0 B12R1.286 BrCCc1ccc(c(c1)OC)O 1P024I5X [0,0,0,0,0,0|1,0,1]=2 1 B12R1.286 C=CCc1ccc(c(c1)OC)O 1P00IKCT [0,0,0,0,0,0|0,0,0]=0 2 B12R1.286 CCCc1ccc(c(c1)OC)O 1P002VE9 [0,0,0,0,0,0|0,0,2]=2 3 B12R1.286 CNCc1ccc(c(c1)OC)Br 1P027VYI [0,0,0,0,0,0|2,0,1]=3 4 B12R1.286 CNCc1ccc(c(c1)OC)C 1P0293VY [0,0,0,0,0,0|2,0,1]=3 5 B12R1.286 CNCc1ccc(c(c1)OC)O 1P019LLX [0,0,0,0,0,0|1,0,1]=2 6 B12R1.286 COC1=CC(CNO)=CC=C1O 1P01KGD1 [0,0,0,0,0,0|2,0,0]=2 7 B12R1.286 C\C=C\c1ccc(c(c1)OC)O 1P006C74 [0,0,0,0,0,0|0,0,2]=2 8 B12R1.286 N#CCc1ccc(c(c1)C=O)O 1P01DX2V [0,0,0,0,0,0|3,0,1]=4 9 B12R1.286 N#CCc1ccc(c(c1)OC)Br 1P009MC1 [0,0,0,0,0,0|2,0,1]=3 10 B12R1.286 N#CCc1ccc(c(c1)OC)C 1P003K3L [0,0,0,0,0,0|2,0,1]=3 11 B12R1.286 N#CCc1ccc(c(c1)OC)Cl 1P0013HA [0,0,0,0,0,0|2,0,1]=3 12 B12R1.286 N#CCc1ccc(c(c1)OC)F 1P0036V4 [0,0,0,0,0,0|2,0,1]=3 13 B12R1.286 N#CCc1ccc(c(c1)OC)I 1P0280WD [0,0,0,0,0,0|2,0,1]=3 14 B12R1.286 N#CCc1ccc(c(c1)OC)N 1P028L7Z [0,0,0,0,0,0|2,0,1]=3 15 B12R1.286 N#CCc1ccc(c(c1)OC)O 1P003LYO [0,0,0,0,0,0|1,0,1]=2 16 B12R1.286 N#CSc1ccc(c(c1)OC)O 1P00JHX7 [0,0,0,0,0,0|2,0,1]=3 17 B12R1.286 NCCc1ccc(c(c1)OC)Br 1P00HDN4 [0,0,0,0,0,0|2,0,1]=3 18 B12R1.286 NCCc1ccc(c(c1)OC)C 1P00BBXG [0,0,0,0,0,0|2,0,1]=3 19 B12R1.286 NCCc1ccc(c(c1)OC)Cl 1P01AN9W [0,0,0,0,0,0|2,0,1]=3 20 B12R1.286 NCCc1ccc(c(c1)OC)F 1P01A4P2 [0,0,0,0,0,0|2,0,1]=3 21 B12R1.286 NCCc1ccc(c(c1)OC)F 1P01EINL [0,0,0,0,0,0|2,0,1]=3 22 B12R1.286 NCCc1ccc(c(c1)OC)N 1P01AVHB [0,0,0,0,0,0|2,0,1]=3 23 B12R1.286 NCCc1ccc(c(c1)OC)N 1P01C5YK [0,0,0,0,0,0|2,0,1]=3 24 B12R1.286 NCCc1ccc(c(c1)OC)O 1P001FKO [0,0,0,0,0,0|1,0,1]=2 25 B12R1.286 NCCc1ccc(c(c1)OC)O 1P00D9L7 [0,0,0,0,0,0|1,0,1]=2 26 B12R1.286 NCCc1ncc(c(c1)OC)C 1P0281UM [0,0,0,0,0,0|3,0,1]=4 27 B12R1.286 O=C=Nc1ccc(c(c1)OC)C 1P00EZNJ [0,0,0,0,0,0|3,0,1]=4 28 B12R1.286 O=C=Nc1ccc(c(c1)OC)F 1P023TTK [0,0,0,0,0,0|3,0,1]=4 29 B12R1.286 OCCc1ccc(c(c1)OC)N 1P01BF0I [0,0,0,0,0,0|2,0,1]=3 30 B12R1.286 OCCc1ccc(c(c1)OC)O 1P00I52J [0,0,0,0,0,0|1,0,1]=2 31 B12R1.286 O\N=C\c1ccc(c(c1)OC)O 1P003K3J [0,0,0,0,0,0|2,0,1]=3 32 B12R1.286 S=C=Nc1ccc(c(c1)OC)Cl 1P02033R [0,0,0,0,0,0|3,0,1]=4 33 B11R1.189 BrCCc1cccc(c1)OC 1P003K4F [1,0,0,0,0,0|1,0,1]=3 34 B11R1.189 C#CCc1cccc(c1)OC 1P0248ZW [1,0,0,0,0,0|0,0,2]=3 35 B11R1.189 C=CCc1cccc(c1)C=O 1P00BL33 [1,0,0,0,0,0|2,0,0]=3 36 B11R1.189 C=CCc1cccc(c1)CBr 1P01EMCS [1,0,0,0,0,0|2,0,0]=3 37 B11R1.189 C=CCc1cccc(c1)CO 1P01BOAW [1,0,0,0,0,0|2,0,0]=3 38 B11R1.189 C=CCc1cccc(c1)OC 1P00C2AZ [1,0,0,0,0,0|0,0,0]=1 39 B11R1.189 CCNc1cccc(c1)OC 1P00CLVM [1,0,0,0,0,0|1,0,2]=4 40 B11R1.189 CNCc1cccc(c1)CC 1P027Y02 [1,0,0,0,0,0|2,0,1]=4 41 B11R1.189 CNCc1cccc(c1)OC 1P003BEX [1,0,0,0,0,0|1,0,1]=3 42 B11R1.189 CNCc1cccc(c1)OC 1P00J3G2 [1,0,0,0,0,0|1,0,1]=3 43 B11R1.189 CNCc1cccc(c1)SC 1P00GU6J [1,0,0,0,0,0|1,1,1]=4 44 B11R1.189 CNCc1cccc(n1)OC 1P028VLC [1,0,0,0,0,0|2,0,1]=4 45 B11R1.189 CNCc1ccnc(c1)OC 1P027YC1 [1,0,0,0,0,0|2,0,1]=4 46 B11R1.189 CNCc1cncc(c1)OC 1P01E8MC [1,0,0,0,0,0|2,0,1]=4 47 B11R1.189 CNCc1nccc(c1)OC 1P00J3I4 [1,0,0,0,0,0|2,0,1]=4 48 B11R1.189 COc1cc(CCO)ncc1 1P024URU [1,0,0,0,0,0|2,0,1]=4 49 B11R1.189 CSCc1cccc(c1)OC 1P01DIVQ [1,0,0,0,0,0|1,0,1]=3 50 B11R1.189 ClCCc1cccc(c1)OC 1P005NKH [1,0,0,0,0,0|1,0,1]=3 51 B11R1.189 N#CCc1cccc(c1)OC 1P002CH1 [1,0,0,0,0,0|1,0,1]=3 52 B11R1.189 N#CCc1cccc(n1)OC 1P00014O [1,0,0,0,0,0|2,0,1]=4 53 B11R1.189 N#CCc1ccnc(c1)OC 1P005YCE [1,0,0,0,0,0|2,0,1]=4 54 B11R1.189 NCCc1cccc(c1)OC 1P0029N3 [1,0,0,0,0,0|1,0,1]=3 55 B11R1.189 NCCc1cccc(c1)SC 1P0293OP [1,0,0,0,0,0|1,1,1]=4 56 B11R1.189 NCCc1cccc(n1)OC 1P00BBSA [1,0,0,0,0,0|2,0,1]=4 57 B11R1.189 NCCc1cccc(n1)OC 1P01BVBV [1,0,0,0,0,0|2,0,1]=4 58 B11R1.189 NCCc1ccnc(c1)OC 1P00G36D [1,0,0,0,0,0|2,0,1]=4 59 B11R1.189 NCCc1ccnc(c1)OC 1P019FD5 [1,0,0,0,0,0|2,0,1]=4 60 B11R1.189 NNCc1cccc(c1)OC 1P00G52E [1,0,0,0,0,0|2,0,0]=3 61 B11R1.189 NNCc1cccc(c1)OC 1P00J1XQ [1,0,0,0,0,0|2,0,0]=3 62 B11R1.189 NOCc1cccc(c1)OC 1P00C8S5 [1,0,0,0,0,0|2,0,0]=3 63 B11R1.189 O=C=Nc1cccc(c1)OC 1P002IB0 [1,0,0,0,0,0|2,0,1]=4 64 B11R1.189 O=CCc1cccc(c1)OC 1P00EAYN [1,0,0,0,0,0|1,0,0]=2 65 B11R1.189 OCCc1cccc(c1)OC 1P00347K [1,0,0,0,0,0|1,0,1]=3 66 B11R1.189 OCCc1cccc(n1)OC 1P00BBUK [1,0,0,0,0,0|2,0,1]=4 67 B11R1.189 ON=Cc1cccc(c1)OC 1P01BGJQ [1,0,0,0,0,0|2,0,1]=4 68 B11R1.189 S=C=Nc1cccc(c1)OC 1P003K4G [1,0,0,0,0,0|2,0,1]=4 69 B11R1.189 [C-]#[N+]Cc1cccc(c1)OC 1P00AKTA [1,0,0,0,0,0|1,0,1]=3 70 B11R1.189 [N-]=[N+]=Nc1cccc(c1)OC 1P003JEZ [1,0,0,0,0,0|3,0,0]=4 71 B11R1.192 BrCCc1ccc(c(c1)O)O 1P00BLT0 [1,0,0,0,0,0|1,0,1]=3 72 B11R1.192 C=CCc1ccc(c(c1)C)F 1P004SD9 [1,0,0,0,0,0|1,0,0]=2 73 B11R1.192 C=CCc1ccc(c(c1)Cl)F 1P0015WL [1,0,0,0,0,0|2,0,0]=3 74 B11R1.192 C=CCc1ccc(c(c1)O)O 1P008YIU [1,0,0,0,0,0|0,0,0]=1 75 B11R1.192 CCCc1ccc(c(c1)O)O 1P00BVV1 [1,0,0,0,0,0|0,0,2]=3 76 B11R1.192 CCOc1ccc(c(c1)C)O 1P004XJX [1,0,0,0,0,0|1,0,2]=4 77 B11R1.192 CCSc1ccc(c(c1)C)O 1P027OVR [1,0,0,0,0,0|1,0,2]=4 78 B11R1.192 CNCc1ccc(c(c1)C)Br 1P01AWSM [1,0,0,0,0,0|2,0,1]=4 79 B11R1.192 CNCc1ccc(c(c1)C)C 1P001WSK [1,0,0,0,0,0|2,0,1]=4 80 B11R1.192 CNCc1ccc(c(c1)C)C 1P01C2EB [1,0,0,0,0,0|2,0,1]=4 81 B11R1.192 CNCc1ccc(c(c1)C)Cl 1P028JXF [1,0,0,0,0,0|2,0,1]=4 82 B11R1.192 CNCc1ccc(c(c1)C)F 1P01BF9Q [1,0,0,0,0,0|2,0,1]=4 83 B11R1.192 CNCc1ccc(c(c1)O)O 1P00085M [1,0,0,0,0,0|1,0,1]=3 84 B11R1.192 COCc1ccc(c(c1)C)N 1P028NM8 [1,0,0,0,0,0|2,0,1]=4 85 B11R1.192 N#CCc1ccc(c(c1)C)Br 1P007QD9 [1,0,0,0,0,0|2,0,1]=4 86 B11R1.192 N#CCc1ccc(c(c1)C)C 1P00BDNI [1,0,0,0,0,0|2,0,1]=4 87 B11R1.192 N#CCc1ccc(c(c1)C)Cl 1P01DX6K [1,0,0,0,0,0|2,0,1]=4 88 B11R1.192 N#CCc1ccc(c(c1)C)F 1P009PBH [1,0,0,0,0,0|2,0,1]=4 89 B11R1.192 N#CCc1ccc(c(c1)C)O 1P027L4E [1,0,0,0,0,0|1,0,1]=3 90 B11R1.192 N#CCc1ccc(c(c1)O)I 1P028FPC [1,0,0,0,0,0|2,0,1]=4 91 B11R1.192 N#CCc1ccc(c(c1)O)O 1P007T63 [1,0,0,0,0,0|1,0,1]=3 92 B11R1.192 N#CSc1ccc(c(c1)C)O 1P00C8Y5 [1,0,0,0,0,0|2,0,1]=4 93 B11R1.192 NCCc1ccc(c(c1)C)Br 1P00598P [1,0,0,0,0,0|2,0,1]=4 94 B11R1.192 NCCc1ccc(c(c1)C)Br 1P0283MG [1,0,0,0,0,0|2,0,1]=4 95 B11R1.192 NCCc1ccc(c(c1)C)C 1P00APR3 [1,0,0,0,0,0|2,0,1]=4 96 B11R1.192 NCCc1ccc(c(c1)C)C 1P01B5ST [1,0,0,0,0,0|2,0,1]=4 97 B11R1.192 NCCc1ccc(c(c1)C)F 1P01A5BS [1,0,0,0,0,0|2,0,1]=4 98 B11R1.192 NCCc1ccc(c(c1)N)O 1P028GYY [1,0,0,0,0,0|2,0,1]=4 99 B11R1.192 NCCc1ccc(c(c1)O)C 1P028NJK [1,0,0,0,0,0|2,0,1]=4 100 B11R1.192 NCCc1ccc(c(c1)O)O 1P003K1P [1,0,0,0,0,0|1,0,1]=3 101 B11R1.192 NCCc1ccc(c(c1)O)O 1P00DCU4 [1,0,0,0,0,0|1,0,1]=3 102 B11R1.192 NCCc1ccc(c(c1)O)O 1P00IBF1 [1,0,0,0,0,0|1,0,1]=3 103 B11R1.192 NOCc1ccc(c(c1)F)O 1P028X9Q [1,0,0,0,0,0|3,0,0]=4 104 B11R1.192 NOCc1ccc(c(c1)O)Br 1P01BB88 [1,0,0,0,0,0|3,0,0]=4 105 B11R1.192 O=CCc1ccc(c(c1)C)C 1P005O77 [1,0,0,0,0,0|2,0,0]=3 106 B11R1.192 O=CCc1ccc(c(c1)C)F 1P000OPQ [1,0,0,0,0,0|2,0,0]=3 107 B11R1.192 O=CCc1ccc(c(c1)Cl)Cl 1P006FY2 [1,0,0,0,0,0|3,0,0]=4 108 B11R1.192 O=CCc1ccc(c(c1)F)Br 1P0095VC [1,0,0,0,0,0|3,0,0]=4 109 B11R1.192 O=CCc1ccc(c(c1)O)O 1P00EEXO [1,0,0,0,0,0|1,0,0]=2 110 B11R1.192 OCCc1ccc(c(c1)C)N 1P028ETB [1,0,0,0,0,0|2,0,1]=4 111 B11R1.192 OCCc1ccc(c(c1)Cl)O 1P01DWX8 [1,0,0,0,0,0|2,0,1]=4 112 B11R1.192 OCCc1ccc(c(c1)F)O 1P00DJSS [1,0,0,0,0,0|2,0,1]=4 113 B11R1.192 OCCc1ccc(c(c1)O)O 1P008RI5 [1,0,0,0,0,0|1,0,1]=3 114 B11R1.280 CCc1cc(C#N)ccc1O 1P00DLHX [1,0,0,0,0,0|2,0,1]=4 115 B11R1.280 CCc1cc(C=O)ccc1Cl 1P01F00E [1,0,0,0,0,0|3,0,0]=4 116 B11R1.280 CCc1cc(C=O)ccc1F 1P00CMSV [1,0,0,0,0,0|3,0,0]=4 117 B11R1.280 CCc1cc(CBr)ccc1C 1P0293AU [1,0,0,0,0,0|3,0,0]=4 118 B11R1.280 CCc1cc(CBr)ccc1F 1P028U1B [1,0,0,0,0,0|3,0,0]=4 119 B11R1.280 CCc1cc(CCl)ccc1Cl 1P027Y30 [1,0,0,0,0,0|3,0,0]=4 120 B11R1.280 CCc1cc(CO)ccc1C 1P01DQTJ [1,0,0,0,0,0|3,0,0]=4 121 B11R1.280 CCc1cc(CO)ccc1F 1P0009CU [1,0,0,0,0,0|3,0,0]=4 122 B11R1.280 CCc1ccc(c(c1)C=O)O 1P00DD2Z [1,0,0,0,0,0|2,0,1]=4 123 B11R1.280 CCc1ccc(c(c1)OC)Br 1P00133L [1,0,0,0,0,0|1,0,1]=3 124 B11R1.280 CCc1ccc(c(c1)OC)O 1P002VE7 [1,0,0,0,0,0|0,0,1]=2 125 B11R1.280 CNC1=CC=C(F)C(OC)=C1 1P01JYUO [1,0,0,0,0,0|2,0,1]=4 126 B11R1.280 CNc1ccc(c(c1)OC)C 1P027YP8 [1,0,0,0,0,0|2,0,1]=4 127 B11R1.280 COc1cc(C#C)ccc1Br 1P01PSUG [1,0,0,0,0,0|1,0,2]=4 128 B11R1.280 COc1cc(C#C)ccc1Cl 1P01AUXR [1,0,0,0,0,0|1,0,2]=4 129 B11R1.280 COc1cc(C#C)ccc1F 1P01PW1L [1,0,0,0,0,0|1,0,2]=4 130 B11R1.280 COc1cc(C#N)ccc1Br 1P0081MF [1,0,0,0,0,0|2,0,1]=4 131 B11R1.280 COc1cc(C#N)ccc1C 1P003K3K [1,0,0,0,0,0|2,0,1]=4 132 B11R1.280 COc1cc(C#N)ccc1Cl 1P002EA2 [1,0,0,0,0,0|2,0,1]=4 133 B11R1.280 COc1cc(C#N)ccc1F 1P003LUW [1,0,0,0,0,0|2,0,1]=4 134 B11R1.280 COc1cc(C#N)ccc1I 1P01ILZ1 [1,0,0,0,0,0|2,0,1]=4 135 B11R1.280 COc1cc(C#N)ccc1N 1P0025TH [1,0,0,0,0,0|2,0,1]=4 136 B11R1.280 COc1cc(C#N)ccc1O 1P003LYJ [1,0,0,0,0,0|1,0,1]=3 137 B11R1.280 COc1cc(C=C)ccc1Br 1P01Q849 [1,0,0,0,0,0|1,0,0]=2 138 B11R1.280 COc1cc(C=C)ccc1F 1P00EOH4 [1,0,0,0,0,0|1,0,0]=2 139 B11R1.280 COc1cc(C=C)ccc1O 1P003HZP [1,0,0,0,0,0|0,0,0]=1 140 B11R1.280 COc1cc(C=O)ccc1Br 1P0074T8 [1,0,0,0,0,0|2,0,0]=3 141 B11R1.280 COc1cc(C=O)ccc1C 1P002QIY [1,0,0,0,0,0|2,0,0]=3 142 B11R1.280 COc1cc(C=O)ccc1Cl 1P0013HE [1,0,0,0,0,0|2,0,0]=3 143 B11R1.280 COc1cc(C=O)ccc1F 1P000YLB [1,0,0,0,0,0|2,0,0]=3 144 B11R1.280 COc1cc(C=O)ccc1I 1P00AIQ2 [1,0,0,0,0,0|2,0,0]=3 145 B11R1.280 COc1cc(C=O)ccc1O 1P0038DS [1,0,0,0,0,0|1,0,0]=2 146 B11R1.280 COc1cc(C=O)ccc1S 1P019Y2V [1,0,0,0,0,0|1,1,0]=3 147 B11R1.280 COc1cc(C=O)cnc1Cl 1P00HB7M [1,0,0,0,0,0|3,0,0]=4 148 B11R1.280 COc1cc(C=O)ncc1C 1P00H6NO [1,0,0,0,0,0|3,0,0]=4 149 B11R1.280 COc1cc(CBr)ccc1Br 1P000FQX [1,0,0,0,0,0|2,0,0]=3 150 B11R1.280 COc1cc(CBr)ccc1C 1P01BCZU [1,0,0,0,0,0|2,0,0]=3 151 B11R1.280 COc1cc(CBr)ccc1Cl 1P0038TK [1,0,0,0,0,0|2,0,0]=3 152 B11R1.280 COc1cc(CBr)ccc1F 1P001GBX [1,0,0,0,0,0|2,0,0]=3 153 B11R1.280 COc1cc(CBr)ccc1I 1P01FHIW [1,0,0,0,0,0|2,0,0]=3 154 B11R1.280 COc1cc(CBr)cnc1Cl 1P0292UX [1,0,0,0,0,0|3,0,0]=4 155 B11R1.280 COc1cc(CCl)ccc1Cl 1P0013HC [1,0,0,0,0,0|2,0,0]=3 156 B11R1.280 COc1cc(CCl)ccc1I 1P028QYP [1,0,0,0,0,0|2,0,0]=3 157 B11R1.280 COc1cc(CCl)cnc1Cl 1P01B2PQ [1,0,0,0,0,0|3,0,0]=4 158 B11R1.280 COc1cc(CCl)ncc1C 1P005XWY [1,0,0,0,0,0|3,0,0]=4 159 B11R1.280 COc1cc(CCl)ncc1Cl 1P01A2K8 [1,0,0,0,0,0|3,0,0]=4 160 B11R1.280 COc1cc(CN)ccc1C 1P0096T5 [1,0,0,0,0,0|2,0,0]=3 161 B11R1.280 COc1cc(CN)ccc1C 1P00BJTX [1,0,0,0,0,0|2,0,0]=3 162 B11R1.280 COc1cc(CN)ccc1Cl 1P001YWR [1,0,0,0,0,0|2,0,0]=3 163 B11R1.280 COc1cc(CN)ccc1Cl 1P002PSM [1,0,0,0,0,0|2,0,0]=3 164 B11R1.280 COc1cc(CN)ccc1F 1P006W9D [1,0,0,0,0,0|2,0,0]=3 165 B11R1.280 COc1cc(CN)ccc1F 1P00IEQ0 [1,0,0,0,0,0|2,0,0]=3 166 B11R1.280 COc1cc(CN)ccc1N 1P01FJ8I [1,0,0,0,0,0|2,0,0]=3 167 B11R1.280 COc1cc(CN)ccc1O 1P000PPR [1,0,0,0,0,0|1,0,0]=2 168 B11R1.280 COc1cc(CN)ccc1O 1P003LYL [1,0,0,0,0,0|1,0,0]=2 169 B11R1.280 COc1cc(CO)ccc1Br 1P0038P1 [1,0,0,0,0,0|2,0,0]=3 170 B11R1.280 COc1cc(CO)ccc1C 1P00DJ4Y [1,0,0,0,0,0|2,0,0]=3 171 B11R1.280 COc1cc(CO)ccc1Cl 1P0013HD [1,0,0,0,0,0|2,0,0]=3 172 B11R1.280 COc1cc(CO)ccc1F 1P000YLC [1,0,0,0,0,0|2,0,0]=3 173 B11R1.280 COc1cc(CO)ccc1I 1P01FHIX [1,0,0,0,0,0|2,0,0]=3 174 B11R1.280 COc1cc(CO)ccc1N 1P001LE8 [1,0,0,0,0,0|2,0,0]=3 175 B11R1.280 COc1cc(CO)ccc1O 1P003LYK [1,0,0,0,0,0|1,0,0]=2 176 B11R1.280 COc1cc(CO)cnc1Cl 1P00H2RZ [1,0,0,0,0,0|3,0,0]=4 177 B11R1.280 COc1cc(CO)ncc1Br 1P00HH63 [1,0,0,0,0,0|3,0,0]=4 178 B11R1.280 COc1cc(NN)ccc1Cl 1P01BF6B [1,0,0,0,0,0|3,0,0]=4 179 B11R1.280 COc1cc(NN)ccc1F 1P00CNSU [1,0,0,0,0,0|3,0,0]=4 180 B11R1.280 COc1cc(NN)ccc1F 1P028DTJ [1,0,0,0,0,0|3,0,0]=4 181 B11R1.280 COc1cc(SC)ccc1Br 1P01DKY5 [1,0,0,0,0,0|2,0,1]=4 182 B11R1.280 COc1cc(SC)ccc1N 1P019UBP [1,0,0,0,0,0|2,0,1]=4 183 B11R1.280 COc1cc(SC)ccc1N 1P01BFKH [1,0,0,0,0,0|2,0,1]=4 184 B11R1.280 COc1ccc(c(c1)OC)Br 1P0025L0 [1,0,0,0,0,0|2,0,1]=4 185 B11R1.280 COc1ccc(c(c1)OC)C 1P003GAK [1,0,0,0,0,0|2,0,1]=4 186 B11R1.280 COc1ccc(c(c1)OC)Cl 1P005IXB [1,0,0,0,0,0|2,0,1]=4 187 B11R1.280 COc1ccc(c(c1)OC)F 1P0025KZ [1,0,0,0,0,0|2,0,1]=4 188 B11R1.280 COc1ccc(c(c1)OC)I 1P002A43 [1,0,0,0,0,0|2,0,1]=4 189 B11R1.280 COc1ccc(c(c1)OC)N 1P003GA9 [1,0,0,0,0,0|2,0,1]=4 190 B11R1.280 COc1ccc(c(c1)OC)O 1P00151L [1,0,0,0,0,0|1,0,1]=3 191 B11R1.280 COc1ccc(c(c1)OC)S 1P002I9L [1,0,0,0,0,0|1,1,1]=4 192 B11R1.280 COc1ccc(c(n1)OC)O 1P01DNZ2 [1,0,0,0,0,0|2,0,1]=4 193 B11R1.280 COc1nc(C=O)ccc1Br 1P01EC72 [1,0,0,0,0,0|3,0,0]=4 194 B11R1.280 COc1nc(C=O)ccc1C 1P00A6XB [1,0,0,0,0,0|3,0,0]=4 195 B11R1.280 COc1nc(C=O)ccc1Cl 1P01KLGK [1,0,0,0,0,0|3,0,0]=4 196 B11R1.280 COc1nc(CCl)ccc1Br 1P00KIVC [1,0,0,0,0,0|3,0,0]=4 197 B11R1.280 COc1nc(CN)ccc1Cl 1P01KLB2 [1,0,0,0,0,0|3,0,0]=4 198 B11R1.280 CSc1cc(C=O)ccc1O 1P0021F0 [1,0,0,0,0,0|1,1,0]=3 199 B11R1.280 ClCc1ccc(c(c1)C=O)O 1P00BCD4 [1,0,0,0,0,0|3,0,0]=4 200 B11R1.280 O=Cc1ccc(c(c1)C#N)O 1P005PO6 [1,0,0,0,0,0|3,0,0]=4 201 B11R1.280 O=Cc1ccc(c(c1)C=O)O 1P003M05 [1,0,0,0,0,0|3,0,0]=4 202 B11R1.280 OCc1cc(C=O)ccc1O 1P00DJXX [1,0,0,0,0,0|3,0,0]=4 203 B11R1.280 OCc1ccc(c(c1)C=O)O 1P008P64 [1,0,0,0,0,0|3,0,0]=4 204 B11R1.280 OCc1ccc(c(c1)CO)O 1P002YN4 [1,0,0,0,0,0|3,0,0]=4 205 B13R1.49 BrCC(=O)c1ccc(c(c1)OC)O 1P005VXD [0,1,0,0,0,0|1,0,2]=4 206 B13R1.49 CCC(=O)c1ccc(c(c1)OC)O 1P00283V [0,1,0,0,0,0|0,0,3]=4 207 B13R1.49 CCC(c1ccc(c(c1)OC)O)O 1P00JHXT [0,1,0,0,0,0|0,0,2]=3 208 B13R1.49 COC(=O)c1ccc(c(c1)OC)O 1P0035PY [0,1,0,0,0,0|1,0,2]=4 209 B13R1.49 NCC(=O)c1ccc(c(c1)OC)O 1P028DII [0,1,0,0,0,0|1,0,2]=4 210 B13R1.49 NCC(c1ccc(c(c1)OC)Cl)F 1P01EIQG [0,1,0,0,0,0|2,0,1]=4 211 B13R1.49 NCC(c1ccc(c(c1)OC)O)O 1P000483 [0,1,0,0,0,0|1,0,1]=3 212 B13R1.49 NCC(c1ccc(c(c1)OC)O)O 1P01DIGL [0,1,0,0,0,0|1,0,1]=3 213 B13R1.49 NNC(=O)c1ccc(c(c1)OC)O 1P0002A0 [0,1,0,0,0,0|2,0,1]=4 214 B13R1.49 OCC(c1ccc(c(c1)OC)O)O 1P006HYH [0,1,0,0,0,0|1,0,1]=3 215 B13R1.49 OC[C@@H](c1ccc(c(c1)OC)F)N 1P01KL5L [0,1,0,0,0,0|2,0,1]=4 216 B13R1.49 OC[C@H](c1ccc(c(c1)OC)F)N 1P01DUOJ [0,1,0,0,0,0|2,0,1]=4 217 B13R1.49 ON=C(c1ccc(c(c1)OC)O)N 1P01A8MG [0,1,0,0,0,0|2,0,1]=4 218 B13R1.52 CCc1cc(ccc1F)CC(=O)O 1P028EQ4 [0,1,0,0,0,0|3,0,0]=4 219 B13R1.52 COc1cc(ccc1Br)CC(=O)O 1P00IKRR [0,1,0,0,0,0|2,0,0]=3 220 B13R1.52 COc1cc(ccc1C)CC(=O)O 1P0003IS [0,1,0,0,0,0|2,0,0]=3 221 B13R1.52 COc1cc(ccc1Cl)CC(=O)O 1P0013HB [0,1,0,0,0,0|2,0,0]=3 222 B13R1.52 COc1cc(ccc1Cl)NC(=S)N 1P00LE2B [0,1,0,0,0,0|3,0,0]=4 223 B13R1.52 COc1cc(ccc1F)CC(=O)C 1P01EAYO [0,1,0,0,0,0|1,0,1]=3 224 B13R1.52 COc1cc(ccc1F)CC(=O)O 1P00IIWD [0,1,0,0,0,0|2,0,0]=3 225 B13R1.52 COc1cc(ccc1F)NC(=S)N 1P01FF2P [0,1,0,0,0,0|3,0,0]=4 226 B13R1.52 COc1cc(ccc1I)NC(=O)C 1P01AHYP [0,1,0,0,0,0|2,0,1]=4 227 B13R1.52 COc1cc(ccc1N)CC(=O)O 1P028S99 [0,1,0,0,0,0|2,0,0]=3 228 B13R1.52 COc1cc(ccc1N)CN(C)C 1P00H5S3 [0,1,0,0,0,0|2,0,1]=4 229 B13R1.52 COc1cc(ccc1N)NC(=O)C 1P01A1WD [0,1,0,0,0,0|2,0,1]=4 230 B13R1.52 COc1cc(ccc1O)CC(=O)C 1P002QOT [0,1,0,0,0,0|0,0,1]=2 231 B13R1.52 COc1cc(ccc1O)CC(=O)O 1P00313T [0,1,0,0,0,0|1,0,0]=2 232 B13R1.52 COc1cc(ccc1O)CC(N)C 1P00A0CB [0,1,0,0,0,0|0,0,2]=3 233 B13R1.52 COc1cc(ccc1O)CN(C)C 1P01ALLK [0,1,0,0,0,0|1,0,1]=3 234 B13R1.52 COc1cc(ccc1O)OC(=O)C 1P01FLYC [0,1,0,0,0,0|1,0,1]=3 235 B13R1.384 CCOc1cc(C=NO)ccc1O 1P00CUCA [0,1,0,0,0,0|2,0,1]=4 236 B13R1.384 OCCc1ccc(c(c1)OCC)O 1P01BBJC [0,1,0,0,0,0|1,0,1]=3 237 B13R1.386 BrCCc1ccc(c(c1)OC)OC 1P003IYX [0,1,0,0,0,0|1,0,1]=3 238 B13R1.386 C=CCc1ccc(c(c1)OC)OC 1P0035PF [0,1,0,0,0,0|0,0,0]=1 239 B13R1.386 CC=Cc1ccc(c(c1)OC)OC 1P006IK7 [0,1,0,0,0,0|0,0,2]=3 240 B13R1.386 CCCc1ccc(c(c1)OC)OC 1P00EB24 [0,1,0,0,0,0|0,0,2]=3 241 B13R1.386 CCNc1ccc(c(c1)OC)OC 1P00C13U [0,1,0,0,0,0|1,0,2]=4 242 B13R1.386 CNCc1ccc(c(c1)OC)OC 1P003TN9 [0,1,0,0,0,0|1,0,1]=3 243 B13R1.386 CNCc1ccc(c(c1)OC)SC 1P01A8CD [0,1,0,0,0,0|1,1,1]=4 244 B13R1.386 C\C=C\c1ccc(c(c1)OC)OC 1P0036GL [0,1,0,0,0,0|0,0,2]=3 245 B13R1.386 ClCCc1ccc(c(c1)OC)OC 1P007M8F [0,1,0,0,0,0|1,0,1]=3 246 B13R1.386 N#CCc1ccc(c(c1)OC)OC 1P003IZ1 [0,1,0,0,0,0|1,0,1]=3 247 B13R1.386 N#CCc1ccc(c(c1)OC)SC 1P01AHDP [0,1,0,0,0,0|1,1,1]=4 248 B13R1.386 N#CCc1ccc(c(c1)SC)OC 1P01AHKK [0,1,0,0,0,0|1,1,1]=4 249 B13R1.386 NCCc1ccc(c(c1)OC)OC 1P000QGT [0,1,0,0,0,0|1,0,1]=3 250 B13R1.386 NCCc1ccc(c(c1)OC)OC 1P00EC91 [0,1,0,0,0,0|1,0,1]=3 251 B13R1.386 O=C=Nc1ccc(c(c1)OC)OC 1P003M1R [0,1,0,0,0,0|2,0,1]=4 252 B13R1.386 O=CCc1ccc(c(c1)OC)OC 1P00382A [0,1,0,0,0,0|1,0,0]=2 253 B13R1.386 OCCc1ccc(c(c1)OC)OC 1P00FACH [0,1,0,0,0,0|1,0,1]=3 254 B13R1.386 O\N=C\c1ccc(c(c1)OC)OC 1P00C1KU [0,1,0,0,0,0|2,0,1]=4 255 B13R1.386 S=C=Nc1ccc(c(c1)OC)OC 1P003IYZ [0,1,0,0,0,0|2,0,1]=4 256 B13R1.386 [N-]=[N+]=Nc1ccc(c(c1)OC)OC 1P004RFI [0,1,0,0,0,0|3,0,0]=4 257 B13R1.387 CCCc1ccc(c(c1)C(=O)C)O 1P019GI6 [0,1,0,0,0,0|1,0,2]=4 258 B13R1.575 CCCOc1ccc(c(c1)OC)Br 1P01B2WG [0,1,0,0,0,0|1,0,2]=4 259 B13R1.575 CCOCc1ccc(c(c1)OC)O 1P0010AE [0,1,0,0,0,0|0,0,2]=3 260 B13R1.575 CNCCc1ccc(c(c1)OC)O 1P01RS3Q [0,1,0,0,0,0|0,0,2]=3 261 B13R1.575 O=CCCc1ccc(c(c1)OC)O 1P0052LX [0,1,0,0,0,0|0,0,1]=2 262 B13R1.575 O=C\C=C\c1ccc(c(c1)OC)O 1P003LYM [0,1,0,0,0,0|0,0,1]=2 263 B13R1.575 OCCCc1ccc(c(c1)OC)C 1P019FIO [0,1,0,0,0,0|1,0,2]=4 264 B13R1.575 OCCCc1ccc(c(c1)OC)O 1P003PZK [0,1,0,0,0,0|0,0,2]=3 265 B13R1.575 OC\C=C\c1ccc(c(c1)OC)O 1P003PI8 [0,1,0,0,0,0|0,0,2]=3 266 B13R1.1255 CNCc1ccc(c(c1F)OC)F 1P027WVC [0,1,0,0,0,0|2,0,1]=4 267 B13R1.1255 N#CCc1ccc(c(c1F)OC)Cl 1P009J4K [0,1,0,0,0,0|2,0,1]=4 268 B13R1.1255 NCCc1ccc(c(c1F)OC)F 1P027WKA [0,1,0,0,0,0|2,0,1]=4 269 B13R1.1255 OCCc1ccc(c(c1F)OC)F 1P028FN1 [0,1,0,0,0,0|2,0,1]=4 270 B13R1.4030 N#CCc1cc(OC)c(c(c1)Br)O 1P0050K0 [0,1,0,0,0,0|1,0,1]=3 271 B13R1.4030 NCCc1cc(OC)c(c(c1)O)O 1P0287J0 [0,1,0,0,0,0|1,0,1]=3 272 B13R2.121 CCc1c(N)ccc2c1cc[nH]2 1P0002BC [0,0,0,1,0,0|3,0,0]=4 273 B13R2.121 COc1c(Br)ccc2c1[nH]cn2 1P01XGHG [0,0,0,1,0,0|3,0,0]=4 274 B13R2.121 COc1c(Br)ccc2c1ccs2 1P005YJA [0,0,0,1,0,0|2,0,0]=3 275 B13R2.121 COc1c(Br)ccc2c1cn[nH]2 1P004TC4 [0,0,0,1,0,0|3,0,0]=4 276 B13R2.121 COc1c(Br)ccc2n1ccn2 1P02899T [0,0,0,1,0,0|3,0,0]=4 277 B13R2.121 COc1c(Br)cnc2c1cc[nH]2 1P00835R [0,0,0,1,0,0|3,0,0]=4 278 B13R2.121 COc1c(Cl)ccc2c1scc2 1P0284CF [0,0,0,1,0,0|2,0,1]=4 279 B13R2.121 COc1c(F)ccc2c1cc[nH]2 1P022258 [0,0,0,1,0,0|2,0,0]=3 280 B13R2.121 COc1c(N)ccn2c1ccn2 1P01XA9O [0,0,0,1,0,0|3,0,0]=4 281 B13R2.449 BrCCc1ccc2c(c1)CCO2 1P000XAG [0,0,0,1,0,0|2,0,1]=4 282 B13R2.449 BrCCc1ccc2c(c1)OCO2 1P00KIUG [0,0,0,1,0,0|1,0,1]=3 283 B13R2.449 CCNc1ccc2c(c1)OCO2 1P003TGC [0,0,0,1,0,0|1,0,2]=4 284 B13R2.449 CNCc1ccc2c(c1)CCO2 1P01BEQP [0,0,0,1,0,0|2,0,1]=4 285 B13R2.449 CNCc1ccc2c(c1)OCO2 1P00ABRI [0,0,0,1,0,0|1,0,1]=3 286 B13R2.449 ClCCc1ccc2c(c1)CCO2 1P005ZOK [0,0,0,1,0,0|2,0,1]=4 287 B13R2.449 N#CCc1ccc2c(c1)CCO2 1P00AODX [0,0,0,1,0,0|2,0,1]=4 288 B13R2.449 N#CCc1ccc2c(c1)OCO2 1P003IUR [0,0,0,1,0,0|1,0,1]=3 289 B13R2.449 NCCc1ccc2c(c1)CCO2 1P01AIUH [0,0,0,1,0,0|2,0,1]=4 290 B13R2.449 NCCc1ccc2c(c1)CCO2 1P01BDPQ [0,0,0,1,0,0|2,0,1]=4 291 B13R2.449 NNCc1ccc2c(c1)OCO2 1P00J1XN [0,0,0,1,0,0|2,0,0]=3 292 B13R2.449 O=C=Nc1ccc2c(c1)OCO2 1P0034R6 [0,0,0,1,0,0|2,0,1]=4 293 B13R2.449 O=CCc1ccc2c(c1)OCO2 1P00F4HN [0,0,0,1,0,0|1,0,0]=2 294 B13R2.449 O=CNc1ccc2c(c1)OCO2 1P01A24K [0,0,0,1,0,0|2,0,0]=3 295 B13R2.449 OCCc1ccc2c(c1)CCO2 1P004LFM [0,0,0,1,0,0|2,0,1]=4 296 B13R2.449 OCCc1ccc2c(c1)OCO2 1P00EARS [0,0,0,1,0,0|1,0,1]=3 297 B13R2.449 S=C=Nc1ccc2c(c1)OCO2 1P0009AE [0,0,0,1,0,0|2,0,1]=4 298 B13R2.449 [N-]=[N+]=Nc1ccc2c(c1)OCO2 1P02848S [0,0,0,1,0,0|3,0,0]=4 299 B13R2.599 COc1cc2CCCc2cc1F 1P01OOUI [0,0,0,1,0,0|1,0,2]=4 300 B13R2.599 COc1cc2CCCc2cc1O 1P028CEF [0,0,0,1,0,0|0,0,2]=3 301 B13R2.599 COc1cc2CCNc2cc1F 1P028ECA [0,0,0,1,0,0|2,0,1]=4 302 B13R2.599 COc1cc2COCc2cc1Br 1P01DWAL [0,0,0,1,0,0|2,0,1]=4 303 B13R2.599 COc1cc2[nH]ccc2cc1Br 1P00I06D [0,0,0,1,0,0|2,0,0]=3 304 B13R2.599 COc1cc2[nH]ccc2cc1C 1P008Y73 [0,0,0,1,0,0|2,0,0]=3 305 B13R2.599 COc1cc2[nH]ccc2cc1Cl 1P006BCX [0,0,0,1,0,0|2,0,0]=3 306 B13R2.599 COc1cc2[nH]ccc2cc1F 1P003N86 [0,0,0,1,0,0|2,0,0]=3 307 B13R2.599 COc1cc2[nH]ccc2cc1O 1P00BK6W [0,0,0,1,0,0|1,0,0]=2 308 B13R2.599 COc1cc2[nH]ncc2cc1Br 1P0034OX [0,0,0,1,0,0|3,0,0]=4 309 B13R2.599 COc1cc2[nH]ncc2cc1Cl 1P0099PT [0,0,0,1,0,0|3,0,0]=4 310 B13R2.599 COc1cc2[nH]ncc2cc1F 1P00HBK1 [0,0,0,1,0,0|3,0,0]=4 311 B13R2.599 COc1cc2[nH]ncc2cc1I 1P008Y74 [0,0,0,1,0,0|3,0,0]=4 312 B13R2.599 COc1cc2[nH]ncc2cc1N 1P003A9F [0,0,0,1,0,0|3,0,0]=4 313 B13R2.599 COc1cc2cc[nH]c2cc1Br 1P008Y79 [0,0,0,1,0,0|2,0,1]=4 314 B13R2.599 COc1cc2cc[nH]c2cc1C 1P00CB86 [0,0,0,1,0,0|2,0,1]=4 315 B13R2.599 COc1cc2cc[nH]c2cc1Cl 1P00EGC1 [0,0,0,1,0,0|2,0,1]=4 316 B13R2.599 COc1cc2cc[nH]c2cc1F 1P00EGC2 [0,0,0,1,0,0|2,0,1]=4 317 B13R2.599 COc1cc2cn[nH]c2cc1O 1P000JNR [0,0,0,1,0,0|2,0,1]=4 318 B13R2.599 COc1cc2nc[nH]c2cc1Br 1P0003GD [0,0,0,1,0,0|3,0,0]=4 319 B13R2.599 COc1cc2nccn2cc1Br 1P00HX29 [0,0,0,1,0,0|3,0,0]=4 320 B13R2.599 COc1cc2scnc2cc1N 1P028ADM [0,0,0,1,0,0|3,0,0]=4 321 B13R2.599 COc1cn2nccc2cc1Br 1P027VCB [0,0,0,1,0,0|3,0,0]=4 322 B13R2.599 COc1cn2nccc2nc1O 1P028DIR [0,0,0,1,0,0|3,0,0]=4 323 B13R2.599 COc1nc2[nH]ccc2cc1Br 1P000IGJ [0,0,0,1,0,0|3,0,0]=4 324 B13R2.599 COc1nc2[nH]ccc2cc1Cl 1P000I3I [0,0,0,1,0,0|3,0,0]=4 325 B13R2.2461 COc1cc(ccc1Br)C2CC2 1P01DWD8 [0,0,0,1,0,0|1,0,2]=4 326 B13R2.2461 COc1cc(ccc1N)C2CC2 1P01KYDG [0,0,0,1,0,0|1,0,2]=4 327 B10R1.10 BrCCc1cccc(c1)C 1P001Y74 [2,0,0,0,0,0|1,0,1]=4 328 B10R1.10 C=CCc1cccc(c1)Br 1P0024GG [2,0,0,0,0,0|1,0,0]=3 329 B10R1.10 C=CCc1cccc(c1)C 1P003EDX [2,0,0,0,0,0|0,0,0]=2 330 B10R1.10 C=CCc1cccc(c1)F 1P0032AM [2,0,0,0,0,0|1,0,0]=3 331 B10R1.10 C=CCc1cccc(c1)O 1P001KAF [2,0,0,0,0,0|0,0,0]=2 332 B10R1.10 C=COc1cccc(c1)C 1P0002M9 [2,0,0,0,0,0|1,0,0]=3 333 B10R1.10 CCCc1cccc(c1)O 1P003KAZ [2,0,0,0,0,0|0,0,2]=4 334 B10R1.10 CNCc1cccc(c1)C 1P003K89 [2,0,0,0,0,0|1,0,1]=4 335 B10R1.10 CNCc1cccc(c1)C 1P028EM9 [2,0,0,0,0,0|1,0,1]=4 336 B10R1.10 CNCc1cccc(c1)O 1P000LPH [2,0,0,0,0,0|1,0,1]=4 337 B10R1.10 COCc1cccc(c1)C 1P01H9A5 [2,0,0,0,0,0|1,0,1]=4 338 B10R1.10 COCc1cccc(c1)O 1P00IANX [2,0,0,0,0,0|1,0,1]=4 339 B10R1.10 ClCCc1cccc(c1)C 1P00CS1D [2,0,0,0,0,0|1,0,1]=4 340 B10R1.10 N#CCc1cccc(c1)C 1P002YYS [2,0,0,0,0,0|1,0,1]=4 341 B10R1.10 N#CCc1cccc(c1)O 1P0038M2 [2,0,0,0,0,0|1,0,1]=4 342 B10R1.10 NCCc1cccc(c1)C 1P00DEU2 [2,0,0,0,0,0|1,0,1]=4 343 B10R1.10 NCCc1cccc(c1)C 1P00DGLD [2,0,0,0,0,0|1,0,1]=4 344 B10R1.10 NCCc1cccc(c1)O 1P003K1G [2,0,0,0,0,0|1,0,1]=4 345 B10R1.10 NCCc1cccc(c1)O 1P00C9GZ [2,0,0,0,0,0|1,0,1]=4 346 B10R1.10 NCCc1cccc(c1)O 1P00EA8W [2,0,0,0,0,0|1,0,1]=4 347 B10R1.10 NNCc1cccc(c1)C 1P00J1XM [2,0,0,0,0,0|2,0,0]=4 348 B10R1.10 NNCc1cccc(c1)C 1P028PB6 [2,0,0,0,0,0|2,0,0]=4 349 B10R1.10 NNCc1cccc(c1)O 1P003K10 [2,0,0,0,0,0|2,0,0]=4 350 B10R1.10 O=CCc1cccc(c1)Br 1P008SJJ [2,0,0,0,0,0|2,0,0]=4 351 B10R1.10 O=CCc1cccc(c1)C 1P005ZAB [2,0,0,0,0,0|1,0,0]=3 352 B10R1.10 O=CCc1cccc(c1)Cl 1P00BZE9 [2,0,0,0,0,0|2,0,0]=4 353 B10R1.10 O=CCc1cccc(c1)F 1P00G36B [2,0,0,0,0,0|2,0,0]=4 354 B10R1.10 O=CNc1cccc(c1)O 1P002Q8J [2,0,0,0,0,0|2,0,0]=4 355 B10R1.10 OCCc1cccc(c1)C 1P0075A6 [2,0,0,0,0,0|1,0,1]=4 356 B10R1.10 OCCc1cccc(c1)O 1P0071LP [2,0,0,0,0,0|1,0,1]=4 357 B10R1.10 SCCc1cccc(c1)C 1P01FFL5 [2,0,0,0,0,0|1,0,1]=4 358 B10R1.172 BrCc1cccc(c1)OC 1P003K42 [2,0,0,0,0,0|1,0,0]=3 359 B10R1.172 BrCc1cccc(c1)SC 1P01B38M [2,0,0,0,0,0|1,1,0]=4 360 B10R1.172 BrCc1cccc(n1)OC 1P001OYU [2,0,0,0,0,0|2,0,0]=4 361 B10R1.172 BrCc1cncc(c1)OC 1P028L61 [2,0,0,0,0,0|2,0,0]=4 362 B10R1.172 C=Cc1cccc(c1)C#N 1P019STI [2,0,0,0,0,0|2,0,0]=4 363 B10R1.172 C=Cc1cccc(c1)C=C 1P008TDY [2,0,0,0,0,0|1,0,1]=4 364 B10R1.172 C=Cc1cccc(c1)C=O 1P002CN6 [2,0,0,0,0,0|2,0,0]=4 365 B10R1.172 CCc1cccc(c1)C=C 1P005N8X [2,0,0,0,0,0|1,0,0]=3 366 B10R1.172 CCc1cccc(c1)C=O 1P00399O [2,0,0,0,0,0|2,0,0]=4 367 B10R1.172 CCc1cccc(c1)CBr 1P01B28K [2,0,0,0,0,0|2,0,0]=4 368 B10R1.172 CCc1cccc(c1)CN 1P01C5SC [2,0,0,0,0,0|2,0,0]=4 369 B10R1.172 CCc1cccc(c1)CO 1P00GPWE [2,0,0,0,0,0|2,0,0]=4 370 B10R1.172 CCc1cccc(c1)NC 1P01C2IG [2,0,0,0,0,0|1,0,1]=4 371 B10R1.172 CCc1cccc(c1)OC 1P009OIF [2,0,0,0,0,0|0,0,1]=3 372 B10R1.172 CNc1cccc(c1)C=O 1P00CIOA [2,0,0,0,0,0|2,0,0]=4 373 B10R1.172 CNc1cccc(c1)OC 1P003K4E [2,0,0,0,0,0|1,0,1]=4 374 B10R1.172 CNc1cccc(c1)OC 1P00BIXX [2,0,0,0,0,0|1,0,1]=4 375 B10R1.172 COc1cccc(c1)C#C 1P003JVG [2,0,0,0,0,0|0,0,2]=4 376 B10R1.172 COc1cccc(c1)C#N 1P003K3Z [2,0,0,0,0,0|1,0,1]=4 377 B10R1.172 COc1cccc(c1)C=C 1P003KDW [2,0,0,0,0,0|0,0,0]=2 378 B10R1.172 COc1cccc(c1)C=O 1P00347J [2,0,0,0,0,0|1,0,0]=3 379 B10R1.172 COc1cccc(c1)OC 1P001NGR [2,0,0,0,0,0|1,0,1]=4 380 B10R1.172 COc1cccc(c1)SC 1P003K4T [2,0,0,0,0,0|1,0,1]=4 381 B10R1.172 COc1cccc(c1)[N+]#[C-] 1P002AXC [2,0,0,0,0,0|1,0,1]=4 382 B10R1.172 COc1cccc(n1)C=O 1P003NQN [2,0,0,0,0,0|2,0,0]=4 383 B10R1.172 COc1ccnc(c1)C=C 1P00310W [2,0,0,0,0,0|1,0,0]=3 384 B10R1.172 COc1ccnc(c1)C=O 1P001XUY [2,0,0,0,0,0|2,0,0]=4 385 B10R1.172 COc1ccnc(c1)CBr 1P028FYA [2,0,0,0,0,0|2,0,0]=4 386 B10R1.172 COc1ccnc(c1)CCl 1P00ELEQ [2,0,0,0,0,0|2,0,0]=4 387 B10R1.172 COc1ccnc(c1)CN 1P007517 [2,0,0,0,0,0|2,0,0]=4 388 B10R1.172 COc1ccnc(c1)CN 1P009DUI [2,0,0,0,0,0|2,0,0]=4 389 B10R1.172 COc1ccnc(c1)CO 1P001XBR [2,0,0,0,0,0|2,0,0]=4 390 B10R1.172 COc1cncc(c1)C=C 1P01AMQZ [2,0,0,0,0,0|1,0,0]=3 391 B10R1.172 COc1cncc(c1)C=O 1P003NAT [2,0,0,0,0,0|2,0,0]=4 392 B10R1.172 COc1nccc(c1)C=O 1P005FZ0 [2,0,0,0,0,0|2,0,0]=4 393 B10R1.172 COc1nccc(c1)CBr 1P0081MW [2,0,0,0,0,0|2,0,0]=4 394 B10R1.172 COc1nccc(c1)CBr 1P01XD38 [2,0,0,0,0,0|2,0,0]=4 395 B10R1.172 COc1nccc(c1)CCl 1P007RI9 [2,0,0,0,0,0|2,0,0]=4 396 B10R1.172 COc1nccc(c1)CCl 1P00C7BJ [2,0,0,0,0,0|2,0,0]=4 397 B10R1.172 COc1nccc(c1)CN 1P001LQN [2,0,0,0,0,0|2,0,0]=4 398 B10R1.172 COc1nccc(c1)CN 1P008V8P [2,0,0,0,0,0|2,0,0]=4 399 B10R1.172 COc1nccc(c1)CO 1P000KIY [2,0,0,0,0,0|2,0,0]=4 400 B10R1.172 CSc1cccc(c1)C=O 1P005Y1X [2,0,0,0,0,0|1,1,0]=4 401 B10R1.172 ClCc1cccc(c1)OC 1P003K43 [2,0,0,0,0,0|1,0,0]=3 402 B10R1.172 ClCc1cccc(n1)OC 1P004O2C [2,0,0,0,0,0|2,0,0]=4 403 B10R1.172 ClCc1cccc(n1)OC 1P00CM0R [2,0,0,0,0,0|2,0,0]=4 404 B10R1.172 ClCc1cncc(c1)OC 1P01BC6T [2,0,0,0,0,0|2,0,0]=4 405 B10R1.172 NCc1cccc(c1)NC 1P00G515 [2,0,0,0,0,0|2,0,0]=4 406 B10R1.172 NCc1cccc(c1)OC 1P00395P [2,0,0,0,0,0|1,0,0]=3 407 B10R1.172 NCc1cccc(c1)SC 1P0066JI [2,0,0,0,0,0|1,1,0]=4 408 B10R1.172 NCc1cccc(c1)SC 1P00J1G6 [2,0,0,0,0,0|1,1,0]=4 409 B10R1.172 NCc1cccc(n1)OC 1P00APL6 [2,0,0,0,0,0|2,0,0]=4 410 B10R1.172 NCc1cccc(n1)OC 1P00H7RJ [2,0,0,0,0,0|2,0,0]=4 411 B10R1.172 NCc1cccc(n1)OC 1P01DUNJ [2,0,0,0,0,0|2,0,0]=4 412 B10R1.172 NCc1cncc(c1)OC 1P008UBN [2,0,0,0,0,0|2,0,0]=4 413 B10R1.172 NCc1cncc(c1)OC 1P01C5OX [2,0,0,0,0,0|2,0,0]=4 414 B10R1.172 NCc1cncc(c1)OC 1P027XGG [2,0,0,0,0,0|2,0,0]=4 415 B10R1.172 NNc1cccc(c1)OC 1P003K4M [2,0,0,0,0,0|2,0,0]=4 416 B10R1.172 NNc1cccc(c1)OC 1P01BE5F [2,0,0,0,0,0|2,0,0]=4 417 B10R1.172 OCc1cccc(c1)NC 1P00HGR2 [2,0,0,0,0,0|2,0,0]=4 418 B10R1.172 OCc1cccc(c1)NC 1P01A3B1 [2,0,0,0,0,0|2,0,0]=4 419 B10R1.172 OCc1cccc(c1)OC 1P003K41 [2,0,0,0,0,0|1,0,0]=3 420 B10R1.172 OCc1cccc(c1)SC 1P00F2J4 [2,0,0,0,0,0|1,1,0]=4 421 B10R1.172 OCc1cccc(n1)OC 1P00EAGU [2,0,0,0,0,0|2,0,0]=4 422 B10R1.172 OCc1cncc(c1)OC 1P00GXMJ [2,0,0,0,0,0|2,0,0]=4 423 B10R1.172 SCc1cccc(c1)OC 1P006416 [2,0,0,0,0,0|1,0,0]=3 424 B10R1.1 BrCCc1ccc(cc1)O 1P003M0B [2,0,0,0,0,0|1,0,1]=4 425 B10R1.1 C#CCc1ccc(cc1)O 1P01XIKJ [2,0,0,0,0,0|0,0,2]=4 426 B10R1.1 C=CCc1ccc(cc1)C 1P003L3X [2,0,0,0,0,0|1,0,0]=3 427 B10R1.1 C=CCc1ccc(cc1)Cl 1P00206A [2,0,0,0,0,0|1,0,0]=3 428 B10R1.1 C=CCc1ccc(cc1)F 1P001ZL7 [2,0,0,0,0,0|1,0,0]=3 429 B10R1.1 C=CCc1ccc(cc1)O 1P00395J [2,0,0,0,0,0|0,0,0]=2 430 B10R1.1 C=COc1ccc(cc1)Br 1P0091XP [2,0,0,0,0,0|2,0,0]=4 431 B10R1.1 CCCc1ccc(cc1)O 1P003MGY [2,0,0,0,0,0|0,0,2]=4 432 B10R1.1 CNCc1ccc(cc1)O 1P003L1D [2,0,0,0,0,0|1,0,1]=4 433 B10R1.1 CNCc1ccc(cc1)O 1P0092KQ [2,0,0,0,0,0|1,0,1]=4 434 B10R1.1 CNCc1ccc(cc1)O 1P01EAKR [2,0,0,0,0,0|1,0,1]=4 435 B10R1.1 COCc1ccc(cc1)O 1P00DG3W [2,0,0,0,0,0|1,0,1]=4 436 B10R1.1 C\C=C\c1ccc(cc1)O 1P0286KE [2,0,0,0,0,0|0,0,2]=4 437 B10R1.1 FCCc1ccc(cc1)O 1P01DHVV [2,0,0,0,0,0|1,0,1]=4 438 B10R1.1 N#CCc1ccc(cc1)O 1P001HTW [2,0,0,0,0,0|1,0,1]=4 439 B10R1.1 NCCc1ccc(cc1)O 1P003FD7 [2,0,0,0,0,0|1,0,1]=4 440 B10R1.1 NCCc1ccc(cc1)O 1P00IB3O [2,0,0,0,0,0|1,0,1]=4 441 B10R1.1 NNCc1ccc(cc1)O 1P028XZA [2,0,0,0,0,0|2,0,0]=4 442 B10R1.1 O=CCc1ccc(cc1)Br 1P00BCHQ [2,0,0,0,0,0|2,0,0]=4 443 B10R1.1 O=CCc1ccc(cc1)C 1P0085DU [2,0,0,0,0,0|2,0,0]=4 444 B10R1.1 O=CCc1ccc(cc1)Cl 1P00BXZ5 [2,0,0,0,0,0|2,0,0]=4 445 B10R1.1 O=CCc1ccc(cc1)F 1P001ZIV [2,0,0,0,0,0|2,0,0]=4 446 B10R1.1 O=CNc1ccc(cc1)O 1P007B39 [2,0,0,0,0,0|2,0,0]=4 447 B10R1.1 OCCc1ccc(cc1)O 1P0034J3 [2,0,0,0,0,0|1,0,1]=4 448 B10R1.176 BrCc1ccc(c(c1)C)Br 1P002UJR [2,0,0,0,0,0|2,0,0]=4 449 B10R1.176 BrCc1ccc(c(c1)C)C 1P0036AO [2,0,0,0,0,0|2,0,0]=4 450 B10R1.176 BrCc1ccc(c(c1)C)Cl 1P01ANA6 [2,0,0,0,0,0|2,0,0]=4 451 B10R1.176 BrCc1ccc(c(c1)C)F 1P002SNF [2,0,0,0,0,0|2,0,0]=4 452 B10R1.176 C(=C)C1=CC(=C(C=C1)O)I 1P01FWKM [2,0,0,0,0,0|1,0,0]=3 453 B10R1.176 C=Cc1ccc(c(c1)C)C 1P002VCY [2,0,0,0,0,0|1,0,0]=3 454 B10R1.176 C=Cc1ccc(c(c1)Cl)Cl 1P0029MW [2,0,0,0,0,0|2,0,0]=4 455 B10R1.176 C=Cc1ccc(c(c1)Cl)F 1P01BI15 [2,0,0,0,0,0|2,0,0]=4 456 B10R1.176 C=Cc1ccc(c(c1)F)Cl 1P000T4X [2,0,0,0,0,0|2,0,0]=4 457 B10R1.176 C=Cc1ccc(c(c1)F)F 1P00C1IO [2,0,0,0,0,0|2,0,0]=4 458 B10R1.176 C=Cc1ccc(c(c1)O)O 1P00EEZ7 [2,0,0,0,0,0|0,0,0]=2 459 B10R1.176 CCc1ccc(c(c1)Br)O 1P0037F4 [2,0,0,0,0,0|1,0,1]=4 460 B10R1.176 CCc1ccc(c(c1)C)Br 1P01BZC2 [2,0,0,0,0,0|1,0,1]=4 461 B10R1.176 CCc1ccc(c(c1)C)C 1P006FV1 [2,0,0,0,0,0|1,0,1]=4 462 B10R1.176 CCc1ccc(c(c1)C)I 1P00IENC [2,0,0,0,0,0|1,0,1]=4 463 B10R1.176 CCc1ccc(c(c1)C)N 1P005QEI [2,0,0,0,0,0|1,0,1]=4 464 B10R1.176 CCc1ccc(c(c1)C)O 1P00BRH9 [2,0,0,0,0,0|0,0,1]=3 465 B10R1.176 CCc1ccc(c(c1)N)O 1P005V9C [2,0,0,0,0,0|1,0,1]=4 466 B10R1.176 CCc1ccc(c(c1)N)O 1P019TR4 [2,0,0,0,0,0|1,0,1]=4 467 B10R1.176 CCc1ccc(c(c1)O)N 1P001MJ1 [2,0,0,0,0,0|1,0,1]=4 468 B10R1.176 CCc1ccc(c(c1)O)N 1P0024E3 [2,0,0,0,0,0|1,0,1]=4 469 B10R1.176 CCc1ccc(c(c1)O)O 1P003LSP [2,0,0,0,0,0|0,0,1]=3 470 B10R1.176 CNc1ccc(c(c1)C)O 1P00E3NE [2,0,0,0,0,0|1,0,1]=4 471 B10R1.176 COc1ccc(c(c1)C)O 1P00DIBB [2,0,0,0,0,0|1,0,1]=4 472 B10R1.176 COc1ccc(c(c1)O)O 1P00CKFC [2,0,0,0,0,0|1,0,1]=4 473 B10R1.176 CSc1ccc(c(c1)C)O 1P00D0DY [2,0,0,0,0,0|1,0,1]=4 474 B10R1.176 ClCc1ccc(c(c1)C)Br 1P001LUM [2,0,0,0,0,0|2,0,0]=4 475 B10R1.176 ClCc1ccc(c(c1)C)C 1P0006PD [2,0,0,0,0,0|2,0,0]=4 476 B10R1.176 ClCc1ccc(c(c1)C)Cl 1P00IHJD [2,0,0,0,0,0|2,0,0]=4 477 B10R1.176 ClCc1ccc(c(c1)C)F 1P01BA2C [2,0,0,0,0,0|2,0,0]=4 478 B10R1.176 ClCc1ccc(c(c1)O)F 1P01JWHO [2,0,0,0,0,0|2,0,0]=4 479 B10R1.176 N#Cc1ccc(c(c1)C)O 1P001Q62 [2,0,0,0,0,0|1,0,1]=4 480 B10R1.176 N#Cc1ccc(c(c1)O)O 1P001ZEF [2,0,0,0,0,0|1,0,1]=4 481 B10R1.176 NCc1ccc(c(c1)Br)O 1P01A1H5 [2,0,0,0,0,0|2,0,0]=4 482 B10R1.176 NCc1ccc(c(c1)C)Br 1P001LUN [2,0,0,0,0,0|2,0,0]=4 483 B10R1.176 NCc1ccc(c(c1)C)Br 1P01C302 [2,0,0,0,0,0|2,0,0]=4 484 B10R1.176 NCc1ccc(c(c1)C)C 1P0006PB [2,0,0,0,0,0|2,0,0]=4 485 B10R1.176 NCc1ccc(c(c1)C)C 1P019F5W [2,0,0,0,0,0|2,0,0]=4 486 B10R1.176 NCc1ccc(c(c1)C)Cl 1P009ECV [2,0,0,0,0,0|2,0,0]=4 487 B10R1.176 NCc1ccc(c(c1)C)F 1P002SNH [2,0,0,0,0,0|2,0,0]=4 488 B10R1.176 NCc1ccc(c(c1)C)I 1P01BHRL [2,0,0,0,0,0|2,0,0]=4 489 B10R1.176 NCc1ccc(c(c1)C)N 1P01BO3P [2,0,0,0,0,0|2,0,0]=4 490 B10R1.176 NCc1ccc(c(c1)C)O 1P01FIBN [2,0,0,0,0,0|1,0,0]=3 491 B10R1.176 NCc1ccc(c(c1)C)O 1P01JV5G [2,0,0,0,0,0|1,0,0]=3 492 B10R1.176 NCc1ccc(c(c1)F)O 1P01AKEK [2,0,0,0,0,0|2,0,0]=4 493 B10R1.176 NCc1ccc(c(c1)O)C 1P028GD0 [2,0,0,0,0,0|2,0,0]=4 494 B10R1.176 NCc1ccc(c(c1)O)Cl 1P003ALV [2,0,0,0,0,0|2,0,0]=4 495 B10R1.176 NCc1ccc(c(c1)O)Cl 1P01EDXN [2,0,0,0,0,0|2,0,0]=4 496 B10R1.176 NCc1ccc(c(c1)O)F 1P01KLQP [2,0,0,0,0,0|2,0,0]=4 497 B10R1.176 NCc1ccc(c(c1)O)O 1P003IYE [2,0,0,0,0,0|1,0,0]=3 498 B10R1.176 NCc1ccc(c(c1)O)O 1P0098TQ [2,0,0,0,0,0|1,0,0]=3 499 B10R1.176 O=Cc1ccc(c(c1)Br)O 1P002ZPH [2,0,0,0,0,0|2,0,0]=4 500 B10R1.176 O=Cc1ccc(c(c1)C)Br 1P0036Y6 [2,0,0,0,0,0|2,0,0]=4 501 B10R1.176 O=Cc1ccc(c(c1)C)C 1P003IZ7 [2,0,0,0,0,0|2,0,0]=4 502 B10R1.176 O=Cc1ccc(c(c1)C)Cl 1P0004QJ [2,0,0,0,0,0|2,0,0]=4 503 B10R1.176 O=Cc1ccc(c(c1)C)F 1P008022 [2,0,0,0,0,0|2,0,0]=4 504 B10R1.176 O=Cc1ccc(c(c1)C)I 1P0093FU [2,0,0,0,0,0|2,0,0]=4 505 B10R1.176 O=Cc1ccc(c(c1)C)O 1P003LYR [2,0,0,0,0,0|1,0,0]=3 506 B10R1.176 O=Cc1ccc(c(c1)Cl)O 1P003JOV [2,0,0,0,0,0|2,0,0]=4 507 B10R1.176 O=Cc1ccc(c(c1)F)O 1P003JWJ [2,0,0,0,0,0|2,0,0]=4 508 B10R1.176 O=Cc1ccc(c(c1)I)O 1P00EARQ [2,0,0,0,0,0|2,0,0]=4 509 B10R1.176 O=Cc1ccc(c(c1)O)Br 1P002D64 [2,0,0,0,0,0|2,0,0]=4 510 B10R1.176 O=Cc1ccc(c(c1)O)C 1P0037N3 [2,0,0,0,0,0|2,0,0]=4 511 B10R1.176 O=Cc1ccc(c(c1)O)Cl 1P00EITE [2,0,0,0,0,0|2,0,0]=4 512 B10R1.176 O=Cc1ccc(c(c1)O)F 1P007H5L [2,0,0,0,0,0|2,0,0]=4 513 B10R1.176 O=Cc1ccc(c(c1)O)I 1P006ZQX [2,0,0,0,0,0|2,0,0]=4 514 B10R1.176 O=Cc1ccc(c(c1)O)O 1P0033ZA [2,0,0,0,0,0|1,0,0]=3 515 B10R1.176 O=Cc1ccc(c(n1)O)O 1P028F42 [2,0,0,0,0,0|2,0,0]=4 516 B10R1.176 O=Cc1cnc(c(c1)C)O 1P009YL6 [2,0,0,0,0,0|2,0,0]=4 517 B10R1.176 OCc1ccc(c(c1)Br)O 1P00BDJM [2,0,0,0,0,0|2,0,0]=4 518 B10R1.176 OCc1ccc(c(c1)C)Br 1P001LUP [2,0,0,0,0,0|2,0,0]=4 519 B10R1.176 OCc1ccc(c(c1)C)C 1P003IZB [2,0,0,0,0,0|2,0,0]=4 520 B10R1.176 OCc1ccc(c(c1)C)Cl 1P000WB6 [2,0,0,0,0,0|2,0,0]=4 521 B10R1.176 OCc1ccc(c(c1)C)F 1P002SM5 [2,0,0,0,0,0|2,0,0]=4 522 B10R1.176 OCc1ccc(c(c1)C)I 1P01RUUK [2,0,0,0,0,0|2,0,0]=4 523 B10R1.176 OCc1ccc(c(c1)C)N 1P0046NV [2,0,0,0,0,0|2,0,0]=4 524 B10R1.176 OCc1ccc(c(c1)C)O 1P0024RZ [2,0,0,0,0,0|1,0,0]=3 525 B10R1.176 OCc1ccc(c(c1)Cl)O 1P00962Y [2,0,0,0,0,0|2,0,0]=4 526 B10R1.176 OCc1ccc(c(c1)F)O 1P01AJX5 [2,0,0,0,0,0|2,0,0]=4 527 B10R1.176 OCc1ccc(c(c1)N)O 1P00DNOE [2,0,0,0,0,0|2,0,0]=4 528 B10R1.176 OCc1ccc(c(c1)O)Br 1P00BGJP [2,0,0,0,0,0|2,0,0]=4 529 B10R1.176 OCc1ccc(c(c1)O)Cl 1P000SC9 [2,0,0,0,0,0|2,0,0]=4 530 B10R1.176 OCc1ccc(c(c1)O)F 1P00II2L [2,0,0,0,0,0|2,0,0]=4 531 B10R1.176 OCc1ccc(c(c1)O)I 1P005C1F [2,0,0,0,0,0|2,0,0]=4 532 B10R1.176 OCc1ccc(c(c1)O)N 1P000EZG [2,0,0,0,0,0|2,0,0]=4 533 B10R1.176 OCc1ccc(c(c1)O)O 1P003IYD [2,0,0,0,0,0|1,0,0]=3 534 B10R1.176 OCc1ccc(c(n1)C)O 1P00DLQN [2,0,0,0,0,0|2,0,0]=4 535 B10R1.176 SCc1ccc(c(c1)C)C 1P01A04U [2,0,0,0,0,0|2,0,0]=4 536 B10R1.30 CCc1cc(Br)ccc1O 1P002EFG [2,0,0,0,0,0|2,0,0]=4 537 B10R1.30 CCc1cc(C)ccc1O 1P00CV2C [2,0,0,0,0,0|1,0,0]=3 538 B10R1.30 CCc1cc(F)ccc1O 1P00C72H [2,0,0,0,0,0|2,0,0]=4 539 B10R1.30 CCc1cc(O)ccc1O 1P002NUU [2,0,0,0,0,0|2,0,0]=4 540 B10R1.30 CCc1nc(C)ccc1O 1P000XJS [2,0,0,0,0,0|2,0,0]=4 541 B10R1.30 CCc1nc(C)ccc1O 1P0011CF [2,0,0,0,0,0|2,0,0]=4 542 B10R1.30 CCc1nc(C)ccc1O 1P002OGM [2,0,0,0,0,0|2,0,0]=4 543 B10R1.30 CNc1cc(C)ccc1Br 1P028YLU [2,0,0,0,0,0|2,0,0]=4 544 B10R1.30 CNc1cc(C)ccc1C 1P019WOA [2,0,0,0,0,0|2,0,0]=4 545 B10R1.30 CNc1cc(C)ccc1C 1P01A7UM [2,0,0,0,0,0|2,0,0]=4 546 B10R1.30 CNc1cc(C)ccc1N 1P000VT5 [2,0,0,0,0,0|2,0,0]=4 547 B10R1.30 CNc1cc(O)ccc1O 1P007HJ6 [2,0,0,0,0,0|2,0,0]=4 548 B10R1.30 COC1=CC(=O)C=CC1=O 1P002X1K [2,0,0,0,0,0|1,0,1]=4 549 B10R1.30 COc1cc(Br)ccc1Br 1P00IK5L [2,0,0,0,0,0|2,0,0]=4 550 B10R1.30 COc1cc(Br)ccc1C 1P003LDS [2,0,0,0,0,0|2,0,0]=4 551 B10R1.30 COc1cc(Br)ccc1Cl 1P001YDB [2,0,0,0,0,0|2,0,0]=4 552 B10R1.30 COc1cc(Br)ccc1F 1P003HQO [2,0,0,0,0,0|2,0,0]=4 553 B10R1.30 COc1cc(Br)ccc1I 1P008N6U [2,0,0,0,0,0|2,0,0]=4 554 B10R1.30 COc1cc(Br)ccc1N 1P00EAYY [2,0,0,0,0,0|2,0,0]=4 555 B10R1.30 COc1cc(Br)ccc1O 1P003LDR [2,0,0,0,0,0|1,0,0]=3 556 B10R1.30 COc1cc(C)ccc1Br 1P00IJW1 [2,0,0,0,0,0|1,0,0]=3 557 B10R1.30 COc1cc(C)ccc1C 1P003BM5 [2,0,0,0,0,0|1,0,0]=3 558 B10R1.30 COc1cc(C)ccc1Cl 1P008Q5B [2,0,0,0,0,0|1,0,0]=3 559 B10R1.30 COc1cc(C)ccc1F 1P003BOT [2,0,0,0,0,0|1,0,0]=3 560 B10R1.30 COc1cc(C)ccc1I 1P007624 [2,0,0,0,0,0|1,0,0]=3 561 B10R1.30 COc1cc(C)ccc1N 1P003HZJ [2,0,0,0,0,0|1,0,0]=3 562 B10R1.30 COc1cc(C)ccc1N 1P00FC0J [2,0,0,0,0,0|1,0,0]=3 563 B10R1.30 COc1cc(C)ccc1O 1P00IHWN [2,0,0,0,0,0|0,0,0]=2 564 B10R1.30 COc1cc(C)cnc1Cl 1P0094NJ [2,0,0,0,0,0|2,0,0]=4 565 B10R1.30 COc1cc(C)ncc1Br 1P00GSM7 [2,0,0,0,0,0|2,0,0]=4 566 B10R1.30 COc1cc(Cl)ccc1Br 1P0020IO [2,0,0,0,0,0|2,0,0]=4 567 B10R1.30 COc1cc(Cl)ccc1C 1P0075OZ [2,0,0,0,0,0|2,0,0]=4 568 B10R1.30 COc1cc(Cl)ccc1Cl 1P002BYK [2,0,0,0,0,0|2,0,0]=4 569 B10R1.30 COc1cc(Cl)ccc1F 1P00HBSW [2,0,0,0,0,0|2,0,0]=4 570 B10R1.30 COc1cc(Cl)ccc1I 1P00G3UM [2,0,0,0,0,0|2,0,0]=4 571 B10R1.30 COc1cc(Cl)ccc1N 1P0036U3 [2,0,0,0,0,0|2,0,0]=4 572 B10R1.30 COc1cc(Cl)ccc1N 1P00IHWM [2,0,0,0,0,0|2,0,0]=4 573 B10R1.30 COc1cc(Cl)ccc1O 1P003LKA [2,0,0,0,0,0|1,0,0]=3 574 B10R1.30 COc1cc(F)ccc1Br 1P003H69 [2,0,0,0,0,0|2,0,0]=4 575 B10R1.30 COc1cc(F)ccc1C 1P003N7Q [2,0,0,0,0,0|2,0,0]=4 576 B10R1.30 COc1cc(F)ccc1Cl 1P003HF8 [2,0,0,0,0,0|2,0,0]=4 577 B10R1.30 COc1cc(F)ccc1F 1P003GEX [2,0,0,0,0,0|2,0,0]=4 578 B10R1.30 COc1cc(F)ccc1I 1P01DNZZ [2,0,0,0,0,0|2,0,0]=4 579 B10R1.30 COc1cc(F)ccc1N 1P0026P4 [2,0,0,0,0,0|2,0,0]=4 580 B10R1.30 COc1cc(F)ccc1N 1P003HZI [2,0,0,0,0,0|2,0,0]=4 581 B10R1.30 COc1cc(F)ccc1O 1P003LTV [2,0,0,0,0,0|1,0,0]=3 582 B10R1.30 COc1cc(I)ccc1Br 1P005XNR [2,0,0,0,0,0|2,0,0]=4 583 B10R1.30 COc1cc(I)ccc1C 1P00BGQZ [2,0,0,0,0,0|2,0,0]=4 584 B10R1.30 COc1cc(I)ccc1Cl 1P001SZX [2,0,0,0,0,0|2,0,0]=4 585 B10R1.30 COc1cc(I)ccc1F 1P008NKH [2,0,0,0,0,0|2,0,0]=4 586 B10R1.30 COc1cc(I)ccc1N 1P00C0WR [2,0,0,0,0,0|2,0,0]=4 587 B10R1.30 COc1cc(I)ccc1N 1P01ANQM [2,0,0,0,0,0|2,0,0]=4 588 B10R1.30 COc1cc(I)ccc1O 1P0029MI [2,0,0,0,0,0|1,0,0]=3 589 B10R1.30 COc1cc(N)ccc1Br 1P002F3Y [2,0,0,0,0,0|2,0,0]=4 590 B10R1.30 COc1cc(N)ccc1C 1P007VW3 [2,0,0,0,0,0|2,0,0]=4 591 B10R1.30 COc1cc(N)ccc1Cl 1P0013HF [2,0,0,0,0,0|2,0,0]=4 592 B10R1.30 COc1cc(N)ccc1F 1P006Y6H [2,0,0,0,0,0|2,0,0]=4 593 B10R1.30 COc1cc(N)ccc1F 1P00IBTX [2,0,0,0,0,0|2,0,0]=4 594 B10R1.30 COc1cc(N)ccc1I 1P00972U [2,0,0,0,0,0|2,0,0]=4 595 B10R1.30 COc1cc(N)ccc1N 1P0033GL [2,0,0,0,0,0|2,0,0]=4 596 B10R1.30 COc1cc(N)ccc1N 1P003B3R [2,0,0,0,0,0|2,0,0]=4 597 B10R1.30 COc1cc(N)ccc1O 1P003887 [2,0,0,0,0,0|1,0,0]=3 598 B10R1.30 COc1cc(N)ccc1O 1P00DFCA [2,0,0,0,0,0|1,0,0]=3 599 B10R1.30 COc1cc(O)ccc1Br 1P000763 [2,0,0,0,0,0|2,0,0]=4 600 B10R1.30 COc1cc(O)ccc1C 1P002G67 [2,0,0,0,0,0|2,0,0]=4 601 B10R1.30 COc1cc(O)ccc1Cl 1P00235Z [2,0,0,0,0,0|2,0,0]=4 602 B10R1.30 COc1cc(O)ccc1F 1P0034IK [2,0,0,0,0,0|2,0,0]=4 603 B10R1.30 COc1cc(O)ccc1N 1P003L6C [2,0,0,0,0,0|2,0,0]=4 604 B10R1.30 COc1cc(O)ccc1N 1P003L6D [2,0,0,0,0,0|2,0,0]=4 605 B10R1.30 COc1cc(O)ccc1O 1P003BPJ [2,0,0,0,0,0|1,0,0]=3 606 B10R1.30 COc1nc(Br)ccc1O 1P00I1PG [2,0,0,0,0,0|2,0,0]=4 607 B10R1.30 COc1nc(C)ccc1Br 1P003JHC [2,0,0,0,0,0|2,0,0]=4 608 B10R1.30 COc1nc(C)ccc1F 1P0079YX [2,0,0,0,0,0|2,0,0]=4 609 B10R1.30 COc1nc(C)ccc1N 1P00I29Q [2,0,0,0,0,0|2,0,0]=4 610 B10R1.30 COc1nc(C)ccc1O 1P00CHN8 [2,0,0,0,0,0|1,0,0]=3 611 B10R1.30 CSc1cc(Br)ccc1O 1P0291UR [2,0,0,0,0,0|1,1,0]=4 612 B10R1.30 CSc1cc(F)ccc1O 1P01JFRT [2,0,0,0,0,0|1,1,0]=4 613 B10R1.30 N#Cc1cc(C)ccc1O 1P00DLHV [2,0,0,0,0,0|2,0,0]=4 614 B10R1.30 NCc1cc(C)ccc1O 1P01BVD4 [2,0,0,0,0,0|2,0,0]=4 615 B10R1.30 O=Cc1cc(C)ccc1O 1P003ND7 [2,0,0,0,0,0|2,0,0]=4 616 B10R1.30 OCc1cc(C)ccc1O 1P0039V2 [2,0,0,0,0,0|2,0,0]=4 617 B12R1.41 BrCCc1cc(OC)cc(c1)Cl 1P02828R [1,1,0,0,0,0|1,0,1]=4 618 B12R1.41 CNCc1cc(OC)cc(c1)F 1P027VQZ [1,1,0,0,0,0|1,0,1]=4 619 B12R1.41 ClCCc1cc(OC)cc(c1)Cl 1P027YZH [1,1,0,0,0,0|1,0,1]=4 620 B12R1.41 N#CCc1cc(OC)cc(c1)Br 1P009JN0 [1,1,0,0,0,0|1,0,1]=4 621 B12R1.41 N#CCc1cc(OC)cc(c1)C 1P002D32 [1,1,0,0,0,0|1,0,1]=4 622 B12R1.41 N#CCc1cc(OC)cc(c1)Cl 1P01BW6I [1,1,0,0,0,0|1,0,1]=4 623 B12R1.41 N#CCc1cc(OC)cc(c1)F 1P00H06E [1,1,0,0,0,0|1,0,1]=4 624 B12R1.41 NCCc1cc(OC)cc(c1)Br 1P00BHTD [1,1,0,0,0,0|1,0,1]=4 625 B12R1.41 NCCc1cc(OC)cc(c1)Br 1P027YJK [1,1,0,0,0,0|1,0,1]=4 626 B12R1.41 NCCc1cc(OC)cc(c1)C 1P01B5IQ [1,1,0,0,0,0|1,0,1]=4 627 B12R1.41 NCCc1cc(OC)cc(c1)C 1P02857F [1,1,0,0,0,0|1,0,1]=4 628 B12R1.41 NCCc1cc(OC)cc(c1)Cl 1P0289IY [1,1,0,0,0,0|1,0,1]=4 629 B12R1.41 OCCc1cc(OC)cc(c1)Cl 1P01BWA4 [1,1,0,0,0,0|1,0,1]=4 630 B12R1.41 OCCc1cc(OC)cc(c1)N 1P00C6TF [1,1,0,0,0,0|1,0,1]=4 631 B12R1.41 OCCc1cc(OC)cc(c1)O 1P01C4A1 [1,1,0,0,0,0|1,0,1]=4 632 B12R1.270 C=CCc1cc(C=O)ccc1O 1P0073TR [1,1,0,0,0,0|2,0,0]=4 633 B12R1.270 C=CCc1cc(OC)ccc1O 1P00EL68 [1,1,0,0,0,0|0,0,0]=2 634 B12R1.270 CNCc1cc(OC)ccc1Br 1P01BEKS [1,1,0,0,0,0|1,0,1]=4 635 B12R1.270 CNCc1cc(OC)ccc1Br 1P028U8K [1,1,0,0,0,0|1,0,1]=4 636 B12R1.270 CNCc1cc(OC)ccc1C 1P027U7D [1,1,0,0,0,0|1,0,1]=4 637 B12R1.270 CNCc1cc(OC)ccc1F 1P02909R [1,1,0,0,0,0|1,0,1]=4 638 B12R1.270 COCc1cc(OC)ccc1Br 1P01DNYK [1,1,0,0,0,0|1,0,1]=4 639 B12R1.270 N#CCc1cc(OC)ccc1Br 1P007LLQ [1,1,0,0,0,0|1,0,1]=4 640 B12R1.270 N#CCc1cc(OC)ccc1C 1P027UFH [1,1,0,0,0,0|1,0,1]=4 641 B12R1.270 N#CCc1cc(OC)ccc1Cl 1P028DI2 [1,1,0,0,0,0|1,0,1]=4 642 B12R1.270 N#CCc1cc(OC)ccc1F 1P0063DJ [1,1,0,0,0,0|1,0,1]=4 643 B12R1.270 N#CCc1cc(OC)ccc1I 1P027U90 [1,1,0,0,0,0|1,0,1]=4 644 B12R1.270 NCCc1cc(OC)ccc1Br 1P00IGVB [1,1,0,0,0,0|1,0,1]=4 645 B12R1.270 NCCc1cc(OC)ccc1C 1P027V32 [1,1,0,0,0,0|1,0,1]=4 646 B12R1.270 NCCc1cc(OC)ccc1Cl 1P028E4R [1,1,0,0,0,0|1,0,1]=4 647 B12R1.270 NNCc1cc(OC)ccc1Br 1P01BDDE [1,1,0,0,0,0|2,0,0]=4 648 B12R1.270 OCCc1cc(OC)ccc1Br 1P008QCH [1,1,0,0,0,0|1,0,1]=4 649 B12R1.278 CCOc1cccc(c1)CNC 1P00J4FL [1,1,0,0,0,0|1,0,1]=4 650 B12R1.278 NCCc1cccc(c1)OCC 1P008OZL [1,1,0,0,0,0|1,0,1]=4 651 B12R1.278 NCCc1cccc(c1)OCC 1P028LUR [1,1,0,0,0,0|1,0,1]=4 652 B12R1.279 C=CCc1cccc(c1)C(=O)O 1P007W98 [1,1,0,0,0,0|2,0,0]=4 653 B12R1.280 C=CCc1cccc(c1O)C=O 1P003JA9 [1,1,0,0,0,0|2,0,0]=4 654 B12R1.280 C=CCc1cccc(c1O)OC 1P003TXT [1,1,0,0,0,0|0,0,0]=2 655 B12R1.280 CNCc1cccc(c1Cl)OC 1P027WQ8 [1,1,0,0,0,0|1,0,1]=4 656 B12R1.280 CNCc1cccc(c1F)OC 1P027YXD [1,1,0,0,0,0|1,0,1]=4 657 B12R1.280 N#CCc1cccc(c1Cl)OC 1P01B2OP [1,1,0,0,0,0|1,0,1]=4 658 B12R1.280 N#CCc1cccc(c1O)OC 1P00BZGF [1,1,0,0,0,0|1,0,1]=4 659 B12R1.280 NCCc1cccc(c1C)OC 1P027VLC [1,1,0,0,0,0|1,0,1]=4 660 B12R1.280 NCCc1cccc(c1O)OC 1P002JI2 [1,1,0,0,0,0|1,0,1]=4 661 B12R1.382 BrCCCc1cccc(c1)OC 1P01AKGK [1,1,0,0,0,0|0,0,2]=4 662 B12R1.382 BrCCOc1cccc(c1)OC 1P00C6EK [1,1,0,0,0,0|1,0,1]=4 663 B12R1.382 BrCCSc1cccc(c1)OC 1P01B5H1 [1,1,0,0,0,0|1,0,1]=4 664 B12R1.382 C#CCCc1cccc(c1)OC 1P024V7W [1,1,0,0,0,0|0,0,2]=4 665 B12R1.382 C#CCOc1cccc(c1)OC 1P01ABOE [1,1,0,0,0,0|0,0,2]=4 666 B12R1.382 C=CCOc1cccc(c1)C=O 1P00C97I [1,1,0,0,0,0|2,0,0]=4 667 B12R1.382 C=CCOc1cccc(c1)CO 1P00C91E [1,1,0,0,0,0|2,0,0]=4 668 B12R1.382 CCNCc1cccc(c1)OC 1P001D6Y [1,1,0,0,0,0|0,0,2]=4 669 B12R1.382 CNCCc1cccc(c1)OC 1P007FEZ [1,1,0,0,0,0|0,0,2]=4 670 B12R1.382 ClCCOc1cccc(c1)OC 1P0086Q3 [1,1,0,0,0,0|1,0,1]=4 671 B12R1.382 N#CCOc1cccc(c1)OC 1P003FAN [1,1,0,0,0,0|1,0,1]=4 672 B12R1.382 N#CSCc1cccc(c1)OC 1P01FFU4 [1,1,0,0,0,0|1,0,1]=4 673 B12R1.382 NCCCc1cccc(c1)OC 1P00APQH [1,1,0,0,0,0|0,0,2]=4 674 B12R1.382 NCCCc1cccc(c1)OC 1P01AAAX [1,1,0,0,0,0|0,0,2]=4 675 B12R1.382 NCCOc1cccc(c1)OC 1P002TEL [1,1,0,0,0,0|1,0,1]=4 676 B12R1.382 NCCOc1cccc(c1)OC 1P003FAO [1,1,0,0,0,0|1,0,1]=4 677 B12R1.382 O=C=NCc1cccc(c1)OC 1P003DK0 [1,1,0,0,0,0|1,0,1]=4 678 B12R1.382 O=CCCc1cccc(c1)OC 1P00CAW9 [1,1,0,0,0,0|0,0,1]=3 679 B12R1.382 O=CCCc1cncc(c1)OC 1P01ADNE [1,1,0,0,0,0|1,0,1]=4 680 B12R1.382 O=C\C=C\c1cccc(c1)OC 1P00EITV [1,1,0,0,0,0|0,0,1]=3 681 B12R1.382 OCCCc1cccc(c1)OC 1P005RMW [1,1,0,0,0,0|0,0,2]=4 682 B12R1.382 S=C=NCc1cccc(c1)OC 1P005Z45 [1,1,0,0,0,0|1,0,1]=4 683 B12R1.382 [N-]=[N+]=NCc1cccc(c1)OC 1P000LID [1,1,0,0,0,0|2,0,0]=4 684 B12R1.435 BrCC(c1cccc(c1)OC)F 1P01DZF5 [1,1,0,0,0,0|1,0,1]=4 685 B12R1.435 CCC(c1cccc(c1)OC)Br 1P02855K [1,1,0,0,0,0|0,0,2]=4 686 B12R1.435 CCC(c1cccc(c1)OC)N 1P01ASWT [1,1,0,0,0,0|0,0,2]=4 687 B12R1.435 CCC(c1cccc(c1)OC)O 1P00DC25 [1,1,0,0,0,0|0,0,2]=4 688 B12R1.435 CC[C@@H](C1=CC=CC(OC)=C1)N 1P01JYYC [1,1,0,0,0,0|0,0,2]=4 689 B12R1.435 CC[C@H](c1cccc(c1)OC)N 1P00E9ML [1,1,0,0,0,0|0,0,2]=4 690 B12R1.435 CC[C@H](c1cccc(c1)OC)N 1P00IE70 [1,1,0,0,0,0|0,0,2]=4 691 B12R1.435 CNC(c1cccc(c1)OC)C 1P0073DA [1,1,0,0,0,0|1,0,1]=4 692 B12R1.435 FCC(c1cccc(c1)OC)N 1P01BWZR [1,1,0,0,0,0|1,0,1]=4 693 B12R1.435 FCC(c1cccc(c1)OC)O 1P01EAR7 [1,1,0,0,0,0|1,0,1]=4 694 B12R1.435 N#CC(c1cccc(c1)OC)C 1P019X8Q [1,1,0,0,0,0|1,0,1]=4 695 B12R1.435 NCC(c1cccc(c1)OC)O 1P00BGPI [1,1,0,0,0,0|1,0,1]=4 696 B12R1.435 NCC(c1cccc(c1)OC)O 1P01AIO7 [1,1,0,0,0,0|1,0,1]=4 697 B12R1.435 O=CC(=O)c1cccc(c1)OC 1P000EIK [1,1,0,0,0,0|1,0,1]=4 698 B12R1.435 O=CC(=O)c1cccc(c1)OC 1P003K4L [1,1,0,0,0,0|1,0,1]=4 699 B12R1.435 O=CC(c1cccc(c1)OC)C 1P020M0V [1,1,0,0,0,0|1,0,0]=3 700 B12R1.435 OCC(c1cccc(c1)OC)N 1P0092VI [1,1,0,0,0,0|1,0,1]=4 701 B12R1.435 OCC(c1cccc(c1)OC)N 1P00CIU6 [1,1,0,0,0,0|1,0,1]=4 702 B12R1.435 OCC(c1cccc(c1)OC)O 1P01BWAF [1,1,0,0,0,0|1,0,1]=4 703 B12R1.435 OC[C@@H](c1cccc(c1)OC)N 1P00GAON [1,1,0,0,0,0|1,0,1]=4 704 B12R1.435 OC[C@@H](c1cccc(c1)OC)N 1P01B69A [1,1,0,0,0,0|1,0,1]=4 705 B12R1.435 OC[C@H](c1cccc(c1)OC)N 1P009ZQG [1,1,0,0,0,0|1,0,1]=4 706 B12R1.438 CCc1cccc(c1)CC(=O)O 1P01A259 [1,1,0,0,0,0|2,0,0]=4 707 B12R1.438 COc1cc(CC(=O)O)cnc1 1P01A5X6 [1,1,0,0,0,0|2,0,0]=4 708 B12R1.438 COc1cccc(c1)CC(=N)N 1P00ECGZ [1,1,0,0,0,0|1,0,0]=3 709 B12R1.438 COc1cccc(c1)CC(=O)C 1P002ZVT [1,1,0,0,0,0|0,0,1]=3 710 B12R1.438 COc1cccc(c1)CC(=O)Cl 1P003K4I [1,1,0,0,0,0|1,0,0]=3 711 B12R1.438 COc1cccc(c1)CC(=O)O 1P0027Q3 [1,1,0,0,0,0|1,0,0]=3 712 B12R1.438 COc1cccc(c1)NC(=N)N 1P00EFVN [1,1,0,0,0,0|2,0,0]=4 713 B12R1.438 COc1cccc(c1)NC(=O)C 1P00E9P4 [1,1,0,0,0,0|1,0,1]=4 714 B12R1.438 COc1cccc(c1)NC(=S)N 1P00C9D9 [1,1,0,0,0,0|2,0,0]=4 715 B12R1.438 COc1cccc(n1)CC(=O)C 1P01A6SY [1,1,0,0,0,0|1,0,1]=4 716 B12R1.438 COc1cccc(n1)CC(=O)O 1P003FF6 [1,1,0,0,0,0|2,0,0]=4 717 B12R1.438 COc1cccc(n1)CC(=O)O 1P01AD1B [1,1,0,0,0,0|2,0,0]=4 718 B12R1.438 COc1cccc(n1)CC(=O)[O-] 1P01EI8U [1,1,0,0,0,0|2,0,0]=4 719 B12R1.438 COc1nccc(c1)CC(=O)C 1P01ANP5 [1,1,0,0,0,0|1,0,1]=4 720 B12R1.438 COc1nccc(c1)CC(=O)O 1P00DKUY [1,1,0,0,0,0|2,0,0]=4 721 B12R1.438 COc1nccc(c1)CC(=O)O 1P01ALMK [1,1,0,0,0,0|2,0,0]=4 722 B12R1.438 CSc1cccc(c1)CC(=O)O 1P003IQ0 [1,1,0,0,0,0|1,1,0]=4 723 B12R1.438 [O-]C(=O)Cc1cc(OC)ccn1 1P01BFWN [1,1,0,0,0,0|2,0,0]=4 724 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)O 1P00IBYT [1,1,0,0,0,0|1,0,1]=4 725 B12R1.19 CC(=O)Cc1ccc(c(c1)O)O 1P002QOU [1,1,0,0,0,0|0,0,1]=3 726 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 1P001UU4 [1,1,0,0,0,0|1,0,1]=4 727 B12R1.19 CC(=O)Nc1ccc(c(c1)O)O 1P00C6Z8 [1,1,0,0,0,0|1,0,1]=4 728 B12R1.19 CN(Cc1ccc(c(c1)C)O)C 1P00E8O4 [1,1,0,0,0,0|1,0,1]=4 729 B12R1.19 NC(=N)Sc1ccc(c(c1)O)O 1P01C510 [1,1,0,0,0,0|2,0,0]=4 730 B12R1.19 NC(=O)Cc1ccc(c(c1)O)O 1P0078YT [1,1,0,0,0,0|1,0,0]=3 731 B12R1.19 OC(=O)Cc1ccc(c(c1)Br)O 1P00792O [1,1,0,0,0,0|2,0,0]=4 732 B12R1.19 OC(=O)Cc1ccc(c(c1)C)Br 1P003AF8 [1,1,0,0,0,0|2,0,0]=4 733 B12R1.19 OC(=O)Cc1ccc(c(c1)C)C 1P003IZ9 [1,1,0,0,0,0|2,0,0]=4 734 B12R1.19 OC(=O)Cc1ccc(c(c1)C)F 1P00015M [1,1,0,0,0,0|2,0,0]=4 735 B12R1.19 OC(=O)Cc1ccc(c(c1)C)N 1P003FBB [1,1,0,0,0,0|2,0,0]=4 736 B12R1.19 OC(=O)Cc1ccc(c(c1)C)O 1P002XUD [1,1,0,0,0,0|1,0,0]=3 737 B12R1.19 OC(=O)Cc1ccc(c(c1)Cl)O 1P00344F [1,1,0,0,0,0|2,0,0]=4 738 B12R1.19 OC(=O)Cc1ccc(c(c1)F)O 1P003JWL [1,1,0,0,0,0|2,0,0]=4 739 B12R1.19 OC(=O)Cc1ccc(c(c1)N)O 1P00BZYS [1,1,0,0,0,0|2,0,0]=4 740 B12R1.19 OC(=O)Cc1ccc(c(c1)O)Br 1P01B7XA [1,1,0,0,0,0|2,0,0]=4 741 B12R1.19 OC(=O)Cc1ccc(c(c1)O)C 1P0090I0 [1,1,0,0,0,0|2,0,0]=4 742 B12R1.19 OC(=O)Cc1ccc(c(c1)O)O 1P0006PK [1,1,0,0,0,0|1,0,0]=3 743 B12R1.44 NCCc1cc(C)c(c(c1)C)O 1P01B22V [1,1,0,0,0,0|1,0,1]=4 744 B12R1.44 [NH3+]CCc1cc(O)c(c(c1)O)O 1P003N99 [1,1,0,0,0,0|1,0,1]=4 745 B12R1.288 CCCc1ccc(c(c1)O)OC 1P00F272 [1,1,0,0,0,0|0,0,2]=4 746 B12R1.288 CNCc1ccc(c(c1)C)OC 1P00CPHK [1,1,0,0,0,0|1,0,1]=4 747 B12R1.288 CNCc1ccc(c(c1)O)OC 1P00DDJ3 [1,1,0,0,0,0|1,0,1]=4 748 B12R1.288 N#CCc1ccc(c(c1)C)OC 1P005MIA [1,1,0,0,0,0|1,0,1]=4 749 B12R1.288 NCCc1ccc(c(c1)C)OC 1P0023DD [1,1,0,0,0,0|1,0,1]=4 750 B12R1.288 NCCc1ccc(c(c1)O)OC 1P0037EE [1,1,0,0,0,0|1,0,1]=4 751 B12R1.288 NCCc1ccc(c(c1)O)OC 1P003MEN [1,1,0,0,0,0|1,0,1]=4 752 B12R1.288 OCCc1ccc(c(c1)O)OC 1P01BTXQ [1,1,0,0,0,0|1,0,1]=4 753 B12R1.367 NCC(c1ccc(c(c1)O)O)O 1P00189K [1,1,0,0,0,0|1,0,1]=4 754 B12R1.367 NCC(c1ccc(c(c1)O)O)O 1P003QB2 [1,1,0,0,0,0|1,0,1]=4 755 B12R1.367 NCC(c1ccc(c(c1)O)O)O 1P01DQI9 [1,1,0,0,0,0|1,0,1]=4 756 B12R1.367 NC[C@@H](c1ccc(c(c1)O)O)O 1P00C15O [1,1,0,0,0,0|1,0,1]=4 757 B12R1.367 NC[C@@H](c1ccc(c(c1)O)O)O 1P00IKXZ [1,1,0,0,0,0|1,0,1]=4 758 B12R1.367 NC[C@@H](c1ccc(c(c1)O)O)O 1P01BIAW [1,1,0,0,0,0|1,0,1]=4 759 B12R1.367 NC[C@H](c1ccc(c(c1)O)O)O 1P003CYP [1,1,0,0,0,0|1,0,1]=4 760 B12R1.367 OCC(c1ccc(c(c1)O)O)O 1P002X3Q [1,1,0,0,0,0|1,0,1]=4 761 B12R1.385 C#CCSc1ccc(c(c1)C)O 1P01ENAT [1,1,0,0,0,0|0,0,2]=4 762 B12R1.385 C=CCCc1ccc(c(c1)C)C 1P01EMIZ [1,1,0,0,0,0|1,0,0]=3 763 B12R1.385 CCCCc1ccc(c(c1)C)O 1P01DZBO [1,1,0,0,0,0|0,0,2]=4 764 B12R1.385 CCCCc1ccc(c(c1)O)O 1P00BJNG [1,1,0,0,0,0|0,0,2]=4 765 B12R1.385 CCNCc1ccc(c(c1)O)O 1P001DQX [1,1,0,0,0,0|0,0,2]=4 766 B12R1.385 CNCCc1ccc(c(c1)O)O 1P00E95T [1,1,0,0,0,0|0,0,2]=4 767 B12R1.385 N#CCCc1ccc(c(c1)C)O 1P01EMU2 [1,1,0,0,0,0|0,0,2]=4 768 B12R1.385 NCCCc1ccc(c(c1)O)O 1P01JMHF [1,1,0,0,0,0|0,0,2]=4 769 B12R1.1123 NCCc1cc(O)c(cc1O)O 1P0034TT [1,1,0,0,0,0|1,0,1]=4 770 B12R1.1123 [NH3+]CCc1cc(O)c(cc1O)O 1P00BCGR [1,1,0,0,0,0|1,0,1]=4 771 B12R1.56 CCc1cc(ccc1O)C(=O)O 1P0095MP [1,1,0,0,0,0|2,0,0]=4 772 B12R1.56 COc1cc(ccc1Br)C(=O)C 1P00I9KW [1,1,0,0,0,0|1,0,1]=4 773 B12R1.56 COc1cc(ccc1Br)C(=O)N 1P0025HO [1,1,0,0,0,0|2,0,0]=4 774 B12R1.56 COc1cc(ccc1Br)C(=O)O 1P003LEZ [1,1,0,0,0,0|2,0,0]=4 775 B12R1.56 COc1cc(ccc1Br)C(C)C 1P0053MX [1,1,0,0,0,0|1,0,1]=4 776 B12R1.56 COc1cc(ccc1Br)C(F)F 1P028P2Q [1,1,0,0,0,0|2,0,0]=4 777 B12R1.56 COc1cc(ccc1C)C(=O)C 1P00I7IQ [1,1,0,0,0,0|1,0,1]=4 778 B12R1.56 COc1cc(ccc1C)C(=O)O 1P0036AY [1,1,0,0,0,0|2,0,0]=4 779 B12R1.56 COc1cc(ccc1C)C(C)C 1P01A0RZ [1,1,0,0,0,0|1,0,1]=4 780 B12R1.56 COc1cc(ccc1Cl)C(=O)C 1P00ICX4 [1,1,0,0,0,0|1,0,1]=4 781 B12R1.56 COc1cc(ccc1Cl)C(=O)O 1P004PLE [1,1,0,0,0,0|2,0,0]=4 782 B12R1.56 COc1cc(ccc1F)C(=O)C 1P003LUV [1,1,0,0,0,0|1,0,1]=4 783 B12R1.56 COc1cc(ccc1F)C(=O)O 1P004T2P [1,1,0,0,0,0|2,0,0]=4 784 B12R1.56 COc1cc(ccc1F)C(N)C 1P01A449 [1,1,0,0,0,0|1,0,1]=4 785 B12R1.56 COc1cc(ccc1F)[C@@H](N)C 1P004M1J [1,1,0,0,0,0|1,0,1]=4 786 B12R1.56 COc1cc(ccc1F)[C@@H](N)C 1P01DUOI [1,1,0,0,0,0|1,0,1]=4 787 B12R1.56 COc1cc(ccc1F)[C@H](N)C 1P000HAA [1,1,0,0,0,0|1,0,1]=4 788 B12R1.56 COc1cc(ccc1F)[C@H](N)C 1P000OXX [1,1,0,0,0,0|1,0,1]=4 789 B12R1.56 COc1cc(ccc1I)C(=O)O 1P00BIHY [1,1,0,0,0,0|2,0,0]=4 790 B12R1.56 COc1cc(ccc1I)C(C)C 1P01FT1Q [1,1,0,0,0,0|1,0,1]=4 791 B12R1.56 COc1cc(ccc1N)C(=O)C 1P007Q2G [1,1,0,0,0,0|1,0,1]=4 792 B12R1.56 COc1cc(ccc1N)C(=O)N 1P002LRM [1,1,0,0,0,0|2,0,0]=4 793 B12R1.56 COc1cc(ccc1N)C(=O)O 1P002Q51 [1,1,0,0,0,0|2,0,0]=4 794 B12R1.56 COc1cc(ccc1O)B(O)O 1P00245O [1,1,0,0,0,0|2,0,0]=4 795 B12R1.56 COc1cc(ccc1O)C(=O)C 1P00I9CY [1,1,0,0,0,0|0,0,1]=3 796 B12R1.56 COc1cc(ccc1O)C(=O)O 1P003LYI [1,1,0,0,0,0|1,0,0]=3 797 B12R1.56 COc1cc(ccc1O)C(=O)[O-] 1P002W1L [1,1,0,0,0,0|1,0,0]=3 798 B12R1.56 COc1cc(ccc1O)C(O)C 1P002PY1 [1,1,0,0,0,0|0,0,1]=3 799 B12R1.56 COc1cc(ccc1O)[N+](=O)[O-] 1P003HZN [1,1,0,0,0,0|2,0,0]=4 800 B12R1.56 COc1cc(ccc1S)C(=O)C 1P019ZNJ [1,1,0,0,0,0|0,1,1]=4 801 B12R1.78 COc1cc(C#C)ccc1OC 1P00C05R [1,1,0,0,0,0|0,0,2]=4 802 B12R1.78 COc1cc(C#N)ccc1OC 1P0028OH [1,1,0,0,0,0|1,0,1]=4 803 B12R1.78 COc1cc(C=C)ccc1OC 1P0037LB [1,1,0,0,0,0|0,0,0]=2 804 B12R1.78 COc1cc(C=O)ccc1C#C 1P002F9Q [1,1,0,0,0,0|2,0,0]=4 805 B12R1.78 COc1cc(C=O)ccc1C#N 1P00BJ42 [1,1,0,0,0,0|2,0,0]=4 806 B12R1.78 COc1cc(C=O)ccc1OC 1P000QGW [1,1,0,0,0,0|1,0,0]=3 807 B12R1.78 COc1cc(C=O)ccc1SC 1P006GFG [1,1,0,0,0,0|1,1,0]=4 808 B12R1.78 COc1cc(C=O)cnc1OC 1P0034MY [1,1,0,0,0,0|2,0,0]=4 809 B12R1.78 COc1cc(C=O)ncc1OC 1P01J15E [1,1,0,0,0,0|2,0,0]=4 810 B12R1.78 COc1cc(CBr)ccc1C#N 1P0186Z8 [1,1,0,0,0,0|2,0,0]=4 811 B12R1.78 COc1cc(CBr)ccc1OC 1P0038ML [1,1,0,0,0,0|1,0,0]=3 812 B12R1.78 COc1cc(CC)ccc1C=O 1P024UM8 [1,1,0,0,0,0|0,0,2]=4 813 B12R1.78 COc1cc(CC)ccc1OC 1P00EDBD [1,1,0,0,0,0|0,0,1]=3 814 B12R1.78 COc1cc(CCl)ccc1OC 1P003IYQ [1,1,0,0,0,0|1,0,0]=3 815 B12R1.78 COc1cc(CCl)ccc1SC 1P01AHM3 [1,1,0,0,0,0|1,1,0]=4 816 B12R1.78 COc1cc(CN)ccc1C#N 1P01BCSR [1,1,0,0,0,0|2,0,0]=4 817 B12R1.78 COc1cc(CN)ccc1C#N 1P01BEWY [1,1,0,0,0,0|2,0,0]=4 818 B12R1.78 COc1cc(CN)ccc1OC 1P003VRF [1,1,0,0,0,0|1,0,0]=3 819 B12R1.78 COc1cc(CN)cnc1OC 1P0289JS [1,1,0,0,0,0|2,0,0]=4 820 B12R1.78 COc1cc(CN)ncc1OC 1P01BY9L [1,1,0,0,0,0|2,0,0]=4 821 B12R1.78 COc1cc(CO)ccc1OC 1P00IHWF [1,1,0,0,0,0|1,0,0]=3 822 B12R1.78 COc1cc(CO)cnc1OC 1P009140 [1,1,0,0,0,0|2,0,0]=4 823 B12R1.78 COc1cc(CO)ncc1OC 1P00EKI2 [1,1,0,0,0,0|2,0,0]=4 824 B12R1.78 COc1cc(CS)ccc1OC 1P00DGA8 [1,1,0,0,0,0|1,0,0]=3 825 B12R1.78 COc1cc(NC)ccc1OC 1P00KM4Z [1,1,0,0,0,0|1,0,1]=4 826 B12R1.78 COc1cc(NC)ccc1OC 1P019Y4F [1,1,0,0,0,0|1,0,1]=4 827 B12R1.78 COc1cc(NN)ccc1OC 1P00397L [1,1,0,0,0,0|2,0,0]=4 828 B12R1.78 COc1cc(OC)ccc1CO 1P003BLM [1,1,0,0,0,0|1,0,1]=4 829 B12R1.78 COc1cc(SC)ccc1OC 1P00BEH0 [1,1,0,0,0,0|1,0,1]=4 830 B12R1.78 COc1ccc(c(c1)OC)OC 1P007NO6 [1,1,0,0,0,0|1,0,1]=4 831 B12R1.78 COc1nc(C=O)ccc1OC 1P007VIN [1,1,0,0,0,0|2,0,0]=4 832 B12R1.78 COc1nc(CO)ccc1OC 1P00IAYW [1,1,0,0,0,0|2,0,0]=4 833 B12R1.78 CSc1cc(C=O)ccc1OC 1P01AI5J [1,1,0,0,0,0|1,1,0]=4 834 B12R1.78 NCc1ccc(c(c1)OC)CN 1P01DR8D [1,1,0,0,0,0|2,0,0]=4 835 B12R1.300 CCc1cc(C=O)cc(c1O)C 1P024FBY [1,1,0,0,0,0|2,0,0]=4 836 B12R1.300 COc1cc(C#N)cc(c1O)Br 1P003JIK [1,1,0,0,0,0|1,0,1]=4 837 B12R1.300 COc1cc(C#N)cc(c1O)C 1P001ZQF [1,1,0,0,0,0|1,0,1]=4 838 B12R1.300 COc1cc(C#N)cc(c1O)Cl 1P00DFTL [1,1,0,0,0,0|1,0,1]=4 839 B12R1.300 COc1cc(C#N)cc(c1O)I 1P008JUJ [1,1,0,0,0,0|1,0,1]=4 840 B12R1.300 COc1cc(C#N)cc(c1O)O 1P0044J8 [1,1,0,0,0,0|1,0,1]=4 841 B12R1.300 COc1cc(C=O)cc(c1F)F 1P003ADB [1,1,0,0,0,0|2,0,0]=4 842 B12R1.300 COc1cc(C=O)cc(c1O)Br 1P002ZPJ [1,1,0,0,0,0|1,0,0]=3 843 B12R1.300 COc1cc(C=O)cc(c1O)C 1P01XCTK [1,1,0,0,0,0|1,0,0]=3 844 B12R1.300 COc1cc(C=O)cc(c1O)Cl 1P003N5V [1,1,0,0,0,0|1,0,0]=3 845 B12R1.300 COc1cc(C=O)cc(c1O)F 1P003AB2 [1,1,0,0,0,0|1,0,0]=3 846 B12R1.300 COc1cc(C=O)cc(c1O)I 1P003NA2 [1,1,0,0,0,0|1,0,0]=3 847 B12R1.300 COc1cc(C=O)cc(c1O)O 1P003IY8 [1,1,0,0,0,0|1,0,0]=3 848 B12R1.300 COc1cc(CN)cc(c1O)Br 1P01A49V [1,1,0,0,0,0|1,0,0]=3 849 B12R1.300 COc1cc(CO)cc(c1O)I 1P00CI5O [1,1,0,0,0,0|1,0,0]=3 850 B12R1.300 COc1cc(OC)c(c(c1)I)O 1P027Z4E [1,1,0,0,0,0|1,0,1]=4 851 B12R1.449 CCc1cc(C=O)c(cc1O)O 1P00CNC1 [1,1,0,0,0,0|2,0,0]=4 852 B12R1.449 CCc1cc(OC)c(cc1C)N 1P01DTTC [1,1,0,0,0,0|1,0,1]=4 853 B12R1.449 CCc1cc(OC)c(cc1F)O 1P0092OT [1,1,0,0,0,0|0,0,1]=3 854 B12R1.449 COc1cc(C#N)c(cc1O)C 1P01DZCX [1,1,0,0,0,0|1,0,1]=4 855 B12R1.449 COc1cc(C=O)c(cc1Br)F 1P00G82S [1,1,0,0,0,0|2,0,0]=4 856 B12R1.449 COc1cc(C=O)c(cc1Br)O 1P003LDN [1,1,0,0,0,0|2,0,0]=4 857 B12R1.449 COc1cc(C=O)c(cc1C)F 1P01BY2R [1,1,0,0,0,0|2,0,0]=4 858 B12R1.449 COc1cc(C=O)c(cc1C)O 1P01EXQ8 [1,1,0,0,0,0|2,0,0]=4 859 B12R1.449 COc1cc(C=O)c(cc1Cl)F 1P0025JL [1,1,0,0,0,0|2,0,0]=4 860 B12R1.449 COc1cc(C=O)c(cc1Cl)O 1P01ENPU [1,1,0,0,0,0|2,0,0]=4 861 B12R1.449 COc1cc(C=O)c(cc1F)Br 1P00IEKH [1,1,0,0,0,0|2,0,0]=4 862 B12R1.449 COc1cc(C=O)c(cc1F)F 1P0025JK [1,1,0,0,0,0|2,0,0]=4 863 B12R1.449 COc1cc(C=O)c(cc1F)O 1P0292H4 [1,1,0,0,0,0|2,0,0]=4 864 B12R1.449 COc1cc(C=O)c(cc1O)Br 1P0034T8 [1,1,0,0,0,0|1,0,0]=3 865 B12R1.449 COc1cc(C=O)c(cc1O)Cl 1P0024IK [1,1,0,0,0,0|1,0,0]=3 866 B12R1.449 COc1cc(C=O)c(cc1O)O 1P00DD34 [1,1,0,0,0,0|1,0,0]=3 867 B12R1.449 COc1cc(CN)c(cc1Br)F 1P028R6T [1,1,0,0,0,0|2,0,0]=4 868 B12R1.449 COc1cc(CN)c(cc1C)Br 1P027Y96 [1,1,0,0,0,0|2,0,0]=4 869 B12R1.449 COc1cc(CN)c(cc1O)Br 1P01C5I4 [1,1,0,0,0,0|1,0,0]=3 870 B12R1.449 COc1cc(CO)c(cc1F)F 1P01DFKH [1,1,0,0,0,0|2,0,0]=4 871 B12R1.453 CCc1ccc(c(c1)C(=O)C)O 1P002OXC [1,1,0,0,0,0|1,0,1]=4 872 B12R1.654 COc1c(Br)ccc(c1Br)CN 1P028AXJ [1,1,0,0,0,0|2,0,0]=4 873 B12R1.654 COc1c(Br)ccc(c1F)C=O 1P00I0ZX [1,1,0,0,0,0|2,0,0]=4 874 B12R1.654 COc1c(Cl)ccc(c1F)C=O 1P0001SB [1,1,0,0,0,0|2,0,0]=4 875 B12R1.654 COc1c(Cl)ccc(c1F)CN 1P00HT3U [1,1,0,0,0,0|2,0,0]=4 876 B12R1.654 COc1c(Cl)ccc(c1F)CO 1P009J4C [1,1,0,0,0,0|2,0,0]=4 877 B12R1.654 COc1c(F)ccc(c1F)C=O 1P003G8S [1,1,0,0,0,0|2,0,0]=4 878 B12R1.654 COc1c(F)ccc(c1F)CBr 1P003G8T [1,1,0,0,0,0|2,0,0]=4 879 B12R1.654 COc1c(F)ccc(c1F)CN 1P003BLH [1,1,0,0,0,0|2,0,0]=4 880 B12R1.654 COc1c(O)ccc(c1C)C=O 1P002336 [1,1,0,0,0,0|1,0,0]=3 881 B12R1.654 COc1c(O)ccc(c1Cl)C=O 1P004XD1 [1,1,0,0,0,0|1,0,0]=3 882 B12R1.654 COc1c(O)ccc(c1O)C=O 1P019FJG [1,1,0,0,0,0|1,0,0]=3 883 B14R1.41 COc1cc(ccc1F)[C@@H](C(=O)O)N 1P00231I [0,2,0,0,0,0|2,0,0]=4 884 B14R1.41 COc1cc(ccc1F)[C@H](C(=O)O)N 1P01XDO0 [0,2,0,0,0,0|2,0,0]=4 885 B14R1.41 COc1cc(ccc1O)C(C(=O)O)O 1P003ABI [0,2,0,0,0,0|1,0,0]=3 886 B14R1.626 CCCC(=O)c1ccc(c(c1)OC)O 1P01IGHV [0,2,0,0,0,0|0,0,2]=4 887 B14R1.626 CNCC(c1ccc(c(c1)OC)O)O 1P00DIOD [0,2,0,0,0,0|0,0,2]=4 888 B14R1.626 CNCC(c1ccc(c(c1)OC)O)O 1P00GT0T [0,2,0,0,0,0|0,0,2]=4 889 B14R1.626 OCCC(=O)c1ccc(c(c1)OC)O 1P00C57B [0,2,0,0,0,0|1,0,1]=4 890 B14R1.1864 C=CC(c1ccc(c(c1)OC)OC)O 1P01QEN7 [0,2,0,0,0,0|0,0,0]=2 891 B14R1.1864 CCC(c1ccc(c(c1)OC)OC)N 1P0005E0 [0,2,0,0,0,0|0,0,2]=4 892 B14R1.1864 CCC(c1ccc(c(c1)OC)OC)N 1P00J2ID [0,2,0,0,0,0|0,0,2]=4 893 B14R1.1864 CCC(c1ccc(c(c1)OC)OC)O 1P00858K [0,2,0,0,0,0|0,0,2]=4 894 B14R1.1864 CC[C@H](c1ccc(c(c1)OC)OC)N 1P00IDPV [0,2,0,0,0,0|0,0,2]=4 895 B14R1.1864 NCC(c1ccc(c(c1)OC)OC)C 1P00DVOA [0,2,0,0,0,0|1,0,1]=4 896 B14R1.1864 NCC(c1ccc(c(c1)OC)OC)O 1P00B5IC [0,2,0,0,0,0|1,0,1]=4 897 B14R1.1864 NCC(c1ccc(c(c1)OC)OC)O 1P00FHGM [0,2,0,0,0,0|1,0,1]=4 898 B14R1.1864 O=CC(c1ccc(c(c1)OC)OC)C 1P00I8CJ [0,2,0,0,0,0|1,0,0]=3 899 B14R1.1864 OC[C@@H](c1ccc(c(c1)OC)OC)N 1P0096O5 [0,2,0,0,0,0|1,0,1]=4 900 B14R1.1864 OC[C@@H](c1ccc(c(c1)OC)OC)N 1P01KKG0 [0,2,0,0,0,0|1,0,1]=4 901 B14R1.1864 OC[C@H](c1ccc(c(c1)OC)OC)N 1P0096O7 [0,2,0,0,0,0|1,0,1]=4 902 B14R1.1864 OC[C@H](c1ccc(c(c1)OC)OC)N 1P024G2U [0,2,0,0,0,0|1,0,1]=4 903 B14R1.1864 ONC(c1ccc(c(c1)OC)OC)C 1P028W09 [0,2,0,0,0,0|2,0,0]=4 904 B14R1.439 CCOc1cc(ccc1O)CC(=O)O 1P005E8G [0,2,0,0,0,0|1,0,0]=3 905 B14R1.881 COc1cc(CC(=O)O)c(cc1O)Br 1P0023EM [0,2,0,0,0,0|1,0,0]=3 906 B14R1.3405 COC(=O)Cc1ccc(c(c1)OC)Br 1P0029LR [0,2,0,0,0,0|1,0,1]=4 907 B14R1.3405 COC(=O)Cc1ccc(c(c1)OC)F 1P01KKU4 [0,2,0,0,0,0|1,0,1]=4 908 B14R1.3405 COC(=O)Cc1ccc(c(c1)OC)N 1P028SLF [0,2,0,0,0,0|1,0,1]=4 909 B14R1.3405 COC(=O)Cc1ccc(c(c1)OC)O 1P001RQ9 [0,2,0,0,0,0|0,0,1]=3 910 B14R1.3405 OCC(=O)Cc1ccc(c(c1)OC)O 1P00DZ42 [0,2,0,0,0,0|0,0,1]=3 911 B14R1.3651 COc1cc(ccc1OC)CC(=N)N 1P00ECSJ [0,2,0,0,0,0|1,0,0]=3 912 B14R1.3651 COc1cc(ccc1OC)CC(=O)Cl 1P003C73 [0,2,0,0,0,0|1,0,0]=3 913 B14R1.3651 COc1cc(ccc1OC)CC(=O)N 1P00EAR7 [0,2,0,0,0,0|1,0,0]=3 914 B14R1.3651 COc1cc(ccc1OC)CC(=O)O 1P0032T7 [0,2,0,0,0,0|1,0,0]=3 915 B14R1.3651 COc1cc(ccc1OC)CC(=S)N 1P001DTV [0,2,0,0,0,0|1,0,0]=3 916 B14R1.3651 COc1cc(ccc1OC)CC(O)C 1P00B0NC [0,2,0,0,0,0|0,0,2]=4 917 B14R1.3651 COc1cc(ccc1OC)C[C@@H](O)C 1P001SNH [0,2,0,0,0,0|0,0,2]=4 918 B14R1.3651 COc1cc(ccc1OC)NC(=S)N 1P019LDB [0,2,0,0,0,0|2,0,0]=4 919 B14R1.3651 COc1cc(cnc1OC)CC(=O)O 1P027WXT [0,2,0,0,0,0|2,0,0]=4 920 B14R1.4106 COc1c(Cl)ccc(c1F)CC(=O)O 1P009J3F [0,2,0,0,0,0|2,0,0]=4 921 B14R1.791 CCNCc1ccc(c(c1)OCC)O 1P019NER [0,2,0,0,0,0|0,0,2]=4 922 B14R1.6787 CNCc1ccc(c(c1)OCC)OC 1P00GU64 [0,2,0,0,0,0|1,0,1]=4 923 B14R1.6787 CNCc1ccc(c(c1)OCC)OC 1P00J43S [0,2,0,0,0,0|1,0,1]=4 924 B14R1.6787 NCCc1ccc(c(c1)OCC)OC 1P008GM2 [0,2,0,0,0,0|1,0,1]=4 925 B14R1.793 BrCCCc1ccc(c(c1)OC)OC 1P01FC73 [0,2,0,0,0,0|0,0,2]=4 926 B14R1.793 BrCCOc1ccc(c(c1)OC)OC 1P019TFR [0,2,0,0,0,0|1,0,1]=4 927 B14R1.793 CCNCc1ccc(c(c1)OC)OC 1P00CM79 [0,2,0,0,0,0|0,0,2]=4 928 B14R1.793 CNCCc1ccc(c(c1)OC)OC 1P003IYW [0,2,0,0,0,0|0,0,2]=4 929 B14R1.793 CNCCc1ccc(c(c1)OC)OC 1P003TOG [0,2,0,0,0,0|0,0,2]=4 930 B14R1.793 N#CCCc1ccc(c(c1)OC)OC 1P01GDKF [0,2,0,0,0,0|0,0,2]=4 931 B14R1.793 N#C\C=C\c1ccc(c(c1)OC)OC 1P003IYU [0,2,0,0,0,0|0,0,2]=4 932 B14R1.793 NCCCc1ccc(c(c1)OC)OC 1P001FMX [0,2,0,0,0,0|0,0,2]=4 933 B14R1.793 O=CCCc1ccc(c(c1)OC)OC 1P00EG76 [0,2,0,0,0,0|0,0,1]=3 934 B14R1.793 O=C\C=C\c1ccc(c(c1)OC)OC 1P01HM7M [0,2,0,0,0,0|0,0,1]=3 935 B14R1.793 OCC=Cc1ccc(c(c1)OC)OC 1P0077ZE [0,2,0,0,0,0|0,0,2]=4 936 B14R1.793 OCCCc1ccc(c(c1)OC)OC 1P003IIG [0,2,0,0,0,0|0,0,2]=4 937 B14R1.793 S=C=NCc1ccc(c(c1)OC)OC 1P001E0V [0,2,0,0,0,0|1,0,1]=4 938 B14R1.3237 N#CCc1cc(OC)c(c(c1)I)OC 1P01A82H [0,2,0,0,0,0|1,0,1]=4 939 B14R1.3237 NCCc1cc(OC)c(c(c1)Br)OC 1P028T15 [0,2,0,0,0,0|1,0,1]=4 940 B14R1.3237 NCCc1cc(OC)c(c(c1)F)OC 1P027UDA [0,2,0,0,0,0|1,0,1]=4 941 B14R1.3237 NCCc1cc(OC)c(c(c1)F)OC 1P027UH6 [0,2,0,0,0,0|1,0,1]=4 942 B14R1.3237 NCCc1cc(OC)c(c(c1)O)OC 1P028XJC [0,2,0,0,0,0|1,0,1]=4 943 B14R1.6788 CCOc1ccc(cc1OC)CNC 1P019J7M [0,2,0,0,0,0|1,0,1]=4 944 B14R1.6788 CCOc1ccc(cc1OC)CNC 1P01EJLX [0,2,0,0,0,0|1,0,1]=4 945 B14R1.6788 NCCc1ccc(c(c1)OC)OCC 1P007AK8 [0,2,0,0,0,0|1,0,1]=4 946 B14R1.10285 CNCc1ccc(c(c1Cl)OC)OC 1P0281A7 [0,2,0,0,0,0|1,0,1]=4 947 B14R1.10285 N#CCc1ccc(c(c1C)OC)OC 1P01BGMD [0,2,0,0,0,0|1,0,1]=4 948 B14R1.10285 N#CCc1ccc(c(c1Cl)OC)OC 1P00GNY7 [0,2,0,0,0,0|1,0,1]=4 949 B14R1.10285 NCCc1ccc(c(c1Br)OC)OC 1P0287QN [0,2,0,0,0,0|1,0,1]=4 950 B14R1.10285 NCCc1ccc(c(c1Cl)OC)OC 1P00IC5R [0,2,0,0,0,0|1,0,1]=4 951 B14R1.10285 NCCc1ccc(c(c1Cl)OC)OC 1P01DLZ7 [0,2,0,0,0,0|1,0,1]=4 952 B14R1.14946 C=CCc1cc(OC)c(cc1O)OC 1P00EVAA [0,2,0,0,0,0|0,0,0]=2 953 B14R1.14946 CNCc1cc(OC)c(cc1Br)OC 1P0280M4 [0,2,0,0,0,0|1,0,1]=4 954 B14R1.14946 CNCc1cc(OC)c(cc1C)OC 1P00G4C1 [0,2,0,0,0,0|1,0,1]=4 955 B14R1.14946 COc1cc(CC[NH3+])c(cc1OC)Br 1P01F305 [0,2,0,0,0,0|1,0,1]=4 956 B14R1.14946 N#CCc1cc(OC)c(cc1Br)OC 1P00D8XT [0,2,0,0,0,0|1,0,1]=4 957 B14R1.14946 N#CCc1cc(OC)c(cc1C)OC 1P01CAPE [0,2,0,0,0,0|1,0,1]=4 958 B14R1.14946 NCCc1cc(OC)c(cc1Br)OC 1P00ERAF [0,2,0,0,0,0|1,0,1]=4 959 B14R1.14946 NCCc1cc(OC)c(cc1Br)OC 1P019LMK [0,2,0,0,0,0|1,0,1]=4 960 B14R1.14946 NNCc1cc(OC)c(cc1Br)OC 1P019LHJ [0,2,0,0,0,0|2,0,0]=4 961 B14R1.42 COc1cc(C=CC(=O)O)ccc1O 1P000993 [0,2,0,0,0,0|0,0,1]=3 962 B14R1.42 COc1cc(C=CC(=O)[O-])ccc1O 1P00I54S [0,2,0,0,0,0|0,0,1]=3 963 B14R1.42 COc1cc(CCC(=O)C)ccc1O 1P0016ZV [0,2,0,0,0,0|0,0,1]=3 964 B14R1.42 COc1cc(CCC(=O)O)ccc1Br 1P000S8P [0,2,0,0,0,0|1,0,1]=4 965 B14R1.42 COc1cc(CCC(=O)O)ccc1Cl 1P01A1YX [0,2,0,0,0,0|1,0,1]=4 966 B14R1.42 COc1cc(CCC(=O)O)ccc1F 1P00H250 [0,2,0,0,0,0|1,0,1]=4 967 B14R1.42 COc1cc(CCC(=O)O)ccc1N 1P01B1VC [0,2,0,0,0,0|1,0,1]=4 968 B14R1.42 COc1cc(CCC(=O)O)ccc1O 1P0033X6 [0,2,0,0,0,0|0,0,1]=3 969 B14R1.42 COc1cc(CCC(N)C)ccc1O 1P01EMZ3 [0,2,0,0,0,0|0,0,2]=4 970 B14R1.42 COc1cc(CNC(=O)C)ccc1O 1P00E3ZA [0,2,0,0,0,0|0,0,1]=3 971 B14R1.42 COc1cc(\C=C\C(=O)C)ccc1O 1P003KKK [0,2,0,0,0,0|0,0,1]=3 972 B14R1.42 COc1cc(\C=C\C(=O)N)ccc1O 1P00EHB9 [0,2,0,0,0,0|0,0,1]=3 973 B14R1.42 COc1cc(\C=C\C(=O)O)ccc1Br 1P00IHLJ [0,2,0,0,0,0|1,0,1]=4 974 B14R1.42 COc1cc(\C=C\C(=O)O)ccc1N 1P01DTDP [0,2,0,0,0,0|1,0,1]=4 975 B14R1.42 COc1cc(\C=C\C(=O)O)ccc1O 1P00IA1I [0,2,0,0,0,0|0,0,1]=3 976 B14R1.42 COc1cc(\C=C\C(O)C)ccc1O 1P028J5W [0,2,0,0,0,0|0,0,2]=4 977 B14R1.42 COc1cc(ccc1O)CC[N+](=O)[O-] 1P00D9N9 [0,2,0,0,0,0|1,0,1]=4 978 B14R1.42 COc1cc(ccc1O)\C=C\[N+](=O)[O-] 1P003VEP [0,2,0,0,0,0|1,0,1]=4 979 B14R1.3236 C=CCc1cc(OC)c(c(c1)C=O)O 1P002M1K [0,2,0,0,0,0|0,0,0]=2 980 B14R1.3236 CCCc1cc(OC)c(c(c1)OC)O 1P00FI7U [0,2,0,0,0,0|0,0,2]=4 981 B14R1.3236 COc1cc(CC=C)cc(c1O)OC 1P003L3S [0,2,0,0,0,0|0,0,0]=2 982 B14R1.3236 NCCc1cc(OC)c(c(c1)OC)O 1P007OM7 [0,2,0,0,0,0|1,0,1]=4 983 B14R1.3236 NCCc1cc(OC)c(c(c1)OC)O 1P00BEFQ [0,2,0,0,0,0|1,0,1]=4 984 B14R1.3236 OCCc1cc(OC)c(c(c1)OC)O 1P01BFZ8 [0,2,0,0,0,0|1,0,1]=4 985 B12R2.43 COc1cccc(c1)C2OC2 1P00CLI7 [1,0,0,1,0,0|1,0,1]=4 986 B12R2.44 CNc1ccc2c(c1)[nH]cc2 1P009JF0 [1,0,0,1,0,0|2,0,0]=4 987 B12R2.44 COc1ccc2c(c1)C=CC2 1P00D017 [1,0,0,1,0,0|0,0,2]=4 988 B12R2.44 COc1ccc2c(c1)CC=C2 1P003NAH [1,0,0,1,0,0|0,0,0]=2 989 B12R2.44 COc1ccc2c(c1)CCN2 1P007PH0 [1,0,0,1,0,0|1,0,1]=4 990 B12R2.44 COc1ccc2c(c1)CCN2 1P00DIBL [1,0,0,1,0,0|1,0,1]=4 991 B12R2.44 COc1ccc2c(c1)CNC2 1P000HRY [1,0,0,1,0,0|1,0,1]=4 992 B12R2.44 COc1ccc2c(c1)CNC2 1P000X6X [1,0,0,1,0,0|1,0,1]=4 993 B12R2.44 COc1ccc2c(c1)[nH]cc2 1P0039A6 [1,0,0,1,0,0|1,0,0]=3 994 B12R2.44 COc1ccc2c(c1)[nH]cn2 1P0034R8 [1,0,0,1,0,0|2,0,0]=4 995 B12R2.44 COc1ccc2c(c1)[nH]nc2 1P003NPZ [1,0,0,1,0,0|2,0,0]=4 996 B12R2.44 COc1ccc2c(c1)cc[nH]2 1P0002XM [1,0,0,1,0,0|1,0,1]=4 997 B12R2.44 COc1ccc2c(c1)cco2 1P009ATT [1,0,0,1,0,0|1,0,1]=4 998 B12R2.44 COc1ccc2c(c1)ccs2 1P002AHB [1,0,0,1,0,0|1,0,1]=4 999 B12R2.44 COc1ccc2c(c1)nco2 1P0010VO [1,0,0,1,0,0|2,0,0]=4 1000 B12R2.44 COc1ccc2c(c1)ncs2 1P002YSK [1,0,0,1,0,0|2,0,0]=4 1001 B12R2.44 COc1ccc2c(c1)occ2 1P00DGHZ [1,0,0,1,0,0|1,0,0]=3 1002 B12R2.44 COc1ccc2c(c1)ocn2 1P01KLTK [1,0,0,1,0,0|2,0,0]=4 1003 B12R2.44 COc1ccc2c(c1)scc2 1P006CWS [1,0,0,1,0,0|1,0,0]=3 1004 B12R2.44 COc1ccc2c(c1)scn2 1P002YSL [1,0,0,1,0,0|2,0,0]=4 1005 B12R2.44 COc1ccc2c(c1)snc2 1P001F9M [1,0,0,1,0,0|2,0,0]=4 1006 B12R2.44 COc1ccc2c(n1)[nH]cc2 1P0034TZ [1,0,0,1,0,0|2,0,0]=4 1007 B12R2.44 COc1ccn2c(c1)ncc2 1P00C9K6 [1,0,0,1,0,0|2,0,0]=4 1008 B12R2.44 COc1cnc2c(c1)[nH]cc2 1P000PLU [1,0,0,1,0,0|2,0,0]=4 1009 B12R2.44 COc1ncc2c(c1)[nH]cc2 1P0051AP [1,0,0,1,0,0|2,0,0]=4 1010 B12R2.44 CSc1ccc2c(c1)[nH]cc2 1P0028S7 [1,0,0,1,0,0|1,1,0]=4 1011 B12R2.315 COc1cccc2c1CCC2 1P01V6TQ [1,0,0,1,0,0|0,0,2]=4 1012 B12R2.315 COc1cccc2c1CNC2 1P0095CK [1,0,0,1,0,0|1,0,1]=4 1013 B12R2.315 COc1cccc2c1NCC2 1P00CAJY [1,0,0,1,0,0|1,0,1]=4 1014 B12R2.315 COc1cccc2c1NCC2 1P00DK9Y [1,0,0,1,0,0|1,0,1]=4 1015 B12R2.315 COc1cccc2c1[nH]cc2 1P00I6IA [1,0,0,1,0,0|1,0,1]=4 1016 B12R2.315 COc1cccc2c1[nH]cn2 1P00BT3D [1,0,0,1,0,0|2,0,0]=4 1017 B12R2.315 COc1cccc2c1cc[nH]2 1P003M4F [1,0,0,1,0,0|1,0,0]=3 1018 B12R2.315 COc1cccc2c1ccs2 1P00CAT9 [1,0,0,1,0,0|1,0,0]=3 1019 B12R2.315 COc1cccc2c1cn[nH]2 1P0034JU [1,0,0,1,0,0|2,0,0]=4 1020 B12R2.315 COc1cccc2c1cns2 1P01FLXV [1,0,0,1,0,0|2,0,0]=4 1021 B12R2.315 COc1cccc2c1nco2 1P00AVAC [1,0,0,1,0,0|2,0,0]=4 1022 B12R2.315 COc1cccc2c1ncs2 1P0030QE [1,0,0,1,0,0|2,0,0]=4 1023 B12R2.315 COc1cccc2c1occ2 1P0036FL [1,0,0,1,0,0|1,0,1]=4 1024 B12R2.315 COc1cccc2c1scc2 1P008BKJ [1,0,0,1,0,0|1,0,1]=4 1025 B12R2.315 COc1cccc2c1scn2 1P002YSM [1,0,0,1,0,0|2,0,0]=4 1026 B12R2.315 COc1cccc2n1ccn2 1P00CLTV [1,0,0,1,0,0|2,0,0]=4 1027 B12R2.315 COc1cccn2c1ccn2 1P01B2QC [1,0,0,1,0,0|2,0,0]=4 1028 B12R2.315 COc1ccnc2c1cc[nH]2 1P0017NF [1,0,0,1,0,0|2,0,0]=4 1029 B12R2.315 COc1cncc2c1cc[nH]2 1P003M2Q [1,0,0,1,0,0|2,0,0]=4 1030 B12R2.315 COc1nccc2c1cc[nH]2 1P005XAL [1,0,0,1,0,0|2,0,0]=4 1031 B12R2.315 COc1nccc2c1cco2 1P00ELI1 [1,0,0,1,0,0|2,0,0]=4 1032 B12R2.82 Brc1ccc2c(c1C)cc[nH]2 1P00HX20 [1,0,0,1,0,0|2,0,0]=4 1033 B12R2.82 Cc1ccc2c(c1O)cc[nH]2 1P007RV2 [1,0,0,1,0,0|2,0,0]=4 1034 B12R2.82 Nc1ccc2c(c1C)cc[nH]2 1P007RM1 [1,0,0,1,0,0|2,0,0]=4 1035 B12R2.82 Oc1ccc2c(c1Br)cco2 1P00CKZ9 [1,0,0,1,0,0|2,0,0]=4 1036 B12R2.82 Oc1ccc2c(c1Br)ccs2 1P028EL6 [1,0,0,1,0,0|2,0,0]=4 1037 B12R2.82 Oc1ccc2c(c1C)ocn2 1P028X2Z [1,0,0,1,0,0|2,0,0]=4 1038 B12R2.82 Oc1ccc2c(c1Cl)ccs2 1P028E5K [1,0,0,1,0,0|2,0,0]=4 1039 B12R2.82 Oc1ccc2c(c1F)cc[nH]2 1P002X7R [1,0,0,1,0,0|2,0,0]=4 1040 B12R2.82 Oc1ccc2c(c1N)cc[nH]2 1P028IOA [1,0,0,1,0,0|2,0,0]=4 1041 B12R2.100 Brc1cc2C=CCc2cc1Br 1P01XDPF [1,0,0,1,0,0|2,0,0]=4 1042 B12R2.100 Brc1cc2[nH]ccc2cc1O 1P00I4IF [1,0,0,1,0,0|2,0,0]=4 1043 B12R2.100 Brc1cc2cc[nH]c2cc1C 1P00011M [1,0,0,1,0,0|2,0,0]=4 1044 B12R2.100 Brc1cc2ccoc2cc1C 1P007P0F [1,0,0,1,0,0|2,0,0]=4 1045 B12R2.100 Cc1cc2C=CCc2cc1C 1P00BRV0 [1,0,0,1,0,0|1,0,0]=3 1046 B12R2.100 Cc1cc2[nH]ccc2cc1C 1P00BRVC [1,0,0,1,0,0|2,0,0]=4 1047 B12R2.100 Clc1cc2[nH]ccc2cc1O 1P00B2NZ [1,0,0,1,0,0|2,0,0]=4 1048 B12R2.100 Clc1cc2cc[nH]c2cc1C 1P001T7J [1,0,0,1,0,0|2,0,0]=4 1049 B12R2.100 Fc1cc2C=CCc2cc1F 1P001WAN [1,0,0,1,0,0|2,0,0]=4 1050 B12R2.100 Fc1cc2cc[nH]c2cc1C 1P00011K [1,0,0,1,0,0|2,0,0]=4 1051 B12R2.100 Fc1cc2ccsc2cc1C 1P0285IM [1,0,0,1,0,0|2,0,0]=4 1052 B12R2.100 Oc1cc2CNCc2cc1O 1P01PUEK [1,0,0,1,0,0|1,0,1]=4 1053 B12R2.100 Oc1cc2COCc2cc1O 1P02814Z [1,0,0,1,0,0|1,0,1]=4 1054 B12R2.100 Oc1cc2NCCc2cc1O 1P002Z5D [1,0,0,1,0,0|1,0,1]=4 1055 B12R2.100 Oc1cc2NCCc2cc1O 1P009BTO [1,0,0,1,0,0|1,0,1]=4 1056 B12R2.100 Oc1cc2[nH]ccc2cc1O 1P007I7U [1,0,0,1,0,0|1,0,0]=3 1057 B12R2.100 Oc1cc2cn[nH]c2cc1C 1P003N95 [1,0,0,1,0,0|2,0,0]=4 1058 B14R2.966 FCC(c1ccc2c(c1)OCO2)N 1P027WAV [0,1,0,1,0,0|1,0,1]=4 1059 B14R2.966 FCC(c1ccc2c(c1)OCO2)O 1P02912A [0,1,0,1,0,0|1,0,1]=4 1060 B14R2.966 OC[C@@H](c1ccc2c(c1)OCO2)N 1P01XC59 [0,1,0,1,0,0|1,0,1]=4 1061 B14R2.966 OC[C@H](c1ccc2c(c1)OCO2)C 1P01DZOF [0,1,0,1,0,0|1,0,1]=4 1062 B14R2.1008 CC(=O)Nc1ccc2c(c1)OCO2 1P009DSZ [0,1,0,1,0,0|1,0,1]=4 1063 B14R2.1008 CC(=O)Oc1ccc2c(c1)OCO2 1P00CQ18 [0,1,0,1,0,0|1,0,1]=4 1064 B14R2.1008 CC(Cc1ccc2c(c1)OCO2)O 1P01A79W [0,1,0,1,0,0|0,0,2]=4 1065 B14R2.1008 C[C@@H](Cc1ccc2c(c1)OCO2)O 1P007W9Z [0,1,0,1,0,0|0,0,2]=4 1066 B14R2.1008 C[C@H](Cc1ccc2c(c1)OCO2)O 1P00DC69 [0,1,0,1,0,0|0,0,2]=4 1067 B14R2.1008 ClC(=O)Cc1ccc2c(c1)OCO2 1P00FBIU [0,1,0,1,0,0|1,0,0]=3 1068 B14R2.1008 ClC(=O)Oc1ccc2c(c1)OCO2 1P01FSMM [0,1,0,1,0,0|2,0,0]=4 1069 B14R2.1008 NC(=O)Cc1ccc2c(c1)OCO2 1P01C9L6 [0,1,0,1,0,0|1,0,0]=3 1070 B14R2.1008 NC(=O)Nc1ccc2c(c1)OCO2 1P008V3Z [0,1,0,1,0,0|2,0,0]=4 1071 B14R2.1008 NC(=S)Nc1ccc2c(c1)OCO2 1P00EE7C [0,1,0,1,0,0|2,0,0]=4 1072 B14R2.1008 OC(=O)Cc1ccc2c(c1)CCO2 1P003FZS [0,1,0,1,0,0|2,0,0]=4 1073 B14R2.1008 OC(=O)Cc1ccc2c(c1)OCC2 1P007Z54 [0,1,0,1,0,0|2,0,0]=4 1074 B14R2.1008 OC(=O)Cc1ccc2c(c1)OCO2 1P002WC3 [0,1,0,1,0,0|1,0,0]=3 1075 B14R2.1197 COc1cc2CC(Oc2cc1O)C 1P028Y15 [0,1,0,1,0,0|0,0,2]=4 1076 B14R2.3168 COc1cc(ccc1O)CC2CC2 1P00I97A [0,1,0,1,0,0|0,0,2]=4 1077 B14R2.3809 COc1c(F)ccc2c1NC(=O)C2 1P0291J7 [0,1,0,1,0,0|2,0,0]=4 1078 B14R2.112 BrCCc1ccc2c(c1)OCCO2 1P01A6AE [0,1,0,1,0,0|1,0,1]=4 1079 B14R2.112 CNCc1ccc2c(c1)OCCO2 1P00EJCU [0,1,0,1,0,0|1,0,1]=4 1080 B14R2.112 CNCc1ccc2c(c1)OCCO2 1P00IE1U [0,1,0,1,0,0|1,0,1]=4 1081 B14R2.112 N#CCc1ccc2c(c1)OCCO2 1P007DHN [0,1,0,1,0,0|1,0,1]=4 1082 B14R2.112 NCCc1ccc2c(c1)OCCO2 1P007EWL [0,1,0,1,0,0|1,0,1]=4 1083 B14R2.112 O=COc1ccc2c(c1)OCCO2 1P00GCOH [0,1,0,1,0,0|2,0,0]=4 1084 B14R2.112 OCCc1ccc2c(c1)OCCO2 1P000XAH [0,1,0,1,0,0|1,0,1]=4 1085 B14R2.583 CNCc1cc2OCOc2cc1Br 1P027W69 [0,1,0,1,0,0|1,0,1]=4 1086 B14R2.583 N#CCc1cc2OCOc2cc1Br 1P00DRB4 [0,1,0,1,0,0|1,0,1]=4 1087 B14R2.583 N#CCc1cc2OCOc2cc1O 1P028VNW [0,1,0,1,0,0|1,0,1]=4 1088 B14R2.583 NCCc1cc2OCOc2cc1Br 1P01RYQ0 [0,1,0,1,0,0|1,0,1]=4 1089 B14R2.583 NNCc1cc2OCOc2cc1Br 1P019LHK [0,1,0,1,0,0|2,0,0]=4 1090 B14R2.82 COc1cc2CNCc2cc1OC 1P000ATV [0,1,0,1,0,0|1,0,1]=4 1091 B14R2.82 COc1cc2CNCc2cc1OC 1P000ATW [0,1,0,1,0,0|1,0,1]=4 1092 B14R2.82 COc1cc2NCCc2cc1OC 1P001R4B [0,1,0,1,0,0|1,0,1]=4 1093 B14R2.82 COc1cc2[nH]ccc2cc1OC 1P001JR0 [0,1,0,1,0,0|1,0,0]=3 1094 B14R2.82 COc1cc2[nH]cnc2cc1OC 1P003MQT [0,1,0,1,0,0|2,0,0]=4 1095 B14R2.82 COc1cc2[nH]ncc2cc1OC 1P005BJO [0,1,0,1,0,0|2,0,0]=4 1096 B14R2.82 COc1cc2nocc2cc1OC 1P001LEV [0,1,0,1,0,0|2,0,0]=4 1097 B14R2.82 COc1cc2sccc2cc1OC 1P006EL4 [0,1,0,1,0,0|1,0,0]=3 1098 B14R2.82 COc1cc2scnc2cc1OC 1P00ED10 [0,1,0,1,0,0|2,0,0]=4 1099 B14R2.1238 COc1c(C=O)ccc2c1cc[nH]2 1P028NHO [0,1,0,1,0,0|1,0,1]=4 1100 B14R2.1238 COc1c(CO)ccc2c1ccs2 1P02820K [0,1,0,1,0,0|1,0,0]=3 1101 B14R2.1238 COc1c(OC)ccc2c1[nH]cc2 1P00C4D2 [0,1,0,1,0,0|1,0,1]=4 1102 B14R2.1238 COc1c(OC)ccc2c1cc[nH]2 1P00325Q [0,1,0,1,0,0|1,0,0]=3 1103 B14R2.203 COc1c(Br)ccc2c1cccc2 1P00EAZE [0,1,0,1,0,0|1,0,1]=4 1104 B14R2.203 COc1c(Br)ccc2c1cccn2 1P01JX64 [0,1,0,1,0,0|1,0,1]=4 1105 B14R2.203 COc1c(Br)ccc2c1cncc2 1P028LEA [0,1,0,1,0,0|1,0,1]=4 1106 B14R2.203 COc1c(Br)ccc2c1nccc2 1P00I7QL [0,1,0,1,0,0|1,0,1]=4 1107 B14R2.203 COc1c(C)ccc2c1cccc2 1P001G4Q [0,1,0,1,0,0|1,0,1]=4 1108 B14R2.203 COc1c(N)ccc2c1cccn2 1P00E4SM [0,1,0,1,0,0|1,0,1]=4 1109 B14R2.203 COc1c(O)ccc2c1cccc2 1P00AKZX [0,1,0,1,0,0|0,0,1]=3 1110 B14R2.991 BrCCOc1ccc2c(c1)OCO2 1P01BKMT [0,1,0,1,0,0|1,0,1]=4 1111 B14R2.991 CCCCc1ccc2c(c1)OCO2 1P00ACRT [0,1,0,1,0,0|0,0,2]=4 1112 B14R2.991 CCNCc1ccc2c(c1)OCO2 1P006MFX [0,1,0,1,0,0|0,0,2]=4 1113 B14R2.991 CNCCc1ccc2c(c1)OCO2 1P00DBYF [0,1,0,1,0,0|0,0,2]=4 1114 B14R2.991 CNCCc1ccc2c(c1)OCO2 1P01BIYS [0,1,0,1,0,0|0,0,2]=4 1115 B14R2.991 CNNCc1ccc2c(c1)OCO2 1P00HVZD [0,1,0,1,0,0|1,0,1]=4 1116 B14R2.991 COCOc1ccc2c(c1)OCO2 1P007SUM [0,1,0,1,0,0|1,0,1]=4 1117 B14R2.991 N#CCOc1ccc2c(c1)OCO2 1P005Z9F [0,1,0,1,0,0|1,0,1]=4 1118 B14R2.991 NCCOc1ccc2c(c1)OCO2 1P005NLE [0,1,0,1,0,0|1,0,1]=4 1119 B14R2.991 NCCOc1ccc2c(c1)OCO2 1P009L1R [0,1,0,1,0,0|1,0,1]=4 1120 B14R2.991 O=C=NCc1ccc2c(c1)OCO2 1P005KPS [0,1,0,1,0,0|1,0,1]=4 1121 B14R2.991 O=CCCc1ccc2c(c1)CCO2 1P01ADOE [0,1,0,1,0,0|1,0,1]=4 1122 B14R2.991 O=C\C=C\c1ccc2c(c1)OCO2 1P01EMQF [0,1,0,1,0,0|0,0,1]=3 1123 B14R2.991 OCCCc1ccc2c(c1)OCO2 1P005KCM [0,1,0,1,0,0|0,0,2]=4 1124 B14R2.991 OCCNc1ccc2c(c1)OCO2 1P006QPY [0,1,0,1,0,0|1,0,1]=4 1125 B14R2.991 OC\C=C\c1ccc2c(c1)OCO2 1P00EM82 [0,1,0,1,0,0|0,0,2]=4 1126 B14R2.991 S=C=NCc1ccc2c(c1)OCO2 1P003IUP [0,1,0,1,0,0|1,0,1]=4 1127 B14R2.991 [N-]=[N+]=NCc1ccc2c(c1)OCO2 1P00BN4J [0,1,0,1,0,0|2,0,0]=4 1128 B14R2.1128 COc1cc2CCCCc2cc1O 1P028C9S [0,1,0,1,0,0|0,0,2]=4 1129 B14R2.1128 COc1cc2CCN=Cc2cc1O 1P003NW9 [0,1,0,1,0,0|0,0,1]=3 1130 B14R2.1128 COc1cc2CCNCc2cc1O 1P00048F [0,1,0,1,0,0|0,0,2]=4 1131 B14R2.1128 COc1cc2CNCCc2cc1O 1P008USM [0,1,0,1,0,0|0,0,2]=4 1132 B14R2.1128 COc1cc2ccccc2cc1Br 1P003H3N [0,1,0,1,0,0|1,0,1]=4 1133 B14R2.1128 COc1cc2ccccc2cc1N 1P00FEX2 [0,1,0,1,0,0|1,0,1]=4 1134 B14R2.1128 COc1cc2ccccc2cc1O 1P003K3E [0,1,0,1,0,0|0,0,1]=3 1135 B14R2.1128 COc1cc2cccnc2cc1Br 1P01K2CQ [0,1,0,1,0,0|1,0,1]=4 1136 B14R2.1128 COc1cc2cccnc2cc1C 1P00E75V [0,1,0,1,0,0|1,0,1]=4 1137 B14R2.1128 COc1cc2cccnc2cc1F 1P00IFXL [0,1,0,1,0,0|1,0,1]=4 1138 B14R2.1128 COc1cc2ccncc2cc1Br 1P01IWQ9 [0,1,0,1,0,0|1,0,1]=4 1139 B14R2.1128 COc1cc2ccncc2cc1O 1P00230D [0,1,0,1,0,0|0,0,1]=3 1140 B14R2.1128 COc1cc2cnccc2cc1Br 1P027TZH [0,1,0,1,0,0|1,0,1]=4 1141 B14R2.1128 COc1cc2cnccc2cc1Cl 1P028J1F [0,1,0,1,0,0|1,0,1]=4 1142 B14R2.1128 COc1cc2ncccc2cc1Br 1P00ATWQ [0,1,0,1,0,0|1,0,1]=4 1143 B14R2.1128 COc1cc2ncccc2cc1C 1P003NWU [0,1,0,1,0,0|1,0,1]=4 1144 B14R2.1128 COc1cc2ncccc2cc1N 1P00A1YY [0,1,0,1,0,0|1,0,1]=4 1145 B14R2.1416 COc1cc2CCC(=O)c2cc1Br 1P00FI0K [0,1,0,1,0,0|1,0,1]=4 1146 B14R2.1416 COc1cc2CCC(=O)c2cc1Cl 1P003NMR [0,1,0,1,0,0|1,0,1]=4 1147 B14R2.1416 COc1cc2CCC(=O)c2cc1F 1P002Z8Z [0,1,0,1,0,0|1,0,1]=4 1148 B14R2.1416 COc1cc2CCC(=O)c2cc1O 1P00GXMU [0,1,0,1,0,0|0,0,1]=3 1149 B14R2.808 NCCc1ccc2c(c1O)OCO2 1P028GYQ [0,1,0,1,0,0|1,0,1]=4 1150 B14R2.587 N#CCc1cc(Br)c2c(c1)OCO2 1P019XUD [0,1,0,1,0,0|1,0,1]=4 1151 B14R2.587 N#CCc1cc(Cl)c2c(c1)OCO2 1P028WDG [0,1,0,1,0,0|1,0,1]=4 1152 B14R2.587 NCCc1cc(Cl)c2c(c1)OCO2 1P028BGU [0,1,0,1,0,0|1,0,1]=4 1153 B14R3.3046 N1Cc2c(C1)c3OCOc3cc2 1P01ENK1 [0,0,0,2,0,0|1,0,1]=4 1154 B14R3.3015 C1Oc2c(O1)cc(cc2)C3CO3 1P019VSO [0,0,0,2,0,0|1,0,1]=4 1155 B14R3.3022 C1Oc2c(O1)cc3c(c2)CNC3 1P000O9A [0,0,0,2,0,0|1,0,1]=4 1156 B14R3.3022 C1Oc2c(O1)cc3c(c2)[nH]cc3 1P007L7E [0,0,0,2,0,0|1,0,0]=3