2,0,0]=4 8801 B13R2.10 O=C1NC(CS1)c2ccccc2 Amb23439132 [0,0,0,1,0,1|0,1,0]=3 8802 B13R2.10 O=C1NCC(C1)c2ccccc2 Amb1772919 [0,0,0,1,0,1|1,0,0]=3 8803 B13R2.10 O=C1NCC(C1)c2ccccn2 Amb13952281 [0,0,0,1,0,1|2,0,0]=4 8804 B13R2.10 O=C1NCC(C1)c2cccnc2 Amb13783612 [0,0,0,1,0,1|2,0,0]=4 8805 B13R2.10 O=C1NCC(C1)c2ccncc2 Amb17400108 [0,0,0,1,0,1|2,0,0]=4 8806 B13R2.10 O=C1NCC(N1)c2c[n]ccc2 Amb24346599 [0,0,0,1,0,1|2,0,0]=4 8807 B13R2.10 O=C1NCC(N1)c2cccc[n]2 Amb25331915 [0,0,0,1,0,1|2,0,0]=4 8808 B13R2.10 O=C1NCC(N1)c2ccccc2 Amb22056050 [0,0,0,1,0,1|1,0,0]=3 8809 B13R2.10 O=C1NCC(O1)c2cc[n]cc2 Amb18639408 [0,0,0,1,0,1|2,0,0]=4 8810 B13R2.10 O=C1NCC(O1)c2cccc[n]2 Amb18639394 [0,0,0,1,0,1|2,0,0]=4 8811 B13R2.10 O=C1NCC(O1)c2ccccc2 Amb16232576 [0,0,0,1,0,1|1,0,0]=3 8812 B13R2.10 O=C1NCC(O1)c2cccnc2 Amb17232462 [0,0,0,1,0,1|2,0,0]=4 8813 B13R2.10 O=C1NC[C@@H](N1)c2cccc[n]2 Amb24730704 [0,0,0,1,0,1|2,0,0]=4 8814 B13R2.10 O=C1NC[C@@H](N1)c2ccccc2 Amb24568910 [0,0,0,1,0,1|1,0,0]=3 8815 B13R2.10 O=C1NC[C@@H](O1)c2ccccc2 Amb22338660 [0,0,0,1,0,1|1,0,0]=3 8816 B13R2.10 O=C1NC[C@H](N1)c2c[n]ccc2 Amb25251578 [0,0,0,1,0,1|2,0,0]=4 8817 B13R2.10 O=C1NC[C@H](N1)c2cccc[n]2 Amb24492823 [0,0,0,1,0,1|2,0,0]=4 8818 B13R2.10 O=C1NC[C@H](N1)c2ccccc2 Amb25054081 [0,0,0,1,0,1|1,0,0]=3 8819 B13R2.10 O=C1NC[C@H](O1)c2ccccc2 Amb24574681 [0,0,0,1,0,1|1,0,0]=3 8820 B13R2.10 O=C1NC[C@H](S1)c2ccccc2 Amb25246623 [0,0,0,1,0,1|1,0,0]=3 8821 B13R2.10 O=C1N[C@@H](CO1)c2cc[n]cc2 Amb24731875 [0,0,0,1,0,1|1,0,0]=3 8822 B13R2.10 O=C1N[C@@H](CS1)c2ccccc2 Amb24653499 [0,0,0,1,0,1|0,1,0]=3 8823 B13R2.10 O=C1N[C@H](CO1)c2ccc[n]c2 Amb25159332 [0,0,0,1,0,1|1,0,0]=3 8824 B13R2.10 O=C1ON=C(C1)c2ccncc2 Amb2405318 [0,0,0,1,0,1|2,0,0]=4 8825 B13R2.10 O=C1SSC(C1)c2ccccc2 Amb16757360 [0,0,0,1,0,1|1,1,0]=4 8826 B13R2.10 O=C1[CH-][N+](=NO1)c2ccccc2 Amb20659866 [0,0,0,1,0,1|1,0,1]=4 8827 B13R2.10 O=c1cc([nH]o1)-c2ccccc2 Amb24062192 [0,0,0,1,0,1|1,0,1]=4 8828 B13R2.10 OC1CC(CO1)c2ccccc2 Amb22752509 [0,0,0,1,0,1|0,0,2]=4 8829 B13R2.10 OC1C[C@H](CO1)c2ccccc2 Amb25712077 [0,0,0,1,0,1|0,0,2]=4 8830 B13R2.10 OC=1CC(CN1)c2ccccc2 Amb19866679 [0,0,0,1,0,1|1,0,1]=4 8831 B13R2.10 S=C1NC(CS1)c2ccccc2 Amb24101079 [0,0,0,1,0,1|0,2,0]=4 8832 B13R2.10 S=C1NCC(S1)c2ccccc2 Amb10810186 [0,0,0,1,0,1|1,1,0]=4 8833 B13R2.10 S=C1NC[C@@H](O1)c2ccccc2 Amb24728461 [0,0,0,1,0,1|1,1,0]=4 8834 B13R2.10 S=C1NC[C@H](S1)c2ccccc2 Amb25150880 [0,0,0,1,0,1|1,1,0]=4 8835 B13R2.27 O=C/1CC\C1=C/c2ccccc2 Amb25366584 [0,0,0,1,0,1|1,0,1]=4 8836 B13R2.27 O=C/1NC\C1=C/c2ccccc2 Amb24547036 [0,0,0,1,0,1|1,0,1]=4 8837 B13R2.27 O=C1CCN1Cc2ccccc2 Amb25117461 [0,0,0,1,0,1|1,0,0]=3 8838 B13R2.27 O=C1CC[C@@H]1Cc2ccccc2 Amb25792997 [0,0,0,1,0,1|1,0,0]=3 8839 B13R2.27 O=C1NCC1Sc2ccccc2 Amb25084609 [0,0,0,1,0,1|1,0,0]=3 8840 B13R2.27 O=C1NC[C@@H]1Cc2ccccc2 Amb24711591 [0,0,0,1,0,1|1,0,0]=3 8841 B13R2.27 O=C1NC[C@H]1Sc2ccccc2 Amb24497005 [0,0,0,1,0,1|1,0,0]=3 8842 B13R2.27 S=C1CCN1Cc2ccccc2 Amb25837349 [0,0,0,1,0,1|1,1,0]=4 8843 B13R2.32 CC1C(=O)CNc2ccccc21 Amb25276622 [0,0,0,1,0,1|1,0,0]=3 8844 B13R2.32 CC1C(=O)CSc2ccccc21 Amb24620041 [0,0,0,1,0,1|1,0,0]=3 8845 B13R2.32 CN1C(=C)NCc2ccccc12 Amb25245953 [0,0,0,1,0,1|2,0,0]=4 8846 B13R2.32 CN1C(=O)C=Cc2ccccc12 Amb19116112 [0,0,0,1,0,1|1,0,1]=4 8847 B13R2.32 CN1C(=O)N=Cc2ccccc12 Amb24079785 [0,0,0,1,0,1|1,0,1]=4 8848 B13R2.32 CN1C(=O)OCc2ccccc12 Amb25220213 [0,0,0,1,0,1|1,0,0]=3 8849 B13R2.32 CN1C(=S)CSc2ccccc12 Amb24456908 [0,0,0,1,0,1|1,1,0]=4 8850 B13R2.32 NC1C(=O)NCc2ccccc21 Amb21857372 [0,0,0,1,0,1|2,0,0]=4 8851 B13R2.32 NC1C(=O)NCc2ccccc21 Amb22436817 [0,0,0,1,0,1|2,0,0]=4 8852 B13R2.32 NC1C(=O)NCc2ccccc21 Amb22491803 [0,0,0,1,0,1|2,0,0]=4 8853 B13R2.32 NC1C(=O)OCc2ccccc21 Amb25275532 [0,0,0,1,0,1|2,0,0]=4 8854 B13R2.32 NN1C(=O)CCc2ccccc12 Amb18645671 [0,0,0,1,0,1|2,0,0]=4 8855 B13R2.32 NN1C(=O)CNc2ccccc12 Amb19929383 [0,0,0,1,0,1|2,0,0]=4 8856 B13R2.32 NN1C(=O)CNc2ccccc12 Amb24540886 [0,0,0,1,0,1|2,0,0]=4 8857 B13R2.32 O=C1CCc2c(N1C)cccc2 Amb17322846 [0,0,0,1,0,1|1,0,0]=3 8858 B13R2.32 O=C1CCc2c(N1O)cccc2 Amb1099957 [0,0,0,1,0,1|2,0,0]=4 8859 B13R2.32 O=C1CCc2ccccc2C1Br Amb24680538 [0,0,0,1,0,1|2,0,0]=4 8860 B13R2.32 O=C1CCc2ccccc2C1F Amb25092927 [0,0,0,1,0,1|2,0,0]=4 8861 B13R2.32 O=C1COc2c(N1C)cccc2 Amb1351378 [0,0,0,1,0,1|1,0,0]=3 8862 B13R2.32 O=C1COc2c(N1O)cccc2 Amb2423861 [0,0,0,1,0,1|2,0,0]=4 8863 B13R2.32 O=C1OCc2ccccc2C1=O Amb24633619 [0,0,0,1,0,1|2,0,0]=4 8864 B13R2.32 O=C1c2ccccc2OCC1=O Amb24662280 [0,0,0,1,0,1|2,0,0]=4 8865 B13R2.32 O=C1c2ccccc2SCC1=O Amb24467680 [0,0,0,1,0,1|2,0,0]=4 8866 B13R2.32 OC1C(=O)OCc2ccccc21 Amb24371200 [0,0,0,1,0,1|2,0,0]=4 8867 B13R2.32 ON1C(=O)NCc2ccccc12 Amb25124767 [0,0,0,1,0,1|2,0,0]=4 8868 B13R2.32 ON1C(=O)OCc2ccccc12 Amb24086560 [0,0,0,1,0,1|2,0,0]=4 8869 B13R2.33 C=C1CNc2ccccc2CC1 Amb25858877 [0,0,0,1,0,1|2,0,0]=4 8870 B13R2.33 ClP1OCc2ccccc2CO1 Amb25150005 [0,0,0,1,0,1|2,0,0]=4 8871 B13R2.33 FC=1COc2ccccc2CC1 Amb24379592 [0,0,0,1,0,1|2,0,0]=4 8872 B13R2.33 O=C1C=Cc2c(CC1)cccc2 Amb17593958 [0,0,0,1,0,1|1,0,1]=4 8873 B13R2.33 O=C1CCc2ccccc2CO1 Amb24525708 [0,0,0,1,0,1|0,0,0]=2 8874 B13R2.33 O=C1CNc2[n]cccc2CN1 Amb23580219 [0,0,0,1,0,1|2,0,0]=4 8875 B13R2.33 O=C1CNc2c(CN1)cccc2 Amb17620443 [0,0,0,1,0,1|1,0,0]=3 8876 B13R2.33 O=C1COc2c(CN1)cccc2 Amb2137257 [0,0,0,1,0,1|1,0,0]=3 8877 B13R2.33 O=C1CSc2ccccc2CC1 Amb25044274 [0,0,0,1,0,1|1,0,0]=3 8878 B13R2.33 O=C1NCc2ccccc2CO1 Amb24100846 [0,0,0,1,0,1|0,0,0]=2 8879 B13R2.33 OC1CCc2ccccc2CO1 Amb22227713 [0,0,0,1,0,1|0,0,2]=4 8880 B13R2.33 OC=1NCc2ccccc2CN1 Amb25046691 [0,0,0,1,0,1|1,0,1]=4 8881 B13R2.33 S=C1CNc2ccccc2CN1 Amb24424505 [0,0,0,1,0,1|1,1,0]=4 8882 B13R2.57 CCC=1NCc2ccccc2N1 Amb24424503 [0,0,0,1,0,1|2,0,0]=4 8883 B13R2.57 CNC1=Nc2ccccc2CO1 Amb25081451 [0,0,0,1,0,1|2,0,0]=4 8884 B13R2.57 CNC=1CCc2ccccc2C1 Amb25784738 [0,0,0,1,0,1|2,0,0]=4 8885 B13R2.57 CNC=1CSc2ccccc2N1 Amb25826714 [0,0,0,1,0,1|2,0,0]=4 8886 B13R2.57 COC=1CSc2ccccc2N1 Amb24116116 [0,0,0,1,0,1|1,0,0]=3 8887 B13R2.57 COC=1Cc2ccc[n]c2CC1 Amb24365189 [0,0,0,1,0,1|2,0,0]=4 8888 B13R2.57 COc1[n]c2ccccc2c[n]1 Amb22745160 [0,0,0,1,0,1|1,0,1]=4 8889 B13R2.57 COc1c[n]c2ccccc2[n]1 Amb24105763 [0,0,0,1,0,1|1,0,1]=4 8890 B13R2.57 COc1cc2ccccc2[n]c1 Amb19957896 [0,0,0,1,0,1|1,0,1]=4 8891 B13R2.57 COc1ccc2ccccc2[n]1 Amb20171196 [0,0,0,1,0,1|1,0,1]=4 8892 B13R2.57 CSC1=NCc2c(N1)cccc2 Amb10976190 [0,0,0,1,0,1|1,1,0]=4 8893 B13R2.57 CSC=1CCc2ccccc2N1 Amb24666023 [0,0,0,1,0,1|1,1,0]=4 8894 B13R2.57 CSC=1CSc2ccccc2N1 Amb24361734 [0,0,0,1,0,1|1,1,0]=4 8895 B13R2.57 CSC=1Nc2ccccc2CN1 Amb24678310 [0,0,0,1,0,1|1,1,0]=4 8896 B13R2.373 C=C1C(NC1=O)c2ccccc2 Amb25770081 [0,0,0,1,0,1|1,0,1]=4 8897 B13R2.373 C=C1[C@H](NC1=O)c2ccccc2 Amb25159312 [0,0,0,1,0,1|1,0,1]=4 8898 B13R2.373 CC1C(CC1=O)c2ccccc2 Amb20668234 [0,0,0,1,0,1|1,0,0]=3 8899 B13R2.373 CC1C(NC1=O)c2ccccc2 Amb19149073 [0,0,0,1,0,1|1,0,0]=3 8900 B13R2.373 CN1C(CC1=O)c2ccc[n]c2 Amb25208120 [0,0,0,1,0,1|2,0,0]=4 8901 B13R2.373 C[C@@H]1[C@H](NC1=O)c2ccccc2 Amb25206665 [0,0,0,1,0,1|1,0,0]=3 8902 B13R2.373 C[C@H]1[C@@H](CC1=O)c2ccccc2 Amb25263638 [0,0,0,1,0,1|1,0,0]=3 8903 B13R2.373 NC1C(NC1=O)c2ccccc2 Amb18829732 [0,0,0,1,0,1|2,0,0]=4 8904 B13R2.373 N[C@@H]1[C@H](NC1=O)c2ccccc2 Amb25247209 [0,0,0,1,0,1|2,0,0]=4 8905 B13R2.373 O=C1CC(=C1Cl)c2ccccc2 Amb25706972 [0,0,0,1,0,1|2,0,0]=4 8906 B13R2.373 O=C1NC(C1Cl)c2ccccc2 Amb25159285 [0,0,0,1,0,1|2,0,0]=4 8907 B13R2.373 O=C1N[C@@H]([C@H]1F)c2ccccc2 Amb24513256 [0,0,0,1,0,1|2,0,0]=4 8908 B13R2.373 O=C1N[C@H]([C@@H]1F)c2ccccc2 Amb24617812 [0,0,0,1,0,1|2,0,0]=4 8909 B13R2.373 OC1C(NC1=O)c2ccccc2 Amb25272921 [0,0,0,1,0,1|2,0,0]=4 8910 B13R2.373 OC=1C(=O)CC1c2ccccc2 Amb25092955 [0,0,0,1,0,1|2,0,0]=4 8911 B13R2.373 O[C@H]1C(=O)N[C@H]1c2ccccc2 Amb17615687 [0,0,0,1,0,1|2,0,0]=4 8912 B13R2.2383 C(Oc1ccccc1)C=2CCC2 Amb23453501 [0,0,0,1,0,1|2,0,0]=4 8913 B13R2.3203 CC1(CO1)CCc2ccccc2 Amb18798137 [0,0,0,1,0,1|1,0,1]=4 8914 B13R2.15272 C#CC(=O)C1Cc2ccccc21 Amb25341002 [0,0,0,1,0,1|1,0,1]=4 8915 B13R2.15272 C=CC(=O)C1Cc2ccccc21 Amb24483901 [0,0,0,1,0,1|1,0,1]=4 8916 B13R2.15272 CNC(=O)[n]1oc2ccccc12 Amb24398815 [0,0,0,1,0,1|2,0,0]=4 8917 B13R2.15272 COC(=N)C1Cc2ccccc21 Amb24707799 [0,0,0,1,0,1|1,0,0]=3 8918 B13R2.15272 COC(=O)C1=Cc2ccccc21 Amb20248945 [0,0,0,1,0,1|0,0,1]=3 8919 B13R2.15272 O=C(CBr)C1Cc2ccccc21 Amb25669623 [0,0,0,1,0,1|2,0,0]=4 8920 B13R2.15272 OCC(=O)C1Cc2ccccc21 Amb25319014 [0,0,0,1,0,1|2,0,0]=4 8921 B13R2.15272 ONC(=O)C1Cc2ccccc21 Amb24406877 [0,0,0,1,0,1|2,0,0]=4 8922 B13R2.3729 O=C1CCC2=CC=CC=CC2=C1 Amb24620088 [0,0,0,1,0,1|1,0,1]=4 8923 B13R2.13132 O=C1CC2(CC1)C=CC=CC=C2 Amb25735715 [0,0,0,1,0,1|1,0,1]=4 8924 B13R2.15 N=C1OCCC1c2ccccc2 Amb25140934 [0,1,0,1,0,0|1,0,0]=3 8925 B13R2.15 N[C@H]1COC[C@@H]1c2ccccc2 Amb25122865 [0,1,0,1,0,0|1,0,1]=4 8926 B13R2.15 O=C1C=CCC1c2ccccc2 Amb24520656 [0,1,0,1,0,0|1,0,0]=3 8927 B13R2.15 O=C1C=CCN1c2ccccc2 Amb25679742 [0,1,0,1,0,0|2,0,0]=4 8928 B13R2.15 O=C1CCC=C1c2ccccc2 Amb24099094 [0,1,0,1,0,0|1,0,1]=4 8929 B13R2.15 O=C1CCCC1c2ccc[n]c2 Amb18797977 [0,1,0,1,0,0|2,0,0]=4 8930 B13R2.15 O=C1CCCC1c2ccccc2 Amb17940271 [0,1,0,1,0,0|1,0,0]=3 8931 B13R2.15 O=C1CCNC1c2ccccc2 Amb18829957 [0,1,0,1,0,0|1,0,0]=3 8932 B13R2.15 O=C1CCNC1c2ccccc2 Amb22901061 [0,1,0,1,0,0|1,0,0]=3 8933 B13R2.15 O=C1CCNN1c2ccccc2 Amb24621860 [0,1,0,1,0,0|2,0,0]=4 8934 B13R2.15 O=C1CN=NC1c2ccccc2 Amb25713706 [0,1,0,1,0,0|2,0,0]=4 8935 B13R2.15 O=C1CNCN1c2ccccc2 Amb24664160 [0,1,0,1,0,0|2,0,0]=4 8936 B13R2.15 O=C1COCC1c2ccccc2 Amb23590154 [0,1,0,1,0,0|0,0,0]=2 8937 B13R2.15 O=C1NC=NC1c2ccccc2 Amb24079435 [0,1,0,1,0,0|1,0,1]=4 8938 B13R2.15 O=C1NCCC1c2cc[n]cc2 Amb25070544 [0,1,0,1,0,0|2,0,0]=4 8939 B13R2.15 O=C1NCCC1c2ccc[n]c2 Amb24393400 [0,1,0,1,0,0|2,0,0]=4 8940 B13R2.15 O=C1NCCC1c2ccccc2 Amb17400090 [0,1,0,1,0,0|1,0,0]=3 8941 B13R2.15 O=C1NCSC1c2ccccc2 Amb24600018 [0,1,0,1,0,0|1,0,0]=3 8942 B13R2.15 O=C1OC=NC1c2ccccc2 Amb24661677 [0,1,0,1,0,0|0,0,1]=3 8943 B13R2.15 O=C1OC=NN1c2ccccc2 Amb25688037 [0,1,0,1,0,0|1,0,1]=4 8944 B13R2.15 O=C1OCCC1c2cc[n]cc2 Amb22757401 [0,1,0,1,0,0|1,0,0]=3 8945 B13R2.15 O=C1OCCC1c2ccc[n]c2 Amb22757403 [0,1,0,1,0,0|1,0,0]=3 8946 B13R2.15 O=C1OCCC1c2cccc[n]2 Amb22757402 [0,1,0,1,0,0|1,0,0]=3 8947 B13R2.15 O=C1OCCC1c2ccccc2 Amb10606603 [0,1,0,1,0,0|0,0,0]=2 8948 B13R2.15 O=C1OCCN1c2cc[n]cc2 Amb24364749 [0,1,0,1,0,0|2,0,0]=4 8949 B13R2.15 O=C1OCOC1c2ccccc2 Amb24497607 [0,1,0,1,0,0|0,0,0]=2 8950 B13R2.15 O=C1ON=S=C1c2ccccc2 Amb17836463 [0,1,0,1,0,0|1,0,1]=4 8951 B13R2.15 O=C1SCCN1c2ccccc2 Amb1771171 [0,1,0,1,0,0|1,1,0]=4 8952 B13R2.15 OC1COCC1c2ccccc2 Amb23448389 [0,1,0,1,0,0|0,0,2]=4 8953 B13R2.15 OC1OCCC1c2ccccc2 Amb22752503 [0,1,0,1,0,0|0,0,2]=4 8954 B13R2.15 S=C1NCCC1c2ccccc2 Amb25194723 [0,1,0,1,0,0|1,1,0]=4 8955 B13R2.26 CCCC1=Cc2c(C1)cccc2 Amb15692407 [0,1,0,1,0,0|2,0,0]=4 8956 B13R2.26 CCOC=1Cc2ccccc2N1 Amb24408882 [0,1,0,1,0,0|1,0,0]=3 8957 B13R2.26 CCOc1cc2ccccc2[nH]1 Amb22750429 [0,1,0,1,0,0|1,0,1]=4 8958 B13R2.26 CCOc1cc2ccccc2o1 Amb24104388 [0,1,0,1,0,0|0,0,2]=4 8959 B13R2.26 CNCC=1Cc2ccccc2C1 Amb24451114 [0,1,0,1,0,0|2,0,0]=4 8960 B13R2.26 CNN=C1Cc2ccccc2C1 Amb25717451 [0,1,0,1,0,0|2,0,0]=4 8961 B13R2.26 COCC1Cc2ccccc2N1 Amb25148607 [0,1,0,1,0,0|1,0,1]=4 8962 B13R2.26 COCC1Cc2ccccc2S1 Amb25090874 [0,1,0,1,0,0|0,1,1]=4 8963 B13R2.26 COCc1cc2ccccc2[nH]1 Amb25226813 [0,1,0,1,0,0|1,0,1]=4 8964 B13R2.26 COCc1cc2ccccc2o1 Amb24101331 [0,1,0,1,0,0|0,0,2]=4 8965 B13R2.26 COCc1nc2c([nH]1)cccc2 Amb1162236 [0,1,0,1,0,0|2,0,0]=4 8966 B13R2.26 CONC1Cc2ccccc2C1 Amb25287092 [0,1,0,1,0,0|1,0,1]=4 8967 B13R2.26 CONc1[nH]c2ccccc2[n]1 Amb24472533 [0,1,0,1,0,0|2,0,0]=4 8968 B13R2.26 NCCC=1Cc2ccccc2N1 Amb24638220 [0,1,0,1,0,0|2,0,0]=4 8969 B13R2.26 NCOc1[n]c2ccccc2[s]1 Amb25039196 [0,1,0,1,0,0|1,1,0]=4 8970 B13R2.26 OCCC1=Cc2c(C1)cccc2 Amb17594005 [0,1,0,1,0,0|2,0,0]=4 8971 B13R2.30 CC1CC(=O)C1c2ccccc2 Amb24449010 [0,1,0,1,0,0|1,0,0]=3 8972 B13R2.30 CC1NC(=O)[C@H]1c2ccccc2 Amb24381390 [0,1,0,1,0,0|1,0,0]=3 8973 B13R2.64 C(C1=CCCN1)c2ccccc2 Amb17938862 [0,1,0,1,0,0|2,0,0]=4 8974 B13R2.64 C(c1c[n]co1)c2ccccc2 Amb22753568 [0,1,0,1,0,0|1,0,1]=4 8975 B13R2.64 C(c1ccccc1)C=2CCCC2 Amb24059058 [0,1,0,1,0,0|2,0,0]=4 8976 B13R2.64 C(c1ccccc1)C=2CCCN2 Amb24053775 [0,1,0,1,0,0|2,0,0]=4 8977 B13R2.64 C(c1ccccc1)C=2CCNN2 Amb25109564 [0,1,0,1,0,0|2,0,0]=4 8978 B13R2.64 C1COC(N1)Cc2ccccc2 Amb17506176 [0,1,0,1,0,0|1,0,1]=4 8979 B13R2.64 C1COC=C1Sc2ccccc2 Amb24484091 [0,1,0,1,0,0|2,0,0]=4 8980 B13R2.64 C1NC(CO1)Cc2ccccc2 Amb18563410 [0,1,0,1,0,0|1,0,1]=4 8981 B13R2.64 C1OCCN1Cc2ccccc2 Amb22229191 [0,1,0,1,0,0|2,0,0]=4 8982 B13R2.64 c1ccc(cc1)CC2=NCCO2 Amb2429421 [0,1,0,1,0,0|1,0,0]=3 8983 B13R2.64 c1ccc(cc1)Cc2ncco2 Amb17400052 [0,1,0,1,0,0|1,0,1]=4 8984 B13R2.135 CC=1Cc2ccccc2C1CC Amb25743495 [0,1,0,1,0,0|2,0,0]=4 8985 B13R2.135 CCC1C(=O)Nc2ccccc21 Amb23585468 [0,1,0,1,0,0|2,0,0]=4 8986 B13R2.135 CCC1C(=O)Oc2ccccc21 Amb24103815 [0,1,0,1,0,0|2,0,0]=4 8987 B13R2.135 CCC=1C(=O)CN2C=CC=CC21 Amb25128955 [0,1,0,1,0,0|2,0,0]=4 8988 B13R2.135 CCN1C(=O)Cc2c1cccc2 Amb2416954 [0,1,0,1,0,0|1,0,0]=3 8989 B13R2.135 CCN1C(=O)Nc2ccccc12 Amb18034265 [0,1,0,1,0,0|2,0,0]=4 8990 B13R2.135 CCN1C(=O)Oc2ccccc12 Amb17992087 [0,1,0,1,0,0|2,0,0]=4 8991 B13R2.135 CCN1C(=S)Cc2ccccc12 Amb25047655 [0,1,0,1,0,0|1,1,0]=4 8992 B13R2.135 CNC1C(=O)Nc2c1cccc2 Amb1113865 [0,1,0,1,0,0|2,0,0]=4 8993 B13R2.135 COC1C(=O)Nc2ccccc21 Amb24648884 [0,1,0,1,0,0|1,0,0]=3 8994 B13R2.135 COC1C(Cl)Cc2ccccc21 Amb24104237 [0,1,0,1,0,0|1,0,1]=4 8995 B13R2.135 COC1C(O)Cc2ccccc21 Amb22227971 [0,1,0,1,0,0|0,0,2]=4 8996 B13R2.135 CON1C(=O)Nc2ccccc12 Amb25368420 [0,1,0,1,0,0|1,0,0]=3 8997 B13R2.135 CON1C(O)Cc2ccccc12 Amb24341962 [0,1,0,1,0,0|0,0,2]=4 8998 B13R2.135 CO[C@@H]1C(O)Cc2c1cccc2 Amb16226980 [0,1,0,1,0,0|0,0,2]=4 8999 B13R2.135 CO[C@@H]1[C@@H](Cl)Cc2ccccc21 Amb24744824 [0,1,0,1,0,0|1,0,1]=4 9000 B13R2.135 CO[C@@H]1[C@@H](O)Cc2ccccc21 Amb22757738 [0,1,0,1,0,0|0,0,2]=4 9001 B13R2.135 CO[C@@H]1[C@H](N)Cc2ccccc21 Amb25162040 [0,1,0,1,0,0|1,0,1]=4 9002 B13R2.135 CO[C@H]1[C@@H](N)Cc2ccccc21 Amb24089073 [0,1,0,1,0,0|1,0,1]=4 9003 B13R2.135 CO[n]1c(Cl)cc2ccccc12 Amb25292894 [0,1,0,1,0,0|1,0,1]=4 9004 B13R2.135 CO[n]1c(I)cc2ccccc12 Amb24067547 [0,1,0,1,0,0|1,0,1]=4 9005 B13R2.135 COc1c(I)[s]c2ccccc21 Amb22008794 [0,1,0,1,0,0|2,0,0]=4 9006 B13R2.135 COc1c(O)[nH]c2ccccc21 Amb24574181 [0,1,0,1,0,0|1,0,1]=4 9007 B13R2.135 CSC1C(=O)Nc2ccccc21 Amb24435374 [0,1,0,1,0,0|1,1,0]=4 9008 B13R2.135 C\C=C/1\C(=O)Nc2ccccc21 Amb24487101 [0,1,0,1,0,0|2,0,0]=4 9009 B13R2.135 C\N=C\1/C(=O)Nc2c1cccc2 Amb1042382 [0,1,0,1,0,0|2,0,0]=4 9010 B13R2.135 Cc1oc2ccccc2c1OC Amb24102324 [0,1,0,1,0,0|2,0,0]=4 9011 B13R2.135 ClCn1c(=O)sc2c1cccc2 Amb16205273 [0,1,0,1,0,0|2,0,0]=4 9012 B13R2.135 ClCn1c(=O)sc2c1cccc2 Amb16205816 [0,1,0,1,0,0|2,0,0]=4 9013 B13R2.135 NCC1C(=O)Nc2ccccc21 Amb22001506 [0,1,0,1,0,0|2,0,0]=4 9014 B13R2.135 N\N=C/1\C(=O)Cc2ccccc12 Amb24723936 [0,1,0,1,0,0|2,0,0]=4 9015 B13R2.135 N\N=C\1/C(=O)Cc2ccccc12 Amb24633409 [0,1,0,1,0,0|2,0,0]=4 9016 B13R2.135 O=C1Oc2ccccc2N1CCl Amb19773104 [0,1,0,1,0,0|2,0,0]=4 9017 B13R2.135 O=C1Sc2ccccc2N1CCl Amb22337781 [0,1,0,1,0,0|2,0,0]=4 9018 B13R2.135 O=C1Sc2ccccc2N1CCl Amb22358029 [0,1,0,1,0,0|2,0,0]=4 9019 B13R2.135 OCC1=C(Cl)Cc2ccccc12 Amb24462035 [0,1,0,1,0,0|2,0,0]=4 9020 B13R2.135 OCC1C(=O)Nc2ccccc21 Amb24084324 [0,1,0,1,0,0|2,0,0]=4 9021 B13R2.135 OCN1C(=O)Nc2ccccc12 Amb25273874 [0,1,0,1,0,0|2,0,0]=4 9022 B13R2.135 OCN1C(=O)Oc2ccccc12 Amb19806606 [0,1,0,1,0,0|2,0,0]=4 9023 B13R2.135 OCN1C(=O)Sc2ccccc12 Amb21961868 [0,1,0,1,0,0|2,0,0]=4 9024 B13R2.135 OCN1C(=O)Sc2ccccc12 Amb22343799 [0,1,0,1,0,0|2,0,0]=4 9025 B13R2.135 OCn1c(=O)oc2c1cccc2 Amb1006641 [0,1,0,1,0,0|2,0,0]=4 9026 B13R2.135 OCn1c(=O)sc2c1cccc2 Amb16205274 [0,1,0,1,0,0|2,0,0]=4 9027 B13R2.135 O\C=C/1\C(=O)Cc2ccccc12 Amb24518375 [0,1,0,1,0,0|1,0,1]=4 9028 B13R2.138 C[C@@H]1[C@H](C=O)[C@H]1c2ccccc2 Amb25212061 [0,1,0,1,0,0|1,0,1]=4 9029 B13R2.138 C[C@H]1[C@@H](C=O)[C@@H]1c2ccccc2 Amb25302243 [0,1,0,1,0,0|1,0,1]=4 9030 B13R2.138 C[C@H]1[C@H](C=O)[C@@H]1c2ccccc2 Amb24580397 [0,1,0,1,0,0|1,0,1]=4 9031 B13R2.163 NC=1Cc2ccccc2CCN1 Amb22263623 [0,1,0,1,0,0|2,0,0]=4 9032 B13R2.163 O=C1C=CCc2ccccc2N1 Amb24399245 [0,1,0,1,0,0|2,0,0]=4 9033 B13R2.163 O=C1CCCc2c(N1)cccc2 Amb1077569 [0,1,0,1,0,0|2,0,0]=4 9034 B13R2.163 O=C1CCCc2ccccc2O1 Amb22900954 [0,1,0,1,0,0|2,0,0]=4 9035 B13R2.163 O=C1CCNc2c(N1)cccc2 Amb1666975 [0,1,0,1,0,0|2,0,0]=4 9036 B13R2.163 O=C1CCNc2ccccc2N1 Amb21857722 [0,1,0,1,0,0|2,0,0]=4 9037 B13R2.163 O=C1CCOc2c(N1)cccc2 Amb10608982 [0,1,0,1,0,0|2,0,0]=4 9038 B13R2.163 O=C1CCSc2c(N1)cccc2 Amb1154582 [0,1,0,1,0,0|2,0,0]=4 9039 B13R2.163 O=C1CNCc2c(N1)cccc2 Amb17606145 [0,1,0,1,0,0|2,0,0]=4 9040 B13R2.163 O=C1COCc2ccccc2N1 Amb19516346 [0,1,0,1,0,0|1,0,0]=3 9041 B13R2.163 O=C1Cc2cc[n]cc2CCC1 Amb25730512 [0,1,0,1,0,0|2,0,0]=4 9042 B13R2.163 O=C1Cc2ccc[n]c2CCC1 Amb25097103 [0,1,0,1,0,0|2,0,0]=4 9043 B13R2.163 O=C1Cc2ccccc2NCC1 Amb18829955 [0,1,0,1,0,0|1,0,0]=3 9044 B13R2.163 O=C1Cc2ccccc2OCC1 Amb24352115 [0,1,0,1,0,0|1,0,0]=3 9045 B13R2.163 O=C1NCCc2c(C1)cccc2 Amb16203437 [0,1,0,1,0,0|1,0,0]=3 9046 B13R2.163 O=C1Nc2ccccc2CCO1 Amb24495939 [0,1,0,1,0,0|1,0,0]=3 9047 B13R2.163 O=C1Oc2ccccc2N=CO1 Amb24376626 [0,1,0,1,0,0|1,0,1]=4 9048 B13R2.163 S=C1Cc2ccccc2CCN1 Amb25826588 [0,1,0,1,0,0|1,1,0]=4 9049 B13R2.197 C[C@]1(Cc2ccccc2)OC1Cl Amb25238350 [0,1,0,1,0,0|1,0,1]=4 9050 B13R2.221 NC1(COC1)Cc2ccccc2 Amb23439404 [0,1,0,1,0,0|1,0,1]=4 9051 B13R2.328 C=C1OC(=O)Nc2ccccc21 Amb24497158 [0,1,0,1,0,0|1,0,1]=4 9052 B13R2.328 CC1=CC(=O)Nc2ccccc21 Amb19654011 [0,1,0,1,0,0|2,0,0]=4 9053 B13R2.328 CC1=CC(=O)Oc2ccccc21 Amb20001467 [0,1,0,1,0,0|2,0,0]=4 9054 B13R2.328 CC1CC(=O)Nc2ccccc12 Amb17836212 [0,1,0,1,0,0|2,0,0]=4 9055 B13R2.328 CC1NC(=O)Cc2cc[n]cc21 Amb25159362 [0,1,0,1,0,0|2,0,0]=4 9056 B13R2.328 CC1NC(=O)Cc2ccccc21 Amb23454628 [0,1,0,1,0,0|1,0,0]=3 9057 B13R2.328 CC1NC(=O)Nc2ccccc21 Amb22756019 [0,1,0,1,0,0|2,0,0]=4 9058 B13R2.328 CC1NC(=O)Oc2ccccc21 Amb25823463 [0,1,0,1,0,0|2,0,0]=4 9059 B13R2.328 CC1OC(=O)Nc2ccccc21 Amb25063171 [0,1,0,1,0,0|1,0,0]=3 9060 B13R2.328 CC1OC(O)Cc2ccccc21 Amb24355171 [0,1,0,1,0,0|0,0,2]=4 9061 B13R2.328 CC=1NC(=O)C=C2C=CC=CC21 Amb22371049 [0,1,0,1,0,0|1,0,1]=4 9062 B13R2.328 CC=1NC(=O)N=C2C=CC=CC21 Amb22493795 [0,1,0,1,0,0|2,0,0]=4 9063 B13R2.328 CN1CC(=O)Nc2ccccc12 Amb21864918 [0,1,0,1,0,0|2,0,0]=4 9064 B13R2.328 CS1=NC(=O)Nc2ccccc12 Amb25372251 [0,1,0,1,0,0|1,1,0]=4 9065 B13R2.328 C[C@@H]1CC(=O)Nc2ccccc21 Amb24445921 [0,1,0,1,0,0|2,0,0]=4 9066 B13R2.328 C[C@H]1CC(=O)Nc2ccccc21 Amb25335663 [0,1,0,1,0,0|2,0,0]=4 9067 B13R2.328 C[C@H]1NC(=O)Cc2ccccc21 Amb25315064 [0,1,0,1,0,0|1,0,0]=3 9068 B13R2.328 N=C1NC(=O)Cc2ccccc21 Amb25309609 [0,1,0,1,0,0|1,0,1]=4 9069 B13R2.328 NC1CC(=O)Nc2ccccc21 Amb22586933 [0,1,0,1,0,0|2,0,0]=4 9070 B13R2.328 NC1CC(=O)Oc2ccccc21 Amb25249264 [0,1,0,1,0,0|2,0,0]=4 9071 B13R2.328 N[C@@H]1CC(=O)Nc2ccccc21 Amb25766431 [0,1,0,1,0,0|2,0,0]=4 9072 B13R2.328 O=C1CC(C)c2c(C1)cccc2 Amb17594002 [0,1,0,1,0,0|1,0,0]=3 9073 B13R2.328 O=C1CC(N)c2c(N1)cccc2 Amb10607650 [0,1,0,1,0,0|2,0,0]=4 9074 B13R2.328 O=C1Cc2ccccc2C(=S)N1 Amb17843901 [0,1,0,1,0,0|1,0,1]=4 9075 B13R2.328 O=C1NC(=O)c2c(C1)cccc2 Amb1221580 [0,1,0,1,0,0|1,0,1]=4 9076 B13R2.328 O=C1OC(=O)Cc2[n]cccc12 Amb24559883 [0,1,0,1,0,0|1,0,1]=4 9077 B13R2.328 O=C1OC(=O)Nc2ccccc12 Amb18183505 [0,1,0,1,0,0|1,0,1]=4 9078 B13R2.328 O=C1OC(=O)c2c(C1)cccc2 Amb1157145 [0,1,0,1,0,0|0,0,1]=3 9079 B13R2.328 OC1CC(=O)Cc2ccccc21 Amb24707065 [0,1,0,1,0,0|1,0,0]=3 9080 B13R2.328 OC1NC(=O)Oc2ccccc21 Amb25278301 [0,1,0,1,0,0|2,0,0]=4 9081 B13R2.444 C\C(=C\c1ccccc1)\C2CO2 Amb24670055 [0,1,0,1,0,0|1,0,1]=4 9082 B13R2.444 N[C@@H](Cc1ccccc1)[C@H]2CO2 Amb24578801 [0,1,0,1,0,0|1,0,1]=4 9083 B13R2.444 O=C(Cc1cc[n]cc1)C2CC2 Amb25783505 [0,1,0,1,0,0|2,0,0]=4 9084 B13R2.444 O=C(Cc1ccc[n]c1)C2CC2 Amb24717716 [0,1,0,1,0,0|2,0,0]=4 9085 B13R2.444 O=C(Cc1ccccc1)C2CC2 Amb18034012 [0,1,0,1,0,0|1,0,0]=3 9086 B13R2.444 O=C(Cc1ccccc1)C2CO2 Amb25238359 [0,1,0,1,0,0|0,0,0]=2 9087 B13R2.444 O=C(Nc1ccccc1)C2CO2 Amb24377141 [0,1,0,1,0,0|1,0,0]=3 9088 B13R2.444 O=C(Oc1ccccc1)N2CC2 Amb25801716 [0,1,0,1,0,0|2,0,0]=4 9089 B13R2.444 OC(Cc1ccccc1)C2CO2 Amb24497698 [0,1,0,1,0,0|0,0,2]=4 9090 B13R2.444 O[C@@H](Cc1ccccc1)[C@@H]2CO2 Amb24661121 [0,1,0,1,0,0|0,0,2]=4 9091 B13R2.444 O[C@H](Cc1ccccc1)[C@@H]2CO2 Amb24558598 [0,1,0,1,0,0|0,0,2]=4 9092 B13R2.444 O[C@H](Cc1ccccc1)[C@H]2CO2 Amb24752264 [0,1,0,1,0,0|0,0,2]=4 9093 B13R2.45 CC1=C(Cc2ccccc12)C#N Amb17778901 [0,1,0,1,0,0|2,0,0]=4 9094 B13R2.45 CC1=C(Cc2ccccc21)C=O Amb25276375 [0,1,0,1,0,0|1,0,0]=3 9095 B13R2.45 CCC1=Nc2ccccc2C1=O Amb24753327 [0,1,0,1,0,0|2,0,0]=4 9096 B13R2.45 CC[C@H]1Cc2c(C1=O)cccc2 Amb16232572 [0,1,0,1,0,0|1,0,1]=4 9097 B13R2.45 CN1C(Cc2ccccc12)C=O Amb23586332 [0,1,0,1,0,0|1,0,1]=4 9098 B13R2.45 COC1Cc2c(C1N)cccc2 Amb1140146 [0,1,0,1,0,0|1,0,1]=4 9099 B13R2.45 COC1Cc2ccccc2C1=O Amb24532698 [0,1,0,1,0,0|0,0,1]=3 9100 B13R2.45 COC1Cc2ccccc2C1O Amb18800787 [0,1,0,1,0,0|0,0,2]=4 9101 B13R2.45 COC1Oc2ccccc2C1=O Amb24061519 [0,1,0,1,0,0|1,0,1]=4 9102 B13R2.45 CO[C@@H]1Cc2ccccc2[C@@H]1N Amb24519372 [0,1,0,1,0,0|1,0,1]=4 9103 B13R2.45 CO[C@H]1Cc2ccccc2[C@@H]1O Amb24515517 [0,1,0,1,0,0|0,0,2]=4 9104 B13R2.45 CO[C@H]1Cc2ccccc2[C@H]1N Amb24567956 [0,1,0,1,0,0|1,0,1]=4 9105 B13R2.45 COc1oc2ccccc2c1N Amb24061875 [0,1,0,1,0,0|0,0,2]=4 9106 B13R2.45 CSC1=Nc2ccccc2C1=O Amb25136885 [0,1,0,1,0,0|1,1,0]=4 9107 B13R2.45 C\C=C/1\Cc2ccccc2C1=O Amb24602951 [0,1,0,1,0,0|1,0,0]=3 9108 B13R2.45 C\C=C\1/Oc2ccccc2C1=O Amb24408418 [0,1,0,1,0,0|2,0,0]=4 9109 B13R2.45 C\C=C\1/Sc2ccccc2C1=O Amb25773427 [0,1,0,1,0,0|2,0,0]=4 9110 B13R2.45 C\N=C/1\Nc2ccccc2C1C Amb24512972 [0,1,0,1,0,0|2,0,0]=4 9111 B13R2.45 C\N=C\1/Nc2ccccc2C1=O Amb25130630 [0,1,0,1,0,0|2,0,0]=4 9112 B13R2.45 N\C=C/1\Cc2ccccc2C1=O Amb24553059 [0,1,0,1,0,0|2,0,0]=4 9113 B13R2.45 N\N=C\1/Cc2ccccc2C1=O Amb24364156 [0,1,0,1,0,0|2,0,0]=4 9114 B13R2.45 O=CC=1Cc2ccccc2C1Cl Amb18128299 [0,1,0,1,0,0|2,0,0]=4 9115 B13R2.45 O\C=C\1/Cc2ccccc2C1=O Amb19665720 [0,1,0,1,0,0|2,0,0]=4 9116 B13R2.45 O\N=C\1/Cc2ccccc2C1=O Amb22348033 [0,1,0,1,0,0|2,0,0]=4 9117 B13R2.45 [N-]=[N+]=C1Cc2c(C1=O)cccc2 Amb17593950 [0,1,0,1,0,0|2,0,0]=4 9118 B13R2.45 [O-]C=C1Cc2ccccc2C1=O Amb20669424 [0,1,0,1,0,0|2,0,0]=4 9119 B13R2.56 N\N=C/1\CCC1c2ccccc2 Amb25855473 [0,1,0,1,0,0|2,0,0]=4 9120 B13R2.56 OCC1OCC1c2ccccc2 Amb24703890 [0,1,0,1,0,0|0,0,2]=4 9121 B13R2.56 O\N=C/1\CCC1c2ccccc2 Amb25247166 [0,1,0,1,0,0|1,0,1]=4 9122 B13R2.382 CC=1CC1C(O)c2ccccc2 Amb24465590 [0,1,0,1,0,0|2,0,0]=4 9123 B13R2.413 CC1(CCC1=O)c2ccccc2 Amb22496413 [0,1,0,1,0,0|1,0,0]=3 9124 B13R2.413 C[C@]1(CCC1=O)c2ccccc2 Amb24608634 [0,1,0,1,0,0|1,0,0]=3 9125 B13R2.413 O=C1NC[C@]1(Cl)c2ccccc2 Amb25159108 [0,1,0,1,0,0|1,0,0]=3 9126 B13R2.413 OC1(CCC1=O)c2ccccc2 Amb25717703 [0,1,0,1,0,0|1,0,0]=3 9127 B13R2.413 OC1(CNC1=O)c2ccccc2 Amb24682843 [0,1,0,1,0,0|1,0,0]=3 9128 B13R2.413 O[C@@]1(CNC1=O)c2ccccc2 Amb24419956 [0,1,0,1,0,0|1,0,0]=3 9129 B13R2.413 O[C@]1(CNC1=O)c2ccccc2 Amb24680220 [0,1,0,1,0,0|1,0,0]=3 9130 B13R2.3085 CC1C(=N)N(C)c2ccccc21 Amb22536459 [0,1,0,1,0,0|2,0,0]=4 9131 B13R2.3085 CC1C(=O)N(C)c2ccccc21 Amb24273383 [0,1,0,1,0,0|1,0,0]=3 9132 B13R2.3085 CC=1c2ccccc2C(C)C1Br Amb25849928 [0,1,0,1,0,0|2,0,0]=4 9133 B13R2.3085 CN1C(=O)C(Br)c2ccccc12 Amb22749190 [0,1,0,1,0,0|1,0,0]=3 9134 B13R2.3085 CN1C(=O)C(N)c2ccccc12 Amb22586861 [0,1,0,1,0,0|1,0,0]=3 9135 B13R2.3085 CN1C(=O)N(C)c2ccccc12 Amb18004177 [0,1,0,1,0,0|2,0,0]=4 9136 B13R2.3085 CN1C(=O)N(O)c2ccccc12 Amb25174132 [0,1,0,1,0,0|2,0,0]=4 9137 B13R2.3085 N=C1N(C)c2c(C1C)cccc2 Amb16210593 [0,1,0,1,0,0|2,0,0]=4 9138 B13R2.3085 NC1C(=O)N(O)c2ccccc21 Amb24073758 [0,1,0,1,0,0|2,0,0]=4 9139 B13R2.3085 NC1C(=O)N(O)c2ccccc21 Amb25059235 [0,1,0,1,0,0|2,0,0]=4 9140 B13R2.3085 O=c1n(C)c2c(n1C)cccc2 Amb1778538 [0,1,0,1,0,0|2,0,0]=4 9141 B13R2.3085 O[C@@H]1C(=O)N(O)c2ccccc21 Amb24748466 [0,1,0,1,0,0|2,0,0]=4 9142 B13R2.3085 O[C@H]1C(=O)N(O)c2ccccc21 Amb24524815 [0,1,0,1,0,0|2,0,0]=4 9143 B13R2.8138 C[C@]1(CO1)[C@H](O)c2ccccc2 Amb24520202 [0,1,0,1,0,0|1,0,1]=4 9144 B13R2.359 CC1(Br)C(=O)Nc2ccccc12 Amb24566678 [0,1,0,1,0,0|2,0,0]=4 9145 B13R2.359 CC1(C)C(=O)Cc2ccccc12 Amb25751377 [0,1,0,1,0,0|1,0,0]=3 9146 B13R2.359 CC1(F)C(=O)Nc2ccccc12 Amb25690290 [0,1,0,1,0,0|2,0,0]=4 9147 B13R2.359 CC1(O)C(=O)Nc2ccccc12 Amb22059446 [0,1,0,1,0,0|2,0,0]=4 9148 B13R2.359 C[C@@]1(F)C(=O)Nc2ccccc12 Amb24383132 [0,1,0,1,0,0|2,0,0]=4 9149 B13R2.359 C[C@@]1(O)C(=O)Cc2ccccc12 Amb24341855 [0,1,0,1,0,0|1,0,0]=3 9150 B13R2.359 C[C@]1(N)C(=O)Nc2ccccc12 Amb24365952 [0,1,0,1,0,0|2,0,0]=4 9151 B13R2.359 C[C@]1(O)C(=O)Cc2ccccc12 Amb24432232 [0,1,0,1,0,0|1,0,0]=3 9152 B13R2.369 C=C1Cc2ccccc2NC1=O Amb25263953 [0,1,0,1,0,0|2,0,0]=4 9153 B13R2.369 CC1=Cc2ccccc2NC1=O Amb19115338 [0,1,0,1,0,0|2,0,0]=4 9154 B13R2.369 CC1=Cc2ccccc2OC1=O Amb20247474 [0,1,0,1,0,0|2,0,0]=4 9155 B13R2.369 CC1=Nc2ccccc2NC1=O Amb18368610 [0,1,0,1,0,0|2,0,0]=4 9156 B13R2.369 CC1C=C2C=CC=CC2=NC1=O Amb22015245 [0,1,0,1,0,0|2,0,0]=4 9157 B13R2.369 CC1Cc2ccccc2OC1=O Amb24484179 [0,1,0,1,0,0|2,0,0]=4 9158 B13R2.369 CC1N=C2C=CC=CC2=CC1=O Amb24061572 [0,1,0,1,0,0|1,0,1]=4 9159 B13R2.369 CC1Nc2ccccc2NC1=O Amb2418151 [0,1,0,1,0,0|2,0,0]=4 9160 B13R2.369 CC1Oc2ccccc2CC1=O Amb24583554 [0,1,0,1,0,0|1,0,0]=3 9161 B13R2.369 CN1Cc2ccccc2CC1=O Amb22388960 [0,1,0,1,0,0|1,0,0]=3 9162 B13R2.369 CN1Sc2ccccc2NC1=O Amb25827228 [0,1,0,1,0,0|2,0,0]=4 9163 B13R2.369 C[C@@H]1Cc2ccccc2NC1=O Amb25795819 [0,1,0,1,0,0|2,0,0]=4 9164 B13R2.369 C[C@@H]1Nc2ccccc2NC1=O Amb24382630 [0,1,0,1,0,0|2,0,0]=4 9165 B13R2.369 C[C@H]1Cc2ccccc2NC1=O Amb25707457 [0,1,0,1,0,0|2,0,0]=4 9166 B13R2.369 C[C@H]1Nc2ccccc2NC1=O Amb24653859 [0,1,0,1,0,0|2,0,0]=4 9167 B13R2.369 C[C@H]1Nc2ccccc2OC1=O Amb25152544 [0,1,0,1,0,0|2,0,0]=4 9168 B13R2.369 NC1Cc2ccccc2OC1=O Amb18645811 [0,1,0,1,0,0|2,0,0]=4 9169 B13R2.369 NN1Cc2ccccc2CC1=O Amb18645670 [0,1,0,1,0,0|1,0,0]=3 9170 B13R2.369 N[C@H]1Cc2ccccc2NC1=O Amb25212947 [0,1,0,1,0,0|2,0,0]=4 9171 B13R2.369 O=C1Nc2ccccc2CC1=O Amb24497058 [0,1,0,1,0,0|2,0,0]=4 9172 B13R2.369 O=C1Nc2ccccc2CC1Br Amb10601380 [0,1,0,1,0,0|2,0,0]=4 9173 B13R2.369 O=C1Nc2ccccc2CC1C Amb10604462 [0,1,0,1,0,0|2,0,0]=4 9174 B13R2.369 O=C1Nc2ccccc2CC1Cl Amb22739973 [0,1,0,1,0,0|2,0,0]=4 9175 B13R2.369 O=C1Nc2ccccc2CC1N Amb10975380 [0,1,0,1,0,0|2,0,0]=4 9176 B13R2.369 O=C1Nc2ccccc2CC1N Amb2196732 [0,1,0,1,0,0|2,0,0]=4 9177 B13R2.369 O=C1Nc2ccccc2OC1C Amb2568450 [0,1,0,1,0,0|2,0,0]=4 9178 B13R2.369 O=C1Oc2ccccc2CC1=O Amb22755081 [0,1,0,1,0,0|2,0,0]=4 9179 B13R2.369 O=C1Oc2ccccc2NC1C Amb17217247 [0,1,0,1,0,0|2,0,0]=4 9180 B13R2.369 O=C1Sc2ccccc2CC1=O Amb24497321 [0,1,0,1,0,0|2,0,0]=4 9181 B13R2.369 OC1Cc2ccccc2NC1=O Amb22899290 [0,1,0,1,0,0|2,0,0]=4 9182 B13R2.369 OC1Cc2ccccc2OC1=O Amb25158158 [0,1,0,1,0,0|2,0,0]=4 9183 B13R2.369 O[C@@H]1Cc2ccccc2NC1=O Amb25097865 [0,1,0,1,0,0|2,0,0]=4 9184 B13R2.435 CC(=O)C1=Cc2ccccc2C1 Amb17777848 [0,1,0,1,0,0|2,0,0]=4 9185 B13R2.435 CN(C)C=1Cc2ccccc2N1 Amb25351838 [0,1,0,1,0,0|2,0,0]=4 9186 B13R2.43 CCC=1Cc2cc(N)ccc2C1 Amb25129520 [0,1,0,1,0,0|2,0,0]=4 9187 B13R2.43 COC1Cc2cc(O)ccc2C1 Amb24754414 [0,1,0,1,0,0|1,0,1]=4 9188 B13R2.43 COc1[nH]c2cc(Br)ccc2[n]1 Amb24728756 [0,1,0,1,0,0|2,0,0]=4 9189 B13R2.43 COc1[nH]c2cc(F)ccc2[n]1 Amb25252998 [0,1,0,1,0,0|2,0,0]=4 9190 B13R2.43 COc1[nH]c2cc(S)ccc2[n]1 Amb24596146 [0,1,0,1,0,0|2,0,0]=4 9191 B13R2.43 COc1[nH]c2ccc(O)cc2[n]1 Amb24357716 [0,1,0,1,0,0|2,0,0]=4 9192 B13R2.43 COc1[n]c2cc(Br)ccc2o1 Amb24541094 [0,1,0,1,0,0|1,0,1]=4 9193 B13R2.43 COc1[n]c2cc(Cl)ccc2o1 Amb22753782 [0,1,0,1,0,0|1,0,1]=4 9194 B13R2.43 COc1[n]c2cc(F)ccc2[s]1 Amb23400326 [0,1,0,1,0,0|1,1,0]=4 9195 B13R2.43 COc1[n]c2cc(N)ccc2[s]1 Amb22643345 [0,1,0,1,0,0|1,1,0]=4 9196 B13R2.43 COc1[n]c2cc(N)ccc2o1 Amb20622740 [0,1,0,1,0,0|1,0,1]=4 9197 B13R2.43 COc1[n]c2ccc(Cl)cc2[s]1 Amb25825902 [0,1,0,1,0,0|1,1,0]=4 9198 B13R2.43 COc1[n]c2ccc(I)cc2[s]1 Amb25036364 [0,1,0,1,0,0|1,1,0]=4 9199 B13R2.43 COc1[n]c2ccc(I)cc2o1 Amb25364535 [0,1,0,1,0,0|1,0,1]=4 9200 B13R2.43 COc1[n]c2ccc(N)cc2[s]1 Amb18648379 [0,1,0,1,0,0|1,1,0]=4 9201 B13R2.43 COc1[n]c2ccc(O)cc2[s]1 Amb25694078 [0,1,0,1,0,0|1,1,0]=4 9202 B13R2.43 COc1[n]c2ccc(S)cc2o1 Amb24579296 [0,1,0,1,0,0|1,0,1]=4 9203 B13R2.43 COc1cc2ccc(F)cc2[nH]1 Amb25102730 [0,1,0,1,0,0|1,0,1]=4 9204 B13R2.43 Cc1ccc2[nH]c([n]c2c1)OC Amb24378895 [0,1,0,1,0,0|2,0,0]=4 9205 B13R2.43 Cc1ccc2[n]c(OC)[s]c2c1 Amb24084572 [0,1,0,1,0,0|1,1,0]=4 9206 B13R2.43 Cc1ccc2oc([n]c2c1)OC Amb25268636 [0,1,0,1,0,0|1,0,1]=4 9207 B13R2.146 Cc1ccc(cc1)C2CCC2=O Amb25202633 [0,1,0,1,0,0|1,0,0]=3 9208 B13R2.146 Cc1ccc(cc1)C2CNC2=O Amb25211716 [0,1,0,1,0,0|1,0,0]=3 9209 B13R2.146 Nc1ccc(cc1)C2CNC2=O Amb18135774 [0,1,0,1,0,0|1,0,0]=3 9210 B13R2.148 CC1(Cc2ccc(Br)cc2)CO1 Amb25106431 [0,1,0,1,0,0|1,0,1]=4 9211 B13R2.148 CC1(Cc2ccc(Cl)cc2)CO1 Amb24581859 [0,1,0,1,0,0|1,0,1]=4 9212 B13R2.1062 Cc1ccc(cc1)C=2C(=O)C2C Amb25751553 [0,1,0,1,0,0|1,0,1]=4 9213 B13R2.1069 Brc1ccc(CC=2CCC2)cc1 Amb24429629 [0,1,0,1,0,0|2,0,0]=4 9214 B13R2.3028 CC1C(=O)Nc2ccc(F)cc21 Amb18893506 [0,1,0,1,0,0|2,0,0]=4 9215 B13R2.3028 CC1C(=O)Nc2ccc(I)cc21 Amb23571303 [0,1,0,1,0,0|2,0,0]=4 9216 B13R2.3028 CC1C(=O)Nc2ccc(O)cc21 Amb22886916 [0,1,0,1,0,0|2,0,0]=4 9217 B13R2.3028 CC1C(=O)Nc2ccc(S)cc21 Amb24637609 [0,1,0,1,0,0|2,0,0]=4 9218 B13R2.3028 CN1C(=O)Cc2ccc(Br)cc12 Amb24179225 [0,1,0,1,0,0|1,0,0]=3 9219 B13R2.3028 CN1C(=O)Cc2ccc(Cl)cc12 Amb25095417 [0,1,0,1,0,0|1,0,0]=3 9220 B13R2.3028 CN1C(=O)Cc2ccc(F)cc12 Amb24485706 [0,1,0,1,0,0|1,0,0]=3 9221 B13R2.3028 CN1C(=O)Cc2ccc(N)cc12 Amb21960712 [0,1,0,1,0,0|1,0,0]=3 9222 B13R2.3028 CN1C(=O)Nc2ccc(Br)cc12 Amb22750351 [0,1,0,1,0,0|2,0,0]=4 9223 B13R2.3028 CN1C(=O)Nc2ccc(N)cc12 Amb23438841 [0,1,0,1,0,0|2,0,0]=4 9224 B13R2.3028 CN1C(=O)Nc2ccc(O)cc12 Amb25841001 [0,1,0,1,0,0|2,0,0]=4 9225 B13R2.3028 CN1C(=O)Oc2ccc(Br)cc12 Amb18539364 [0,1,0,1,0,0|2,0,0]=4 9226 B13R2.3028 CN1C(=O)Oc2ccc(Cl)cc12 Amb18036634 [0,1,0,1,0,0|2,0,0]=4 9227 B13R2.3028 CN1C(=O)Oc2ccc(F)cc12 Amb18539350 [0,1,0,1,0,0|2,0,0]=4 9228 B13R2.3028 CN1C(=O)Oc2ccc(N)cc12 Amb18015310 [0,1,0,1,0,0|2,0,0]=4 9229 B13R2.3028 CN1C(=O)Oc2ccc(O)cc12 Amb24722825 [0,1,0,1,0,0|2,0,0]=4 9230 B13R2.3028 CN1C(=O)Oc2ccc(S)cc12 Amb25800828 [0,1,0,1,0,0|2,0,0]=4 9231 B13R2.3028 CN1C(=O)Sc2ccc(Br)cc12 Amb22753806 [0,1,0,1,0,0|2,0,0]=4 9232 B13R2.3028 CN1C(=O)Sc2ccc(Cl)cc12 Amb22753798 [0,1,0,1,0,0|2,0,0]=4 9233 B13R2.3028 CN1C(=S)Cc2ccc(Cl)cc12 Amb19374195 [0,1,0,1,0,0|1,1,0]=4 9234 B13R2.3028 Cc1cc2c(CC(=O)C2=O)cc1 Amb22230094 [0,1,0,1,0,0|2,0,0]=4 9235 B13R2.3028 Cc1ccc2NC(=O)N(C)c2c1 Amb24365326 [0,1,0,1,0,0|2,0,0]=4 9236 B13R2.3028 Cc1ccc2OC(=O)C(C)c2c1 Amb24085550 [0,1,0,1,0,0|2,0,0]=4 9237 B13R2.3028 Cc1ccc2OC(=O)N(C)c2c1 Amb18036628 [0,1,0,1,0,0|2,0,0]=4 9238 B13R2.3028 O=C1Nc2c(C1C)cc(cc2)Br Amb17142135 [0,1,0,1,0,0|2,0,0]=4 9239 B13R2.3028 O=C1Nc2c(C1C)cc(cc2)C Amb17232373 [0,1,0,1,0,0|2,0,0]=4 9240 B13R2.3028 O=C1Nc2c(C1C)cc(cc2)Cl Amb17233869 [0,1,0,1,0,0|2,0,0]=4 9241 B13R2.3028 O=C1c2cc(Br)ccc2CC1=O Amb24493250 [0,1,0,1,0,0|2,0,0]=4 9242 B13R2.3683 C=C1Cc2ccc(Br)cc2CC1 Amb25151065 [0,1,0,1,0,0|2,0,0]=4 9243 B13R2.3683 CN1Cc2ccc(Cl)cc2CO1 Amb24721573 [0,1,0,1,0,0|2,0,0]=4 9244 B13R2.3683 Cc1cc2CCC(=O)Oc2cc1 Amb21928518 [0,1,0,1,0,0|2,0,0]=4 9245 B13R2.3683 Cc1cc2CNC(=O)Cc2cc1 Amb22499417 [0,1,0,1,0,0|1,0,0]=3 9246 B13R2.3683 Cc1ccc2CC(=O)CNc2c1 Amb25159769 [0,1,0,1,0,0|2,0,0]=4 9247 B13R2.3683 Cc1ccc2CC(=O)COc2c1 Amb25148618 [0,1,0,1,0,0|2,0,0]=4 9248 B13R2.3683 Cc1ccc2NC(=O)OCc2c1 Amb24375241 [0,1,0,1,0,0|1,0,0]=3 9249 B13R2.3683 Cc1ccc2OC(=O)NCc2c1 Amb24417945 [0,1,0,1,0,0|2,0,0]=4 9250 B13R2.3683 Fc1ccc2OC(=S)OCc2c1 Amb25238543 [0,1,0,1,0,0|1,1,0]=4 9251 B13R2.3683 Nc1cc2CCC(=O)Nc2cc1 Amb22500684 [0,1,0,1,0,0|2,0,0]=4 9252 B13R2.3683 Nc1cc2CCC(=O)Oc2cc1 Amb25114635 [0,1,0,1,0,0|2,0,0]=4 9253 B13R2.3683 Nc1cc2CNC(=O)Cc2cc1 Amb22491860 [0,1,0,1,0,0|1,0,0]=3 9254 B13R2.3683 Nc1ccc2CC(=O)CCc2[n]1 Amb25336325 [0,1,0,1,0,0|2,0,0]=4 9255 B13R2.3683 Nc1ccc2OC(=O)OCc2c1 Amb25222777 [0,1,0,1,0,0|1,0,0]=3 9256 B13R2.3683 O=C1CC=2C=CC(=O)NC2CC1 Amb25072696 [0,1,0,1,0,0|2,0,0]=4 9257 B13R2.3683 O=C1CCc2c(C1)ccc(c2)Br Amb2383560 [0,1,0,1,0,0|1,0,0]=3 9258 B13R2.3683 O=C1CCc2c(C1)ccc(c2)Cl Amb2383559 [0,1,0,1,0,0|1,0,0]=3 9259 B13R2.3683 O=C1CCc2c(C1)ccc(c2)F Amb2383561 [0,1,0,1,0,0|1,0,0]=3 9260 B13R2.3683 O=C1CCc2c(C1)ccc(c2)I Amb15692704 [0,1,0,1,0,0|1,0,0]=3 9261 B13R2.3683 O=C1CCc2c(N1)ccc(c2)C Amb17545227 [0,1,0,1,0,0|2,0,0]=4 9262 B13R2.3683 O=C1CCc2c(N1)ccc(c2)I Amb17545217 [0,1,0,1,0,0|2,0,0]=4 9263 B13R2.3683 O=C1CCc2c(N1)ccc(c2)N Amb1071171 [0,1,0,1,0,0|2,0,0]=4 9264 B13R2.3683 O=C1CCc2c(N1)ccc(c2)O Amb2371818 [0,1,0,1,0,0|2,0,0]=4 9265 B13R2.3683 O=C1CCc2c(N1)ccc(c2)S Amb1111574 [0,1,0,1,0,0|2,0,0]=4 9266 B13R2.3683 O=C1CCc2c(O1)ccc(c2)Br Amb10603027 [0,1,0,1,0,0|2,0,0]=4 9267 B13R2.3683 O=C1CCc2cc(Cl)ccc2O1 Amb24071938 [0,1,0,1,0,0|2,0,0]=4 9268 B13R2.3683 O=C1Cc2[n]cc(Br)cc2CN1 Amb25714371 [0,1,0,1,0,0|2,0,0]=4 9269 B13R2.3683 O=C1Cc2[n]cc(Cl)cc2CN1 Amb24554408 [0,1,0,1,0,0|2,0,0]=4 9270 B13R2.3683 O=C1Cc2c[n]c(Br)cc2CN1 Amb24436568 [0,1,0,1,0,0|2,0,0]=4 9271 B13R2.3683 O=C1Cc2ccc(Br)cc2CN1 Amb19957763 [0,1,0,1,0,0|1,0,0]=3 9272 B13R2.3683 O=C1Cc2ccc(Br)cc2OC1 Amb21964898 [0,1,0,1,0,0|2,0,0]=4 9273 B13R2.3683 O=C1Cc2ccc(Cl)[n]c2CC1 Amb25829443 [0,1,0,1,0,0|2,0,0]=4 9274 B13R2.3683 O=C1Cc2ccc(Cl)cc2CN1 Amb24453833 [0,1,0,1,0,0|1,0,0]=3 9275 B13R2.3683 O=C1Cc2ccc(Cl)cc2OC1 Amb20241414 [0,1,0,1,0,0|2,0,0]=4 9276 B13R2.3683 O=C1Cc2ccc(F)cc2NC1 Amb24438628 [0,1,0,1,0,0|2,0,0]=4 9277 B13R2.3683 O=C1Cc2ccc(F)cc2OC1 Amb20241415 [0,1,0,1,0,0|2,0,0]=4 9278 B13R2.3683 O=C1NCc2c(C1)ccc(c2)N Amb10603888 [0,1,0,1,0,0|1,0,0]=3 9279 B13R2.3683 O=C1NCc2cc(Br)ccc2N1 Amb22436821 [0,1,0,1,0,0|2,0,0]=4 9280 B13R2.3683 O=C1NCc2cc(Br)ccc2O1 Amb21858217 [0,1,0,1,0,0|2,0,0]=4 9281 B13R2.3683 O=C1NCc2cc(Cl)ccc2O1 Amb24084254 [0,1,0,1,0,0|2,0,0]=4 9282 B13R2.3683 O=C1NCc2cc(F)ccc2N1 Amb25274443 [0,1,0,1,0,0|2,0,0]=4 9283 B13R2.3683 O=C1NCc2cc(F)ccc2O1 Amb25195069 [0,1,0,1,0,0|2,0,0]=4 9284 B13R2.3683 O=C1OCc2c(N1)ncc(c2)Br Amb10975393 [0,1,0,1,0,0|2,0,0]=4 9285 B13R2.3683 Oc1cc2CCC(=O)Oc2cc1 Amb24097420 [0,1,0,1,0,0|2,0,0]=4 9286 B13R2.3683 Oc1cc2CNC(=O)Cc2cc1 Amb18645799 [0,1,0,1,0,0|1,0,0]=3 9287 B13R2.3683 Oc1ccc2OC(=O)OCc2c1 Amb25228168 [0,1,0,1,0,0|1,0,0]=3 9288 B13R2.54 CCC=1Cc2c(Cl)cccc2C1 Amb20242793 [0,1,0,1,0,0|2,0,0]=4 9289 B13R2.54 COc1[nH]c2c(Br)cccc2[n]1 Amb25218532 [0,1,0,1,0,0|2,0,0]=4 9290 B13R2.54 COc1[nH]c2c(N)cccc2[n]1 Amb24432588 [0,1,0,1,0,0|2,0,0]=4 9291 B13R2.54 COc1[nH]c2cccc(Cl)c2[n]1 Amb24565141 [0,1,0,1,0,0|2,0,0]=4 9292 B13R2.54 COc1[nH]c2cccc(F)c2[n]1 Amb20621285 [0,1,0,1,0,0|2,0,0]=4 9293 B13R2.54 COc1[n]c2c(cccc2F)o1 Amb24679524 [0,1,0,1,0,0|1,0,1]=4 9294 B13R2.54 COc1[n]c2cccc(Br)c2[s]1 Amb25202246 [0,1,0,1,0,0|1,1,0]=4 9295 B13R2.54 COc1[n]c2cccc(N)c2[s]1 Amb24084527 [0,1,0,1,0,0|1,1,0]=4 9296 B13R2.54 COc1[n]c2cccc(O)c2o1 Amb24651369 [0,1,0,1,0,0|1,0,1]=4 9297 B13R2.54 Cc1cccc2[n]c(oc12)OC Amb24574315 [0,1,0,1,0,0|1,0,1]=4 9298 B13R2.54 Cc1cccc2[s]c([n]c12)OC Amb24086423 [0,1,0,1,0,0|1,1,0]=4 9299 B13R2.54 Cc1cccc2oc(cc12)OC Amb24084551 [0,1,0,1,0,0|0,0,2]=4 9300 B13R2.150 Nc1cc(ccc1)C2CNC2=O Amb18135865 [0,1,0,1,0,0|1,0,0]=3 9301 B13R2.150 Nc1cc(ccc1)N2CCC2=O Amb24667320 [0,1,0,1,0,0|2,0,0]=4 9302 B13R2.150 O=C1CCC1c2cccc(Br)c2 Amb24497546 [0,1,0,1,0,0|1,0,0]=3 9303 B13R2.150 O=C1CCC1c2cccc(Cl)c2 Amb24497545 [0,1,0,1,0,0|1,0,0]=3 9304 B13R2.150 O=C1CCN1c2cccc(Br)c2 Amb22899322 [0,1,0,1,0,0|2,0,0]=4 9305 B13R2.152 CC1(Cc2cccc(F)c2)CO1 Amb25341753 [0,1,0,1,0,0|1,0,1]=4 9306 B13R2.155 Brc1cc2NC(=O)NCc2cc1 Amb15693525 [0,1,0,1,0,0|2,0,0]=4 9307 B13R2.155 Brc1cc2NC(=O)OCc2cc1 Amb16233697 [0,1,0,1,0,0|1,0,0]=3 9308 B13R2.155 CN1Cc2cc(Cl)ccc2CO1 Amb24347678 [0,1,0,1,0,0|2,0,0]=4 9309 B13R2.155 CN1Cc2cc(N)ccc2CO1 Amb25783907 [0,1,0,1,0,0|2,0,0]=4 9310 B13R2.155 Cc1cc2CC(=O)COc2cc1 Amb25318923 [0,1,0,1,0,0|2,0,0]=4 9311 B13R2.155 Cc1cc2CC(=O)NCc2c[n]1 Amb25825998 [0,1,0,1,0,0|2,0,0]=4 9312 B13R2.155 Cc1cc2NC(=O)CCc2cc1 Amb17470423 [0,1,0,1,0,0|2,0,0]=4 9313 B13R2.155 Cc1cc2NC(=O)NCc2cc1 Amb25178225 [0,1,0,1,0,0|2,0,0]=4 9314 B13R2.155 Cc1cc2NC(=O)OCc2cc1 Amb24495816 [0,1,0,1,0,0|1,0,0]=3 9315 B13R2.155 Clc1cc2CC(=O)COc2cc1 Amb15692706 [0,1,0,1,0,0|2,0,0]=4 9316 B13R2.155 Fc1cc2OC(=S)OCc2cc1 Amb25178372 [0,1,0,1,0,0|1,1,0]=4 9317 B13R2.155 Nc1cc2NC(=O)NCc2cc1 Amb22754754 [0,1,0,1,0,0|2,0,0]=4 9318 B13R2.155 Nc1cc2NC(=O)OCc2cc1 Amb25765690 [0,1,0,1,0,0|1,0,0]=3 9319 B13R2.155 Nc1cc2OC(=O)NCc2cc1 Amb24514255 [0,1,0,1,0,0|2,0,0]=4 9320 B13R2.155 O=C1CCc2ccc(Br)cc2O1 Amb21928269 [0,1,0,1,0,0|2,0,0]=4 9321 B13R2.155 O=C1CCc2ccc(I)cc2N1 Amb22490797 [0,1,0,1,0,0|2,0,0]=4 9322 B13R2.155 O=C1Cc2[n]c(Br)ccc2CN1 Amb25715478 [0,1,0,1,0,0|2,0,0]=4 9323 B13R2.155 O=C1Cc2cc(Br)ccc2CN1 Amb25799361 [0,1,0,1,0,0|1,0,0]=3 9324 B13R2.155 O=C1Cc2cc(Br)ccc2NC1 Amb18160330 [0,1,0,1,0,0|2,0,0]=4 9325 B13R2.155 O=C1Cc2cc(Br)ccc2OC1 Amb22001903 [0,1,0,1,0,0|2,0,0]=4 9326 B13R2.155 O=C1Cc2cc(Cl)[n]cc2CN1 Amb25091032 [0,1,0,1,0,0|2,0,0]=4 9327 B13R2.155 O=C1Cc2cc(Cl)ccc2CN1 Amb25250743 [0,1,0,1,0,0|1,0,0]=3 9328 B13R2.155 O=C1Cc2cc(F)ccc2OC1 Amb21964897 [0,1,0,1,0,0|2,0,0]=4 9329 B13R2.155 O=C1Cc2cc(I)ccc2OC1 Amb22498280 [0,1,0,1,0,0|2,0,0]=4 9330 B13R2.155 O=C1NCc2ccc(F)cc2N1 Amb25243223 [0,1,0,1,0,0|2,0,0]=4 9331 B13R2.155 O=C1OCc2ccc(F)cc2O1 Amb25350783 [0,1,0,1,0,0|1,0,0]=3 9332 B13R2.155 Oc1cc2NC(=O)NCc2cc1 Amb24066314 [0,1,0,1,0,0|2,0,0]=4 9333 B13R2.155 Oc1cc2NC(=O)OCc2cc1 Amb24563624 [0,1,0,1,0,0|1,0,0]=3 9334 B13R2.4856 CC1C(=O)Nc2cccc(Cl)c21 Amb25312687 [0,1,0,1,0,0|2,0,0]=4 9335 B13R2.4856 CC1C(=O)Oc2cccc(O)c21 Amb24070370 [0,1,0,1,0,0|2,0,0]=4 9336 B13R2.4856 CN1C(=O)Cc2cccc(Br)c12 Amb23586172 [0,1,0,1,0,0|1,0,0]=3 9337 B13R2.4856 CN1C(=O)Nc2cccc(Br)c12 Amb22750352 [0,1,0,1,0,0|2,0,0]=4 9338 B13R2.4856 CN1C(=O)Nc2cccc(O)c12 Amb25771051 [0,1,0,1,0,0|2,0,0]=4 9339 B13R2.4856 CN1C(=O)Oc2cccc(N)c12 Amb18102350 [0,1,0,1,0,0|2,0,0]=4 9340 B13R2.4856 CN1C(=O)Sc2cccc(Cl)c12 Amb22753800 [0,1,0,1,0,0|2,0,0]=4 9341 B13R2.4856 Cc1cccc2CC(=O)N(C)c12 Amb24406006 [0,1,0,1,0,0|1,0,0]=3 9342 B13R2.4856 Cc1cccc2CC(=S)N(C)c12 Amb25848577 [0,1,0,1,0,0|1,1,0]=4 9343 B13R2.4856 Cc1cccc2oc(=O)[n](C)c12 Amb24082757 [0,1,0,1,0,0|2,0,0]=4 9344 B13R2.5179 Brc1cccc2c1OCC(=O)C2 Amb15692701 [0,1,0,1,0,0|2,0,0]=4 9345 B13R2.5179 Cc1[n]ccc2CC(=O)NCc21 Amb25343307 [0,1,0,1,0,0|2,0,0]=4 9346 B13R2.5179 Cc1cccc2OC(=O)NCc21 Amb25178458 [0,1,0,1,0,0|2,0,0]=4 9347 B13R2.5179 Cc1cccc2OC(=O)OCc21 Amb25238546 [0,1,0,1,0,0|1,0,0]=3 9348 B13R2.5179 Cc1cccc2c1CCC(=O)N2 Amb17470424 [0,1,0,1,0,0|2,0,0]=4 9349 B13R2.5179 Clc1cccc2c1CCC(=O)N2 Amb17470647 [0,1,0,1,0,0|2,0,0]=4 9350 B13R2.5179 Fc1cccc2OC(=S)OCc21 Amb25246763 [0,1,0,1,0,0|1,1,0]=4 9351 B13R2.5179 Fc1cccc2c1CCC(=O)N2 Amb17470457 [0,1,0,1,0,0|2,0,0]=4 9352 B13R2.5179 Nc1cccc2OC(=O)NCc21 Amb25228064 [0,1,0,1,0,0|2,0,0]=4 9353 B13R2.5179 Nc1cccc2c1CCC(=O)N2 Amb17505562 [0,1,0,1,0,0|2,0,0]=4 9354 B13R2.5179 O=C1CCc2c(Br)cccc2N1 Amb20075766 [0,1,0,1,0,0|2,0,0]=4 9355 B13R2.5179 O=C1CCc2c(Cl)cccc2O1 Amb25130472 [0,1,0,1,0,0|2,0,0]=4 9356 B13R2.5179 O=C1Cc2cc[n]c(Br)c2CN1 Amb25198257 [0,1,0,1,0,0|2,0,0]=4 9357 B13R2.5179 O=C1Cc2cc[n]c(Cl)c2CN1 Amb25156698 [0,1,0,1,0,0|2,0,0]=4 9358 B13R2.5179 O=C1Cc2cccc(Cl)c2OC1 Amb22498279 [0,1,0,1,0,0|2,0,0]=4 9359 B13R2.5179 O=C1Cc2cccc(F)c2CN1 Amb25364617 [0,1,0,1,0,0|1,0,0]=3 9360 B13R2.5179 O=C1Cc2cccc(I)c2CC1 Amb20241953 [0,1,0,1,0,0|1,0,0]=3 9361 B13R2.5179 O=C1Cc2cccc(I)c2OC1 Amb25149966 [0,1,0,1,0,0|2,0,0]=4 9362 B13R2.5179 O=C1Nc2cccc(Br)c2CO1 Amb25045511 [0,1,0,1,0,0|1,0,0]=3 9363 B13R2.5179 Oc1cccc2CC(=O)NCc21 Amb24417800 [0,1,0,1,0,0|1,0,0]=3 9364 B13R2.5179 Oc1cccc2NC(=O)OCc21 Amb25125816 [0,1,0,1,0,0|1,0,0]=3 9365 B13R2.5179 Oc1cccc2OC(=O)NCc21 Amb22491592 [0,1,0,1,0,0|2,0,0]=4 9366 B13R2.5179 Oc1cccc2OC(=O)OCc21 Amb24708113 [0,1,0,1,0,0|1,0,0]=3 9367 B13R2.5190 Brc1ccc2c(c1)CC(=O)N2C Amb1151841 [0,1,0,1,0,0|1,0,0]=3 9368 B13R2.5190 CC1C(=O)Nc2cc(Br)ccc21 Amb22886740 [0,1,0,1,0,0|2,0,0]=4 9369 B13R2.5190 CC1C(=O)Nc2cc(Cl)ccc21 Amb18243824 [0,1,0,1,0,0|2,0,0]=4 9370 B13R2.5190 CC1C(=O)Nc2cc(F)ccc21 Amb18893508 [0,1,0,1,0,0|2,0,0]=4 9371 B13R2.5190 CC1C(=O)Nc2cc(O)ccc21 Amb23571289 [0,1,0,1,0,0|2,0,0]=4 9372 B13R2.5190 CN1C(=O)Cc2cc(Br)c[n]c12 Amb24082536 [0,1,0,1,0,0|2,0,0]=4 9373 B13R2.5190 CN1C(=O)Cc2cc(Cl)ccc12 Amb23401096 [0,1,0,1,0,0|1,0,0]=3 9374 B13R2.5190 CN1C(=O)Cc2cc(I)ccc12 Amb23571302 [0,1,0,1,0,0|1,0,0]=3 9375 B13R2.5190 CN1C(=O)Cc2cc(O)ccc12 Amb18126362 [0,1,0,1,0,0|1,0,0]=3 9376 B13R2.5190 CN1C(=O)Nc2cc(Br)ccc12 Amb22750350 [0,1,0,1,0,0|2,0,0]=4 9377 B13R2.5190 CN1C(=O)Nc2cc(Cl)ccc12 Amb23575692 [0,1,0,1,0,0|2,0,0]=4 9378 B13R2.5190 CN1C(=O)Nc2cc(N)ccc12 Amb21926641 [0,1,0,1,0,0|2,0,0]=4 9379 B13R2.5190 CN1C(=O)Oc2cc(Br)ccc12 Amb18034499 [0,1,0,1,0,0|2,0,0]=4 9380 B13R2.5190 CN1C(=O)Oc2cc(I)ccc12 Amb21927504 [0,1,0,1,0,0|2,0,0]=4 9381 B13R2.5190 CN1C(=O)Oc2cc(N)ccc12 Amb18015307 [0,1,0,1,0,0|2,0,0]=4 9382 B13R2.5190 CN1C(=O)Oc2cc(O)ccc12 Amb25319967 [0,1,0,1,0,0|2,0,0]=4 9383 B13R2.5190 CN1C(=O)Oc2cc(S)ccc12 Amb18809482 [0,1,0,1,0,0|2,0,0]=4 9384 B13R2.5190 CN1C(=O)Sc2cc(Br)ccc12 Amb22753805 [0,1,0,1,0,0|2,0,0]=4 9385 B13R2.5190 CN1C(=O)Sc2cc(Cl)ccc12 Amb22753799 [0,1,0,1,0,0|2,0,0]=4 9386 B13R2.5190 CN1C(=O)Sc2cc(N)ccc12 Amb24563779 [0,1,0,1,0,0|2,0,0]=4 9387 B13R2.5190 CN1C(=S)Cc2cc(Cl)ccc12 Amb25269797 [0,1,0,1,0,0|1,1,0]=4 9388 B13R2.5190 CN1C(=S)Cc2cc(F)ccc12 Amb25343352 [0,1,0,1,0,0|1,1,0]=4 9389 B13R2.5190 Cc1c[n]c2c(CC(=O)N2C)c1 Amb24082460 [0,1,0,1,0,0|2,0,0]=4 9390 B13R2.5190 Cc1ccc2C(C)C(=O)Cc2c1 Amb25318873 [0,1,0,1,0,0|1,0,0]=3 9391 B13R2.5190 Cc1ccc2C(C)C(=O)Nc2c1 Amb18893457 [0,1,0,1,0,0|2,0,0]=4 9392 B13R2.5190 Cc1ccc2c(CC(=O)N2C)c1 Amb25753036 [0,1,0,1,0,0|1,0,0]=3 9393 B13R2.5190 Cc1ccc2c(CC(=S)N2C)c1 Amb19374194 [0,1,0,1,0,0|1,1,0]=4 9394 B13R2.5190 Cc1ccc2c(c1)OC(=O)N2C Amb25245433 [0,1,0,1,0,0|2,0,0]=4 9395 B13R2.5190 Cc1ccc2c(c1)[s]c(=O)[n]2C Amb24085591 [0,1,0,1,0,0|2,0,0]=4 9396 B13R2.101 CCC1(CO1)Cc2ccccc2 Amb25351735 [0,1,0,1,0,0|1,0,1]=4 9397 B13R2.101 ClCC1(CO1)Cc2ccccc2 Amb24710244 [0,1,0,1,0,0|1,0,1]=4 9398 B13R2.101 O=CC1(Cc2ccccc2)CC1 Amb25739009 [0,1,0,1,0,0|1,0,1]=4 9399 B13R2.101 O=C[C@@]1(CO1)Cc2ccccc2 Amb24627868 [0,1,0,1,0,0|0,0,1]=3 9400 B13R2.101 O=C[C@]1(CO1)Cc2ccccc2 Amb25159225 [0,1,0,1,0,0|0,0,1]=3 9401 B13R2.101 OCC1(CO1)Cc2ccccc2 Amb25220951 [0,1,0,1,0,0|0,0,2]=4 9402 B13R2.219 O=S1(=O)CCC1c2ccccc2 Amb24496772 [0,1,0,1,0,0|2,0,0]=4 9403 B13R2.222 O=P1(Cl)OCc2ccccc2O1 Amb24447574 [0,1,0,1,0,0|2,0,0]=4 9404 B13R2.162 Cc1cccc2CNC(=O)Nc21 Amb25178215 [0,1,0,1,0,0|2,0,0]=4 9405 B13R2.162 Cc1cccc2OCC(=O)Cc21 Amb24633648 [0,1,0,1,0,0|2,0,0]=4 9406 B13R2.162 Cc1cccc2SCC(=O)Cc21 Amb24532695 [0,1,0,1,0,0|2,0,0]=4 9407 B13R2.162 Fc1cccc2COC(=S)Nc21 Amb24610718 [0,1,0,1,0,0|1,1,0]=4 9408 B13R2.162 Fc1cccc2COC(=S)Oc21 Amb25178373 [0,1,0,1,0,0|1,1,0]=4 9409 B13R2.162 Nc1cccc2CCC(=O)Nc21 Amb18061623 [0,1,0,1,0,0|2,0,0]=4 9410 B13R2.162 Nc1cccc2CNC(=O)Cc21 Amb25253813 [0,1,0,1,0,0|1,0,0]=3 9411 B13R2.162 Nc1cccc2COC(=O)Nc21 Amb25068928 [0,1,0,1,0,0|1,0,0]=3 9412 B13R2.162 Nc1cccc2COC(=O)Oc21 Amb24514261 [0,1,0,1,0,0|1,0,0]=3 9413 B13R2.162 O=C1CCc2c(C1)c(N)ccc2 Amb10603934 [0,1,0,1,0,0|1,0,0]=3 9414 B13R2.162 O=C1CCc2c(N1)c(Br)ccc2 Amb17545216 [0,1,0,1,0,0|2,0,0]=4 9415 B13R2.162 O=C1CCc2c(N1)c(C)ccc2 Amb17545221 [0,1,0,1,0,0|2,0,0]=4 9416 B13R2.162 O=C1CCc2c(N1)c(Cl)ccc2 Amb17545212 [0,1,0,1,0,0|2,0,0]=4 9417 B13R2.162 O=C1CCc2c(N1)c(O)ccc2 Amb15690696 [0,1,0,1,0,0|2,0,0]=4 9418 B13R2.162 O=C1COc2c(C1)c(Br)ccc2 Amb15692700 [0,1,0,1,0,0|2,0,0]=4 9419 B13R2.162 O=C1Cc2c(Br)cccc2CN1 Amb24537506 [0,1,0,1,0,0|1,0,0]=3 9420 B13R2.162 O=C1Cc2c(Cl)cccc2OC1 Amb20241927 [0,1,0,1,0,0|2,0,0]=4 9421 B13R2.162 O=C1Cc2c(I)cccc2CC1 Amb20241954 [0,1,0,1,0,0|1,0,0]=3 9422 B13R2.162 O=C1Cc2c(I)cccc2OC1 Amb25778220 [0,1,0,1,0,0|2,0,0]=4 9423 B13R2.162 O=C1NCc2cccc(F)c2N1 Amb25316111 [0,1,0,1,0,0|2,0,0]=4 9424 B13R2.162 O=C1OCc2cccc(F)c2O1 Amb24558948 [0,1,0,1,0,0|1,0,0]=3 9425 B13R2.162 Oc1cccc2CNC(=O)Cc21 Amb24728462 [0,1,0,1,0,0|1,0,0]=3 9426 B13R2.162 Oc1cccc2CNC(=O)Oc21 Amb25287566 [0,1,0,1,0,0|2,0,0]=4 9427 B13R2.215 O=C1C=CC=CN1C2CNC2=O Amb25053292 [0,1,0,1,0,0|2,0,0]=4 9428 B13R2.215 O=C1CCC1c2ccccc2Cl Amb19374435 [0,1,0,1,0,0|1,0,0]=3 9429 B13R2.215 O=C1CCC1c2ccccc2F Amb25159965 [0,1,0,1,0,0|1,0,0]=3 9430 B13R2.215 O=C1CCN1c2ccccc2Br Amb24493723 [0,1,0,1,0,0|2,0,0]=4 9431 B13R2.217 CC1(Cc2ccccc2O)CO1 Amb25094446 [0,1,0,1,0,0|1,0,1]=4 9432 B13R2.4825 CC1C(=O)Nc2c(Br)cccc21 Amb18246091 [0,1,0,1,0,0|2,0,0]=4 9433 B13R2.4825 CC1C(=O)Nc2c(Cl)cccc21 Amb18243823 [0,1,0,1,0,0|2,0,0]=4 9434 B13R2.4825 CC1C(=O)Nc2c(F)cccc21 Amb18893507 [0,1,0,1,0,0|2,0,0]=4 9435 B13R2.4825 CC1C(=O)Nc2c(O)cccc21 Amb23571287 [0,1,0,1,0,0|2,0,0]=4 9436 B13R2.4825 CC1C(=O)Oc2c(O)cccc21 Amb24408353 [0,1,0,1,0,0|2,0,0]=4 9437 B13R2.4825 CN1C(=O)Cc2c(Br)cc[n]c12 Amb23402856 [0,1,0,1,0,0|2,0,0]=4 9438 B13R2.4825 CN1C(=O)Cc2c(Cl)cc[n]c12 Amb23402857 [0,1,0,1,0,0|2,0,0]=4 9439 B13R2.4825 CN1C(=O)Cc2c(F)cc[n]c12 Amb23402858 [0,1,0,1,0,0|2,0,0]=4 9440 B13R2.4825 CN1C(=O)Cc2c(O)cccc12 Amb25034640 [0,1,0,1,0,0|1,0,0]=3 9441 B13R2.4825 CN1C(=O)Nc2c(Br)cccc12 Amb22586607 [0,1,0,1,0,0|2,0,0]=4 9442 B13R2.4825 CN1C(=O)Oc2c(Br)cccc12 Amb18547407 [0,1,0,1,0,0|2,0,0]=4 9443 B13R2.4825 CN1C(=O)Oc2c(Cl)cccc12 Amb18046758 [0,1,0,1,0,0|2,0,0]=4 9444 B13R2.4825 CN1C(=O)Oc2c(F)cccc12 Amb18046735 [0,1,0,1,0,0|2,0,0]=4 9445 B13R2.4825 CN1C(=O)Oc2c(N)cccc12 Amb18015311 [0,1,0,1,0,0|2,0,0]=4 9446 B13R2.4825 CN1C(=S)Cc2c(Cl)cccc12 Amb25676468 [0,1,0,1,0,0|1,1,0]=4 9447 B13R2.4825 Cc1cccc2C(C)C(=O)Oc12 Amb24085604 [0,1,0,1,0,0|2,0,0]=4 9448 B13R2.4825 Cc1cccc2c1OC(=O)N2C Amb18547328 [0,1,0,1,0,0|2,0,0]=4 9449 B13R2.4825 O=C1Cc2c(N1C)cccc2Br Amb10067623 [0,1,0,1,0,0|1,0,0]=3 9450 B13R2.4825 O=C1Nc2c(C1C)cccc2C Amb17232374 [0,1,0,1,0,0|2,0,0]=4 9451 B13R2.4825 ON1C(=O)Cc2c(I)cccc12 Amb24531537 [0,1,0,1,0,0|2,0,0]=4 9452 B13R3.25 C1Oc2[nH]c3ccccc3c21 Amb25378939 [0,0,0,2,0,0|1,0,1]=4 9453 B13R3.2083 COC12OC1c3ccccc23 Amb24334687 [0,0,0,2,0,0|0,0,2]=4 9454 B9R0.12 COC(=O)\C(=C\C=C)\C=O Amb24512884 [0,0,1,0,1,0|1,0,0]=3 9455 B9R0.12 COC(=O)\C(\CC=C)=C\Cl Amb24482337 [0,0,1,0,1,0|1,0,1]=4 9456 B9R0.12 COC(=O)\C(\CC=C)=C\O Amb25346134 [0,0,1,0,1,0|1,0,1]=4 9457 B9R0.12 COC(=O)\C(\CN)=C\C=C Amb18643728 [0,0,1,0,1,0|1,0,1]=4 9458 B9R0.12 COC(=O)\C(\CO)=C\C=C Amb25092063 [0,0,1,0,1,0|1,0,1]=4 9459 B9R1.12 COCCc1ccc[s]1 Amb25147094 [1,0,0,0,1,0|1,0,1]=4 9460 B9R1.12 COCCc1ccco1 Amb25147016 [1,0,0,0,1,0|1,0,1]=4 9461 B9R1.12 CONCc1ccc[nH]1 Amb24364458 [1,0,0,0,1,0|2,0,0]=4 9462 B9R1.12 CONCc1ccc[s]1 Amb25347354 [1,0,0,0,1,0|2,0,0]=4 9463 B9R1.12 CONCc1ccco1 Amb25760018 [1,0,0,0,1,0|2,0,0]=4 9464 B9R1.12 CO\C=C\c1ccco1 Amb25208464 [1,0,0,0,1,0|1,0,1]=4 9465 B9R1.12 CO\C=C\c1cocc1 Amb25349455 [1,0,0,0,1,0|1,0,1]=4 9466 B9R1.12 C\C=C\C[n]1cccc1 Amb24375826 [1,0,0,0,1,0|2,0,0]=4 9467 B9R1.12 C\C=C\Cc1c[nH]cc1 Amb25146026 [1,0,0,0,1,0|2,0,0]=4 9468 B9R1.12 C\C=C\Cc1ccc[nH]1 Amb25243730 [1,0,0,0,1,0|2,0,0]=4 9469 B9R1.6 C=C(F)c1ccccc1 Amb22738583 [1,0,0,0,1,0|1,0,1]=4 9470 B9R1.6 C=C([Zn+])c1ccccc1 Amb22228006 [1,0,0,0,1,0|1,0,1]=4 9471 B9R1.6 CC(=C)c1cc[n]cc1 Amb25126374 [1,0,0,0,1,0|2,0,0]=4 9472 B9R1.6 CC(=C)c1cccc[n]1 Amb25077592 [1,0,0,0,1,0|2,0,0]=4 9473 B9R1.6 CC(=C)c1ccccc1 Amb22338342 [1,0,0,0,1,0|1,0,0]=3 9474 B9R1.6 CC(=C)c1ccccc1 Amb22338444 [1,0,0,0,1,0|1,0,0]=3 9475 B9R1.6 CC(=N)c1cc[n]cc1 Amb24478617 [1,0,0,0,1,0|2,0,0]=4 9476 B9R1.6 CC(=N)c1ccc[n]c1 Amb22170296 [1,0,0,0,1,0|2,0,0]=4 9477 B9R1.6 CC(=O)C1=CC=CCS1 Amb24582465 [1,0,0,0,1,0|1,0,1]=4 9478 B9R1.6 CC(=O)C1C=CNC=C1 Amb24707722 [1,0,0,0,1,0|1,0,1]=4 9479 B9R1.6 CC(=O)C=1CCC=CC1 Amb22232236 [1,0,0,0,1,0|0,0,2]=4 9480 B9R1.6 CC(=O)C=1CNC=CC1 Amb25700322 [1,0,0,0,1,0|1,0,1]=4 9481 B9R1.6 CC(=O)[n+]1ccccc1 Amb24692607 [1,0,0,0,1,0|1,0,0]=3 9482 B9R1.6 CC(=O)c1cc[n][n]c1 Amb19958070 [1,0,0,0,1,0|2,0,0]=4 9483 B9R1.6 CC(=O)c1cc[n]c[n]1 Amb19959228 [1,0,0,0,1,0|2,0,0]=4 9484 B9R1.6 CC(=O)c1ccc[nH+]c1 Amb10552777 [1,0,0,0,1,0|1,0,0]=3 9485 B9R1.6 CC(=O)c1ccc[n][n]1 Amb20242017 [1,0,0,0,1,0|2,0,0]=4 9486 B9R1.6 CC(=O)c1cccc[nH+]1 Amb10552776 [1,0,0,0,1,0|1,0,0]=3 9487 B9R1.6 CC(C)c1ccccc1 Amb24052959 [1,0,0,0,1,0|1,0,1]=4 9488 B9R1.6 CC(F)c1ccccc1 Amb24555504 [1,0,0,0,1,0|1,0,1]=4 9489 B9R1.6 CC(I)c1ccccc1 Amb24064714 [1,0,0,0,1,0|1,0,1]=4 9490 B9R1.6 CC(c1ccccc1)[NH3+] Amb10560245 [1,0,0,0,1,0|1,0,1]=4 9491 B9R1.6 CN(C)c1ccccc1 Amb22040069 [1,0,0,0,1,0|2,0,0]=4 9492 B9R1.6 CN(N)c1ccccc1 Amb22346095 [1,0,0,0,1,0|2,0,0]=4 9493 B9R1.6 CN(N)c1ccccc1 Amb22754142 [1,0,0,0,1,0|2,0,0]=4 9494 B9R1.6 CN(c1ccccc1)N Amb1153615 [1,0,0,0,1,0|2,0,0]=4 9495 B9R1.6 CP(=O)c1ccccc1 Amb21858071 [1,0,0,0,1,0|1,0,0]=3 9496 B9R1.6 CP(C)c1ccccc1 Amb22369673 [1,0,0,0,1,0|2,0,0]=4 9497 B9R1.6 CP(C)c1ccccc1 Amb24325382 [1,0,0,0,1,0|2,0,0]=4 9498 B9R1.6 CP(Cl)c1ccccc1 Amb25837553 [1,0,0,0,1,0|2,0,0]=4 9499 B9R1.6 CS(=O)c1c[n]ccc1 Amb24102456 [1,0,0,0,1,0|2,0,0]=4 9500 B9R1.6 CS(=O)c1cc[n]cc1 Amb24103016 [1,0,0,0,1,0|2,0,0]=4 9501 B9R1.6 CS(=O)c1cccc[n]1 Amb24562247 [1,0,0,0,1,0|2,0,0]=4 9502 B9R1.6 C[13C](=O)c1ccccc1 Amb22337854 [1,0,0,0,1,0|0,0,0]=2 9503 B9R1.6 C[C@@H](Br)c1ccccc1 Amb25055693 [1,0,0,0,1,0|1,0,1]=4 9504 B9R1.6 C[C@@H](Cl)c1ccccc1 Amb25772789 [1,0,0,0,1,0|1,0,1]=4 9505 B9R1.6 C[C@@H](N)c1ccccc1 Amb22168000 [1,0,0,0,1,0|1,0,1]=4 9506 B9R1.6 C[C@H](Br)c1ccccc1 Amb24355307 [1,0,0,0,1,0|1,0,1]=4 9507 B9R1.6 C[C@H](Cl)c1ccccc1 Amb24391406 [1,0,0,0,1,0|1,0,1]=4 9508 B9R1.6 C[S@@](=O)c1ccccc1 Amb22747474 [1,0,0,0,1,0|1,0,0]=3 9509 B9R1.6 C[SiH](C)c1ccccc1 Amb19894005 [1,0,0,0,1,0|1,1,0]=4 9510 B9R1.6 C[Si](=O)c1ccccc1 Amb22053625 [1,0,0,0,1,0|0,1,0]=3 9511 B9R1.6 C[Te+](C)c1ccccc1 Amb22345602 [1,0,0,0,1,0|2,0,0]=4 9512 B9R1.6 ClS(=O)c1ccccc1 Amb13881360 [1,0,0,0,1,0|2,0,0]=4 9513 B9R1.6 FC(=O)c1ccccc1 Amb10607152 [1,0,0,0,1,0|1,0,0]=3 9514 B9R1.6 NC(=N)c1ccccc1 Amb10068704 [1,0,0,0,1,0|2,0,0]=4 9515 B9R1.6 NC(=N)c1ccccc1 Amb2371546 [1,0,0,0,1,0|2,0,0]=4 9516 B9R1.6 NC(=O)c1cc[n]cc1 Amb24066211 [1,0,0,0,1,0|2,0,0]=4 9517 B9R1.6 NC(=O)c1cccc[p]1 Amb25353307 [1,0,0,0,1,0|2,0,0]=4 9518 B9R1.6 NC(=O)c1ccccn1 Amb1219876 [1,0,0,0,1,0|2,0,0]=4 9519 B9R1.6 NC(=O)c1cccnc1 Amb16231206 [1,0,0,0,1,0|2,0,0]=4 9520 B9R1.6 N[13C](=O)c1ccccc1 Amb22351604 [1,0,0,0,1,0|1,0,0]=3 9521 B9R1.6 O=C(Br)c1cc[n]cc1 Amb24536581 [1,0,0,0,1,0|2,0,0]=4 9522 B9R1.6 O=C(Cl)c1cc[nH+]cc1 Amb21952993 [1,0,0,0,1,0|2,0,0]=4 9523 B9R1.6 O=C(Cl)c1cccc[n]1 Amb22492448 [1,0,0,0,1,0|2,0,0]=4 9524 B9R1.6 O=C(F)c1ccc[n]c1 Amb25146722 [1,0,0,0,1,0|2,0,0]=4 9525 B9R1.6 O=[13C](Cl)[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22054407 [1,0,0,0,1,0|1,0,0]=3 9526 B9R1.6 O=[13C](Cl)c1ccccc1 Amb22167795 [1,0,0,0,1,0|1,0,0]=3 9527 B9R1.6 OB(O)c1ccccc1 Amb22587706 [1,0,0,0,1,0|1,0,1]=4 9528 B9R1.6 OC(=O)C1=CC=CCS1 Amb22831443 [1,0,0,0,1,0|1,0,1]=4 9529 B9R1.6 OC(=O)C1=COC=CO1 Amb25305603 [1,0,0,0,1,0|2,0,0]=4 9530 B9R1.6 OC(=O)C1C=CC=CN1 Amb24746571 [1,0,0,0,1,0|1,0,1]=4 9531 B9R1.6 OC(=O)C1C=CC=CO1 Amb18642363 [1,0,0,0,1,0|1,0,1]=4 9532 B9R1.6 OC(=O)C1C=CCC=C1 Amb17593268 [1,0,0,0,1,0|0,0,2]=4 9533 B9R1.6 OC(=O)C1C=CNC=C1 Amb24099560 [1,0,0,0,1,0|1,0,1]=4 9534 B9R1.6 OC(=O)C=1CC=CNC1 Amb25293556 [1,0,0,0,1,0|1,0,1]=4 9535 B9R1.6 OC(=O)C=1CNC=CC1 Amb25823057 [1,0,0,0,1,0|1,0,1]=4 9536 B9R1.6 OC(=O)[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22054405 [1,0,0,0,1,0|0,0,0]=2 9537 B9R1.6 OC(=O)[13c]1ccccc1 Amb22353371 [1,0,0,0,1,0|0,0,0]=2 9538 B9R1.6 OC(=O)c1[n]ccc[n]1 Amb19330380 [1,0,0,0,1,0|2,0,0]=4 9539 B9R1.6 OC(=O)c1c[n]c[n]c1 Amb24099331 [1,0,0,0,1,0|2,0,0]=4 9540 B9R1.6 OC(=O)c1cc[13cH]cc1 Amb22367544 [1,0,0,0,1,0|0,0,0]=2 9541 B9R1.6 OC(=O)c1ccccc1 Amb16232256 [1,0,0,0,1,0|0,0,0]=2 9542 B9R1.6 OC(=O)c1ccccc1 Amb1935196 [1,0,0,0,1,0|0,0,0]=2 9543 B9R1.6 OC(=O)c1ccccc1 Amb22002523 [1,0,0,0,1,0|0,0,0]=2 9544 B9R1.6 OC(=O)c1ccccc1 Amb22279605 [1,0,0,0,1,0|0,0,0]=2 9545 B9R1.6 OC(=O)c1ccccc1 Amb22336602 [1,0,0,0,1,0|0,0,0]=2 9546 B9R1.6 OC(=O)c1ccccc1 Amb22338105 [1,0,0,0,1,0|0,0,0]=2 9547 B9R1.6 OC(=O)c1ccccc1 Amb22351742 [1,0,0,0,1,0|0,0,0]=2 9548 B9R1.6 OC(=O)c1ccccc1 Amb22472602 [1,0,0,0,1,0|0,0,0]=2 9549 B9R1.6 OC(=O)c1ccccc1 Amb22491636 [1,0,0,0,1,0|0,0,0]=2 9550 B9R1.6 OC(=O)c1ccccn1 Amb1227737 [1,0,0,0,1,0|1,0,0]=3 9551 B9R1.6 OC(=O)c1cccnc1 Amb1195995 [1,0,0,0,1,0|1,0,0]=3 9552 B9R1.6 OC(=O)c1ccncn1 Amb1102414 [1,0,0,0,1,0|2,0,0]=4 9553 B9R1.6 OC(=O)c1cnccn1 Amb2455963 [1,0,0,0,1,0|2,0,0]=4 9554 B9R1.6 OC(=O)c1cncnc1 Amb2455830 [1,0,0,0,1,0|2,0,0]=4 9555 B9R1.6 OC(=S)c1ccc[n]c1 Amb22731908 [1,0,0,0,1,0|1,1,0]=4 9556 B9R1.6 OC(=S)c1ccccc1 Amb17942862 [1,0,0,0,1,0|0,1,0]=3 9557 B9R1.6 OC(Br)c1ccccc1 Amb24693764 [1,0,0,0,1,0|1,0,1]=4 9558 B9R1.6 OC(Cl)c1ccccc1 Amb24480238 [1,0,0,0,1,0|1,0,1]=4 9559 B9R1.6 OC(P)c1ccccc1 Amb24448419 [1,0,0,0,1,0|1,0,1]=4 9560 B9R1.6 OP(=O)c1ccccc1 Amb10571098 [1,0,0,0,1,0|1,0,0]=3 9561 B9R1.6 OS(=O)c1c[n]ccc1 Amb24062548 [1,0,0,0,1,0|2,0,0]=4 9562 B9R1.6 OS(=O)c1cc[n]cc1 Amb24099594 [1,0,0,0,1,0|2,0,0]=4 9563 B9R1.6 OS(=O)c1ccccc1 Amb17939345 [1,0,0,0,1,0|1,0,0]=3 9564 B9R1.6 O[12C](=O)[12c]1[12cH][12cH][12cH][12cH][12cH]1 Amb22338193 [1,0,0,0,1,0|0,0,0]=2 9565 B9R1.6 O[13C](=O)[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367547 [1,0,0,0,1,0|0,0,0]=2 9566 B9R1.6 O[13C](=O)[13c]1[13cH][13cH][13cH]n[13cH]1 Amb17618353 [1,0,0,0,1,0|1,0,0]=3 9567 B9R1.6 O[13C](=O)c1ccccc1 Amb22338753 [1,0,0,0,1,0|0,0,0]=2 9568 B9R1.6 O[14C](=O)c1ccccc1 Amb22352700 [1,0,0,0,1,0|0,0,0]=2 9569 B9R1.6 O[C@H](Br)c1ccccc1 Amb25114797 [1,0,0,0,1,0|1,0,1]=4 9570 B9R1.6 S=C(Cl)c1ccccc1 Amb25294215 [1,0,0,0,1,0|1,1,0]=4 9571 B9R1.6 SC(=S)c1ccccc1 Amb22051683 [1,0,0,0,1,0|0,2,0]=4 9572 B9R1.6 [13CH3]C(=O)c1ccccc1 Amb22353264 [1,0,0,0,1,0|0,0,0]=2 9573 B9R1.6 [13CH3][13CH](O)c1ccccc1 Amb22363197 [1,0,0,0,1,0|0,0,2]=4 9574 B9R1.6 [13CH3][13C](=O)c1ccccc1 Amb22366852 [1,0,0,0,1,0|0,0,0]=2 9575 B9R1.6 [15NH2]C(=O)c1ccc[n]c1 Amb22367445 [1,0,0,0,1,0|2,0,0]=4 9576 B9R1.6 [15NH2]C(=O)c1ccccc1 Amb22366901 [1,0,0,0,1,0|1,0,0]=3 9577 B9R1.6 [2H]C(=C)c1ccccc1 Amb22337758 [1,0,0,0,1,0|1,0,1]=4 9578 B9R1.6 [2H]C(=O)c1ccccc1 Amb22043987 [1,0,0,0,1,0|1,0,0]=3 9579 B9R1.6 [2H][13C](=O)c1ccccc1 Amb22369001 [1,0,0,0,1,0|1,0,0]=3 9580 B9R1.6 [CH2-]C(=O)c1ccc[n]c1 Amb25692916 [1,0,0,0,1,0|1,0,1]=4 9581 B9R1.6 [O-]C(=O)c1cc[n]cc1 Amb22730239 [1,0,0,0,1,0|1,0,1]=4 9582 B9R1.6 [O-]C(=O)c1ccc[n]c1 Amb22043320 [1,0,0,0,1,0|1,0,1]=4 9583 B9R1.6 [O-]C(=O)c1cccc[n]1 Amb22058087 [1,0,0,0,1,0|1,0,1]=4 9584 B9R1.6 [O-]C(=O)c1cccc[n]1 Amb22411648 [1,0,0,0,1,0|1,0,1]=4 9585 B9R1.6 [O-]C(=O)c1cccc[n]1 Amb22734923 [1,0,0,0,1,0|1,0,1]=4 9586 B9R1.6 [O-]C(=O)c1ccccc1 Amb22053472 [1,0,0,0,1,0|0,0,1]=3 9587 B9R1.6 [O-]C(=O)c1ccccc1 Amb22053705 [1,0,0,0,1,0|0,0,1]=3 9588 B9R1.6 [O-]C(=O)c1ccccc1 Amb22167689 [1,0,0,0,1,0|0,0,1]=3 9589 B9R1.6 [O-]C(=O)c1ccccc1 Amb22168438 [1,0,0,0,1,0|0,0,1]=3 9590 B9R1.6 [O-]C(=O)c1ccccc1 Amb22168439 [1,0,0,0,1,0|0,0,1]=3 9591 B9R1.6 [O-]C(=O)c1ccccc1 Amb22351958 [1,0,0,0,1,0|0,0,1]=3 9592 B9R1.6 [O-]C(=O)c1ccccc1 Amb22353183 [1,0,0,0,1,0|0,0,1]=3 9593 B9R1.6 [O-]C(=O)c1ccccc1 Amb22732264 [1,0,0,0,1,0|0,0,1]=3 9594 B9R1.6 [O-]C(=O)c1ccccc1 Amb22732273 [1,0,0,0,1,0|0,0,1]=3 9595 B9R1.6 [O-]C(=O)c1ccccc1 Amb22732500 [1,0,0,0,1,0|0,0,1]=3 9596 B9R1.6 [O-]C(=O)c1ccccc1 Amb22734002 [1,0,0,0,1,0|0,0,1]=3 9597 B9R1.6 [O-]P(=O)c1ccccc1 Amb21618955 [1,0,0,0,1,0|1,0,1]=4 9598 B9R1.6 [O-]S(=O)c1ccccc1 Amb10790483 [1,0,0,0,1,0|1,0,1]=4 9599 B9R1.6 [O-]S(=O)c1ccccc1 Amb22043426 [1,0,0,0,1,0|1,0,1]=4 9600 B9R1.6 [O-]S(=O)c1ccccc1 Amb22053867 [1,0,0,0,1,0|1,0,1]=4 9601 B9R1.6 [O-]S(=O)c1ccccc1 Amb22352998 [1,0,0,0,1,0|1,0,1]=4 9602 B9R1.6 [O-][15N+](=O)c1ccccc1 Amb22351461 [1,0,0,0,1,0|1,0,1]=4 9603 B9R1.6 [O-][N+](=O)[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22351475 [1,0,0,0,1,0|1,0,1]=4 9604 B9R1.6 [O-][N+](=O)c1ccccc1 Amb24061309 [1,0,0,0,1,0|1,0,1]=4 9605 B9R1.6 [O-][P](=O)c1ccccc1 Amb22731674 [1,0,0,0,1,0|1,0,1]=4 9606 B9R1.6 [S-]C(=O)c1ccccc1 Amb10555187 [1,0,0,0,1,0|0,1,0]=3 9607 B9R1.13 CC(=C)Cc1ccc[nH]1 Amb24477810 [1,0,0,0,1,0|2,0,0]=4 9608 B9R1.13 CC(=C)Cc1ccco1 Amb24673621 [1,0,0,0,1,0|2,0,0]=4 9609 B9R1.13 CC(=O)CC1=CC=C[SiH2]1 Amb25729101 [1,0,0,0,1,0|0,1,0]=3 9610 B9R1.13 CC(=O)C[n]1ccc[n]1 Amb21988437 [1,0,0,0,1,0|2,0,0]=4 9611 B9R1.13 CC(=O)Cc1c[nH]c[n]1 Amb25832036 [1,0,0,0,1,0|2,0,0]=4 9612 B9R1.13 CC(=O)Cc1cc[nH]c1 Amb18893399 [1,0,0,0,1,0|1,0,0]=3 9613 B9R1.13 CC(=O)Cc1cc[n]o1 Amb24425365 [1,0,0,0,1,0|2,0,0]=4 9614 B9R1.13 CC(=O)Cc1ccoc1 Amb25713513 [1,0,0,0,1,0|1,0,0]=3 9615 B9R1.13 CC(=O)Cn1cccn1 Amb1092543 [1,0,0,0,1,0|2,0,0]=4 9616 B9R1.13 CC(=O)Nc1cccs1 Amb2228309 [1,0,0,0,1,0|2,0,0]=4 9617 B9R1.13 CC(=O)Oc1cc[nH]c1 Amb24476976 [1,0,0,0,1,0|2,0,0]=4 9618 B9R1.13 CC(=O)Oc1ccc[s]1 Amb24566730 [1,0,0,0,1,0|2,0,0]=4 9619 B9R1.13 CC(=O)Oc1cocc1 Amb24583167 [1,0,0,0,1,0|2,0,0]=4 9620 B9R1.13 CC(=O)Sc1c[s]cc1 Amb24727644 [1,0,0,0,1,0|2,0,0]=4 9621 B9R1.13 CC(=O)Sc1ccc[s]1 Amb25235134 [1,0,0,0,1,0|2,0,0]=4 9622 B9R1.13 CC(=O)Sc1ccco1 Amb24511658 [1,0,0,0,1,0|2,0,0]=4 9623 B9R1.13 CS(=O)Cc1ccc[s]1 Amb25746950 [1,0,0,0,1,0|2,0,0]=4 9624 B9R1.13 NC(=O)Cc1cc[nH]c1 Amb18243493 [1,0,0,0,1,0|2,0,0]=4 9625 B9R1.13 NC(=O)Cc1ccc[nH]1 Amb22886650 [1,0,0,0,1,0|2,0,0]=4 9626 B9R1.13 NC(=O)Cc1ccco1 Amb24534382 [1,0,0,0,1,0|2,0,0]=4 9627 B9R1.13 O=C(Cl)Cc1ccco1 Amb25124003 [1,0,0,0,1,0|2,0,0]=4 9628 B9R1.13 OC(=O)Cc1[cH-]ccc1 Amb24122585 [1,0,0,0,1,0|0,0,1]=3 9629 B9R1.13 OC(=O)Cc1[nH]cc[n]1 Amb22750530 [1,0,0,0,1,0|2,0,0]=4 9630 B9R1.13 OC(=O)Cc1c[nH]c[n]1 Amb20670251 [1,0,0,0,1,0|2,0,0]=4 9631 B9R1.13 OC(=O)Cc1c[n][s]c1 Amb18831589 [1,0,0,0,1,0|2,0,0]=4 9632 B9R1.13 OC(=O)Cc1cc[nH]c1 Amb18062951 [1,0,0,0,1,0|1,0,0]=3 9633 B9R1.13 OC(=O)Cc1cc[n][nH]1 Amb19243677 [1,0,0,0,1,0|2,0,0]=4 9634 B9R1.13 OC(=O)Cc1cc[n][s]1 Amb18831590 [1,0,0,0,1,0|2,0,0]=4 9635 B9R1.13 OC(=O)Cc1cc[s][n]1 Amb18831591 [1,0,0,0,1,0|2,0,0]=4 9636 B9R1.13 OC(=O)Cc1cscc1 Amb1151879 [1,0,0,0,1,0|1,0,0]=3 9637 B9R1.13 OC(=O)Cc1cscn1 Amb17039671 [1,0,0,0,1,0|2,0,0]=4 9638 B9R1.13 OC(=O)Cn1cccc1 Amb1124868 [1,0,0,0,1,0|1,0,0]=3 9639 B9R1.13 OC(=O)Cn1cccn1 Amb1157167 [1,0,0,0,1,0|2,0,0]=4 9640 B9R1.13 OC(=O)Sc1ccco1 Amb24695916 [1,0,0,0,1,0|2,0,0]=4 9641 B9R1.13 O[13C](=O)[13CH2][15n]1c[15n]cc1 Amb17616038 [1,0,0,0,1,0|2,0,0]=4 9642 B9R1.11 CCC(=O)c1cc[nH]c1 Amb18062764 [0,0,0,0,2,0|2,0,0]=4 9643 B9R1.11 CCC(=O)n1cccc1 Amb17938694 [0,0,0,0,2,0|2,0,0]=4 9644 B9R1.11 CNC(=O)c1c[nH]cc1 Amb24612395 [0,0,0,0,2,0|2,0,0]=4 9645 B9R1.11 CNC(=O)c1ccc[nH]1 Amb21859009 [0,0,0,0,2,0|2,0,0]=4 9646 B9R1.11 CNC(=O)c1ccoc1 Amb24531887 [0,0,0,0,2,0|2,0,0]=4 9647 B9R1.11 COC(=N)c1cc[nH]c1 Amb25846197 [0,0,0,0,2,0|2,0,0]=4 9648 B9R1.11 COC(=N)c1ccc[nH]1 Amb24669587 [0,0,0,0,2,0|2,0,0]=4 9649 B9R1.11 COC(=N)c1ccco1 Amb22263727 [0,0,0,0,2,0|2,0,0]=4 9650 B9R1.11 COC(=N)c1cccs1 Amb17621680 [0,0,0,0,2,0|2,0,0]=4 9651 B9R1.11 COC(=O)C=1C=CCC1 Amb25145939 [0,0,0,0,2,0|0,0,1]=3 9652 B9R1.11 COC(=O)[n]1c[n]cc1 Amb24078489 [0,0,0,0,2,0|2,0,0]=4 9653 B9R1.11 COC(=O)c1[n]cco1 Amb22001762 [0,0,0,0,2,0|2,0,0]=4 9654 B9R1.11 COC(=O)c1c[nH][n]c1 Amb19515848 [0,0,0,0,2,0|2,0,0]=4 9655 B9R1.11 COC(=O)c1c[nH]c[n]1 Amb20621624 [0,0,0,0,2,0|2,0,0]=4 9656 B9R1.11 COC(=O)c1c[nH]nc1 Amb10070554 [0,0,0,0,2,0|2,0,0]=4 9657 B9R1.11 COC(=O)c1c[n][s]c1 Amb25705771 [0,0,0,0,2,0|2,0,0]=4 9658 B9R1.11 COC(=O)c1c[n]co1 Amb21520455 [0,0,0,0,2,0|2,0,0]=4 9659 B9R1.11 COC(=O)c1cc[nH]n1 Amb1000875 [0,0,0,0,2,0|2,0,0]=4 9660 B9R1.11 COC(=O)c1cc[s][n]1 Amb22896459 [0,0,0,0,2,0|2,0,0]=4 9661 B9R1.11 COC(=O)c1ccc[nH]1 Amb1088973 [0,0,0,0,2,0|1,0,0]=3 9662 B9R1.11 COC(=O)c1cccs1 Amb1911537 [0,0,0,0,2,0|1,0,0]=3 9663 B9R1.11 COC(=O)c1ccns1 Amb13883507 [0,0,0,0,2,0|2,0,0]=4 9664 B9R1.11 COC(=O)c1cco[n]1 Amb23412333 [0,0,0,0,2,0|2,0,0]=4 9665 B9R1.11 COC(=O)c1cncs1 Amb2455728 [0,0,0,0,2,0|2,0,0]=4 9666 B9R1.11 COC(=O)c1co[n]c1 Amb22754239 [0,0,0,0,2,0|2,0,0]=4 9667 B9R1.11 COC(=O)c1coc[n]1 Amb21857674 [0,0,0,0,2,0|2,0,0]=4 9668 B9R1.11 COC(=O)c1cscn1 Amb10067320 [0,0,0,0,2,0|2,0,0]=4 9669 B9R1.11 COC(=O)c1nccs1 Amb10807389 [0,0,0,0,2,0|2,0,0]=4 9670 B9R1.11 COC(=S)c1ccco1 Amb22232675 [0,0,0,0,2,0|1,1,0]=4 9671 B9R1.11 COS(=O)c1ccc[s]1 Amb25254375 [0,0,0,0,2,0|2,0,0]=4 9672 B9R1.11 CSC(=O)c1ccc[s]1 Amb24520558 [0,0,0,0,2,0|1,1,0]=4 9673 B9R1.11 NOC(=O)c1ccc[s]1 Amb25268305 [0,0,0,0,2,0|2,0,0]=4 9674 B9R1.11 O([2H])C(=O)c1cccs1 Amb10573503 [0,0,0,0,2,0|2,0,0]=4 9675 B9R1.11 O=C(OCl)c1ccc[nH]1 Amb24518091 [0,0,0,0,2,0|2,0,0]=4 9676 B9R1.11 [Cu]OC(=O)c1cccs1 Amb13890298 [0,0,0,0,2,0|2,0,0]=4 9677 B9R1.11 [Li]OC(=O)n1cccc1 Amb10552456 [0,0,0,0,2,0|2,0,0]=4 9678 B11R1.742 CC(=O)C=C1C=CC=CC=C1 Amb24706699 [1,0,0,0,0,1|0,0,1]=3 9679 B11R1.742 CC(=O)CC=1C=CC=CCC1 Amb24378360 [1,0,0,0,0,1|0,0,0]=2 9680 B11R1.742 CC(=O)CC=1CC=CC=CC1 Amb25371758 [1,0,0,0,0,1|0,0,0]=2 9681 B11R1.742 CC(=O)NC1C=CC=CC=C1 Amb25703260 [1,0,0,0,0,1|1,0,1]=4 9682 B11R1.742 NC(=O)CC1C=CC=CC=C1 Amb24432478 [1,0,0,0,0,1|1,0,1]=4 9683 B11R1.742 NC(=O)NC=1C=CCC=CC1 Amb24693859 [1,0,0,0,0,1|2,0,0]=4 9684 B11R1.742 OC(=O)CC1C=CC=CC=C1 Amb24487914 [1,0,0,0,0,1|0,0,1]=3 9685 B11R1.742 OC(=O)CC1CCC=CC=C1 Amb25362183 [1,0,0,0,0,1|0,0,2]=4 9686 B11R1.742 OC(=O)C[C@@H]1CCC=CC=C1 Amb25102501 [1,0,0,0,0,1|0,0,2]=4 9687 B13R1.718 BrCC(=O)NCCc1ccccc1 Amb2089064 [0,0,0,0,0,2|2,0,0]=4 9688 B13R1.718 C#CC(=O)COCc1ccccc1 Amb25697113 [0,0,0,0,0,2|1,0,1]=4 9689 B13R1.718 C#CC(=O)C\C=C\c1ccccc1 Amb25706938 [0,0,0,0,0,2|1,0,1]=4 9690 B13R1.718 C#CC(=O)NCCc1ccccc1 Amb25349378 [0,0,0,0,0,2|1,0,1]=4 9691 B13R1.718 C#CC(=O)NOCc1ccccc1 Amb25755722 [0,0,0,0,0,2|1,0,1]=4 9692 B13R1.718 C=CC(=O)NOCc1ccccc1 Amb24684331 [0,0,0,0,0,2|1,0,1]=4 9693 B13R1.718 C=CC(=O)OCCc1ccccc1 Amb17934131 [0,0,0,0,0,2|1,0,1]=4 9694 B13R1.718 CCC(=O)C=C=Cc1ccccc1 Amb25713065 [0,0,0,0,0,2|1,0,1]=4 9695 B13R1.718 CCC(=O)CCCc1ccccc1 Amb17138784 [0,0,0,0,0,2|1,0,0]=3 9696 B13R1.718 CCC(=O)COCc1ccccc1 Amb18186198 [0,0,0,0,0,2|1,0,0]=3 9697 B13R1.718 CCC(=O)NCCc1cc[n]cc1 Amb24073074 [0,0,0,0,0,2|2,0,0]=4 9698 B13R1.718 CCC(=O)NOCc1ccccc1 Amb15742563 [0,0,0,0,0,2|1,0,0]=3 9699 B13R1.718 CCC(=O)N\C=C\c1ccccc1 Amb10561812 [0,0,0,0,0,2|1,0,1]=4 9700 B13R1.718 CC\C(\N)=N\OCc1ccccc1 Amb24626643 [0,0,0,0,0,2|2,0,0]=4 9701 B13R1.718 CNC(=N)COCc1ccccc1 Amb24607701 [0,0,0,0,0,2|2,0,0]=4 9702 B13R1.718 CNC(=N)NCCc1ccccc1 Amb18804663 [0,0,0,0,0,2|2,0,0]=4 9703 B13R1.718 CNC(=N)NNCc1ccccc1 Amb25729841 [0,0,0,0,0,2|2,0,0]=4 9704 B13R1.718 CNC(=O)CCNc1cc[n]cc1 Amb18186363 [0,0,0,0,0,2|2,0,0]=4 9705 B13R1.718 CNC(=O)CCNc1cccc[n]1 Amb18186362 [0,0,0,0,0,2|2,0,0]=4 9706 B13R1.718 CNC(=O)CCNc1ccccc1 Amb18180793 [0,0,0,0,0,2|1,0,0]=3 9707 B13R1.718 CNC(=O)C\C=C\c1ccccc1 Amb25857434 [0,0,0,0,0,2|1,0,0]=3 9708 B13R1.718 CNC(=O)NCCc1cc[n]cc1 Amb22584239 [0,0,0,0,0,2|2,0,0]=4 9709 B13R1.718 CNC(=O)NCCc1ccc[n]c1 Amb22584252 [0,0,0,0,0,2|2,0,0]=4 9710 B13R1.718 CNC(=O)NCCc1cccc[n]1 Amb22584238 [0,0,0,0,0,2|2,0,0]=4 9711 B13R1.718 CNC(=O)NCCc1ccccc1 Amb2132768 [0,0,0,0,0,2|1,0,0]=3 9712 B13R1.718 CNC(=O)\C=C/Sc1ccccc1 Amb24669067 [0,0,0,0,0,2|1,0,1]=4 9713 B13R1.718 CNC(=O)\C=N\Nc1ccccc1 Amb24444432 [0,0,0,0,0,2|1,0,1]=4 9714 B13R1.718 CNC(=S)NNCc1ccccc1 Amb25826591 [0,0,0,0,0,2|1,1,0]=4 9715 B13R1.718 CNC(=S)NOCc1ccccc1 Amb25805223 [0,0,0,0,0,2|1,1,0]=4 9716 B13R1.718 COC(=N)CNCc1ccccc1 Amb25074070 [0,0,0,0,0,2|1,0,0]=3 9717 B13R1.718 COC(=N)COCc1ccccc1 Amb24607698 [0,0,0,0,0,2|1,0,0]=3 9718 B13R1.718 COC(=O)C#CCc1c[n]ccc1 Amb24406047 [0,0,0,0,0,2|1,0,0]=3 9719 B13R1.718 COC(=O)C#CCc1ccccc1 Amb24623934 [0,0,0,0,0,2|0,0,0]=2 9720 B13R1.718 COC(=O)CC#Cc1ccccc1 Amb25763626 [0,0,0,0,0,2|0,0,0]=2 9721 B13R1.718 COC(=O)CCCc1cc[n]cc1 Amb19888651 [0,0,0,0,0,2|1,0,0]=3 9722 B13R1.718 COC(=O)CCCc1ccc[n]c1 Amb24066737 [0,0,0,0,0,2|1,0,0]=3 9723 B13R1.718 COC(=O)CCNc1ccc[n]c1 Amb18933308 [0,0,0,0,0,2|1,0,0]=3 9724 B13R1.718 COC(=O)CCNc1ccccc1 Amb1930724 [0,0,0,0,0,2|0,0,0]=2 9725 B13R1.718 COC(=O)CCNc1ccccn1 Amb1243208 [0,0,0,0,0,2|1,0,0]=3 9726 B13R1.718 COC(=O)CC[NH2+]c1ccccc1 Amb10553942 [0,0,0,0,0,2|0,0,0]=2 9727 B13R1.718 COC(=O)CNCc1ccccc1 Amb21929289 [0,0,0,0,0,2|0,0,0]=2 9728 B13R1.718 COC(=O)C\C=C\c1ccccc1 Amb10563169 [0,0,0,0,0,2|0,0,0]=2 9729 B13R1.718 COC(=O)C\N=C\c1ccccc1 Amb22232615 [0,0,0,0,0,2|0,0,0]=2 9730 B13R1.718 COC(=O)NCCc1ccncc1 Amb1089154 [0,0,0,0,0,2|1,0,0]=3 9731 B13R1.718 COC(=O)NOCc1ccccc1 Amb25359225 [0,0,0,0,0,2|0,0,0]=2 9732 B13R1.718 COC(=O)N\C=C\c1ccccc1 Amb20001007 [0,0,0,0,0,2|0,0,1]=3 9733 B13R1.718 COC(=O)N\N=C\c1ccccc1 Amb2411289 [0,0,0,0,0,2|0,0,1]=3 9734 B13R1.718 COC(=O)\C=C\Nc1ccccc1 Amb2386662 [0,0,0,0,0,2|0,0,1]=3 9735 B13R1.718 COC(=O)\C=N/Nc1ccccc1 Amb24460271 [0,0,0,0,0,2|0,0,1]=3 9736 B13R1.718 COC(C)CNCc1ccccc1 Amb23570905 [0,0,0,0,0,2|1,0,1]=4 9737 B13R1.718 CON(C)CC#Cc1ccccc1 Amb25787926 [0,0,0,0,0,2|2,0,0]=4 9738 B13R1.718 C\C(\CC)=N/OCc1ccccc1 Amb24414826 [0,0,0,0,0,2|2,0,0]=4 9739 B13R1.718 C\C(\CNCc1ccccc1)=C/C Amb18127531 [0,0,0,0,0,2|2,0,0]=4 9740 B13R1.718 C\C(\CNCc1ccccc1)=C\C Amb24414647 [0,0,0,0,0,2|2,0,0]=4 9741 B13R1.718 N#CC(=O)NCCc1ccccc1 Amb25725944 [0,0,0,0,0,2|2,0,0]=4 9742 B13R1.718 NCC(=O)NCCc1ccccc1 Amb13951619 [0,0,0,0,0,2|2,0,0]=4 9743 B13R1.718 NNC(=O)CCNc1ccccc1 Amb10607892 [0,0,0,0,0,2|2,0,0]=4 9744 B13R1.718 NNC(=O)CNCc1ccccc1 Amb21967920 [0,0,0,0,0,2|2,0,0]=4 9745 B13R1.718 NNC(=O)C\C=C\c1ccccc1 Amb24540797 [0,0,0,0,0,2|2,0,0]=4 9746 B13R1.718 NNC(=O)NNCc1ccccc1 Amb24501441 [0,0,0,0,0,2|2,0,0]=4 9747 B13R1.718 NNC(=O)NOCc1ccccc1 Amb25251822 [0,0,0,0,0,2|2,0,0]=4 9748 B13R1.718 O=C(CCl)CCCc1ccccc1 Amb22395307 [0,0,0,0,0,2|2,0,0]=4 9749 B13R1.718 O=C(CCl)CCSc1ccccc1 Amb22395335 [0,0,0,0,0,2|2,0,0]=4 9750 B13R1.718 O=C(CCl)COCc1ccccc1 Amb24738350 [0,0,0,0,0,2|2,0,0]=4 9751 B13R1.718 O=C(CCl)CSCc1ccccc1 Amb22395293 [0,0,0,0,0,2|2,0,0]=4 9752 B13R1.718 OCC(=O)COCc1ccccc1 Amb24555141 [0,0,0,0,0,2|2,0,0]=4 9753 B13R1.718 OCC(=O)NCCc1ccccc1 Amb1111400 [0,0,0,0,0,2|2,0,0]=4 9754 B13R1.718 ONC(=O)CC#Cc1ccccc1 Amb24645077 [0,0,0,0,0,2|2,0,0]=4 9755 B13R1.718 ONC(=O)COCc1ccccc1 Amb25072046 [0,0,0,0,0,2|2,0,0]=4 9756 B13R1.718 ONC(=O)NCCc1ccccc1 Amb25112138 [0,0,0,0,0,2|2,0,0]=4