0 B15R2.33 BrC1=C(C=C(C=C1)Cl)C2=CC=CC=C2 1P01JJFJ [0,0,0,0,0,0|3,0,0]=3 1 B15R2.33 Brc1ccc(c(c1)c2ccccc2)N 1P00DLGI [0,0,0,0,0,0|3,0,0]=3 2 B15R2.33 Cc1ccc(=O)n(c1)c2ccccc2 1P0035YH [0,0,0,0,0,0|0,0,0]=0 3 B15R2.33 Cc1ccc(c(c1)c2ccccc2)I 1P027XRX [0,0,0,0,0,0|2,0,0]=2 4 B15R2.33 Cc1ccc(c(c1)c2ccccc2)N 1P00D7P9 [0,0,0,0,0,0|2,0,0]=2 5 B15R2.33 Clc1ccc(=O)n(n1)c2ccccc2 1P00JBSF [0,0,0,0,0,0|2,0,0]=2 6 B15R2.33 Clc1ccc(c(c1)c2ccccc2)N 1P005Z82 [0,0,0,0,0,0|3,0,0]=3 7 B15R2.33 Clc1ccc(c(c1)c2cccnc2)O 1P01ANJD [0,0,0,0,0,0|3,0,1]=4 8 B15R2.33 Cn1ccc(=O)c(c1)c2ccccc2 1P0285PL [0,0,0,0,0,0|2,0,0]=2 9 B15R2.33 Ic1ccc(c(c1)c2ccccc2)O 1P01B9NS [0,0,0,0,0,0|2,0,1]=3 10 B15R2.33 Nc1ccc(=O)n(c1)c2ccccc2 1P028DW4 [0,0,0,0,0,0|1,0,0]=1 11 B15R2.33 Nc1ccc(c(c1)c2ccccc2)Br 1P0085XC [0,0,0,0,0,0|3,0,0]=3 12 B15R2.33 Nc1ccc(c(c1)c2ccccc2)C 1P0289C4 [0,0,0,0,0,0|3,0,0]=3 13 B15R2.33 Nc1ccc(c(c1)c2ccccc2)Cl 1P00EKHG [0,0,0,0,0,0|3,0,0]=3 14 B15R2.33 Nc1ccc(c(c1)c2ccccc2)F 1P007FP0 [0,0,0,0,0,0|3,0,0]=3 15 B15R2.33 Nc1ccc(c(c1)c2ccccc2)F 1P020LWN [0,0,0,0,0,0|3,0,0]=3 16 B15R2.33 Nc1ccc(c(c1)c2ccccc2)O 1P007S4L [0,0,0,0,0,0|2,0,1]=3 17 B15R2.33 Nc1ccc(c(c1)c2ccccn2)Cl 1P00H3FS [0,0,0,0,0,0|4,0,0]=4 18 B15R2.33 Nc1ccc(c(c1)c2ccncc2)F 1P01G5I3 [0,0,0,0,0,0|4,0,0]=4 19 B15R2.33 O=C1C=CC(=O)C=C1c2ccccc2 1P00BYRB [0,0,0,0,0,0|2,0,0]=2 20 B15R2.33 O=C1CCC(=NN1c2ccccc2)C 1P006Z98 [0,0,0,0,0,0|1,0,2]=3 21 B15R2.33 O=C1CCC(=O)NN1c2ccccc2 1P01IUQU [0,0,0,0,0,0|2,0,2]=4 22 B15R2.33 Oc1ccc(=O)n(n1)c2ccccc2 1P00AOXE [0,0,0,0,0,0|2,0,0]=2 23 B15R2.33 Oc1ccc(c(c1)c2ccccc2)O 1P003IC7 [0,0,0,0,0,0|2,0,1]=3 24 B14R2.21 Brc1cccc(c1)c2ccccc2 1P002LQM [1,0,0,0,0,0|2,0,0]=3 25 B14R2.21 Brc1cccc(c1)c2ccccn2 1P00D9LP [1,0,0,0,0,0|3,0,0]=4 26 B14R2.21 Brc1cccc(c1)c2cccnc2 1P003IIT [1,0,0,0,0,0|3,0,0]=4 27 B14R2.21 Brc1cccc(c1)c2ccncc2 1P00DGWH [1,0,0,0,0,0|3,0,0]=4 28 B14R2.21 Brc1cccc(n1)c2ccccc2 1P003988 [1,0,0,0,0,0|3,0,0]=4 29 B14R2.21 Brc1ccnc(c1)c2ccccc2 1P00374X [1,0,0,0,0,0|3,0,0]=4 30 B14R2.21 Brc1cncc(c1)c2ccccc2 1P007KQJ [1,0,0,0,0,0|3,0,0]=4 31 B14R2.21 Brc1nccc(c1)c2ccccc2 1P00DEIN [1,0,0,0,0,0|3,0,0]=4 32 B14R2.21 C[n+]1cccc(c1)c2ccccc2 1P01EUQK [1,0,0,0,0,0|2,0,0]=3 33 B14R2.21 Cc1cccc(c1)c2ccccc2 1P003KCN [1,0,0,0,0,0|1,0,0]=2 34 B14R2.21 Cc1cccc(c1)c2ccccn2 1P00DKXB [1,0,0,0,0,0|2,0,0]=3 35 B14R2.21 Cc1cccc(n1)c2ccccc2 1P003I4V [1,0,0,0,0,0|2,0,0]=3 36 B14R2.21 Cc1cccc(n1)c2ccccn2 1P00DGWA [1,0,0,0,0,0|3,0,0]=4 37 B14R2.21 Cc1cccc(n1)c2cccnc2 1P00555R [1,0,0,0,0,0|3,0,0]=4 38 B14R2.21 Cc1ccnc(c1)c2ccccc2 1P00I7C7 [1,0,0,0,0,0|2,0,0]=3 39 B14R2.21 Cc1ccnc(c1)c2ccccn2 1P00DGGC [1,0,0,0,0,0|3,0,0]=4 40 B14R2.21 Cc1cncc(c1)c2ccccc2 1P003K6Z [1,0,0,0,0,0|2,0,0]=3 41 B14R2.21 Cc1nccc(c1)c2ccccc2 1P001MZP [1,0,0,0,0,0|2,0,0]=3 42 B14R2.21 Cc1nccc(n1)c2ccccc2 1P00C4CW [1,0,0,0,0,0|3,0,0]=4 43 B14R2.21 Clc1cccc(n1)c2ccccc2 1P007NBS [1,0,0,0,0,0|3,0,0]=4 44 B14R2.21 Clc1ccnc(c1)c2ccccc2 1P00EGAV [1,0,0,0,0,0|3,0,0]=4 45 B14R2.21 Clc1nccc(c1)c2ccccc2 1P00CBIQ [1,0,0,0,0,0|3,0,0]=4 46 B14R2.21 Fc1cccc(c1)c2ccccc2 1P002OK5 [1,0,0,0,0,0|2,0,0]=3 47 B14R2.21 Ic1cccc(c1)c2ccccc2 1P00381I [1,0,0,0,0,0|2,0,0]=3 48 B14R2.21 Ic1cccc(c1)c2ccncc2 1P028RVM [1,0,0,0,0,0|3,0,0]=4 49 B14R2.21 Nc1cccc(c1)c2ccccc2 1P002LQO [1,0,0,0,0,0|2,0,0]=3 50 B14R2.21 Nc1cccc(c1)c2ccccc2 1P003JE1 [1,0,0,0,0,0|2,0,0]=3 51 B14R2.21 Nc1cccc(c1)c2ccccn2 1P000E5K [1,0,0,0,0,0|3,0,0]=4 52 B14R2.21 Nc1cccc(c1)c2ccccn2 1P001RG0 [1,0,0,0,0,0|3,0,0]=4 53 B14R2.21 Nc1cccc(c1)c2cccnc2 1P000L8A [1,0,0,0,0,0|3,0,0]=4 54 B14R2.21 Nc1cccc(c1)c2cccnc2 1P003IJA [1,0,0,0,0,0|3,0,0]=4 55 B14R2.21 Nc1cccc(c1)c2cccnc2 1P00E96V [1,0,0,0,0,0|3,0,0]=4 56 B14R2.21 Nc1cccc(c1)c2ccncc2 1P00BZY5 [1,0,0,0,0,0|3,0,0]=4 57 B14R2.21 Nc1cccc(n1)c2ccccc2 1P00BZC2 [1,0,0,0,0,0|3,0,0]=4 58 B14R2.21 Nc1ccnc(c1)c2ccccc2 1P00389S [1,0,0,0,0,0|3,0,0]=4 59 B14R2.21 Nc1cncc(c1)c2ccccc2 1P00BZDC [1,0,0,0,0,0|3,0,0]=4 60 B14R2.21 Nc1nccc(c1)c2ccccc2 1P00IB7M [1,0,0,0,0,0|3,0,0]=4 61 B14R2.21 O=c1[nH]ccc(c1)c2ccccc2 1P002EQP [1,0,0,0,0,0|3,0,0]=4 62 B14R2.21 O=c1cccc([nH]1)c2ccccc2 1P002EQO [1,0,0,0,0,0|3,0,0]=4 63 B14R2.21 Oc1ccc[n+](c1)c2ccccc2 1P007X0Z [1,0,0,0,0,0|1,0,1]=3 64 B14R2.21 Oc1cccc(c1)c2ccccc2 1P003KCF [1,0,0,0,0,0|2,0,0]=3 65 B14R2.21 Oc1cccc(c1)c2ccccn2 1P006AEE [1,0,0,0,0,0|3,0,0]=4 66 B14R2.21 Oc1cccc(c1)c2ccncc2 1P01ANJR [1,0,0,0,0,0|3,0,0]=4 67 B14R2.21 Oc1cncc(c1)c2ccccc2 1P007J8B [1,0,0,0,0,0|3,0,0]=4 68 B14R2.24 Brc1ccccc1c2ccccc2 1P002AEL [1,0,0,0,0,0|2,0,0]=3 69 B14R2.24 Brc1ccccc1c2ccccn2 1P008RTW [1,0,0,0,0,0|3,0,0]=4 70 B14R2.24 Brc1ccccc1c2ccncc2 1P0092IO [1,0,0,0,0,0|3,0,0]=4 71 B14R2.24 Brc1cccnc1c2ccccc2 1P003JHH [1,0,0,0,0,0|3,0,0]=4 72 B14R2.24 Brc1ccncc1c2ccccc2 1P00DA2W [1,0,0,0,0,0|3,0,0]=4 73 B14R2.24 Brc1cnccc1c2ccccc2 1P0089W2 [1,0,0,0,0,0|3,0,0]=4 74 B14R2.24 Brc1ncccc1c2ccccc2 1P00C0O0 [1,0,0,0,0,0|3,0,0]=4 75 B14R2.24 Cc1ccccc1c2ccccc2 1P003ICO [1,0,0,0,0,0|2,0,0]=3 76 B14R2.24 Cc1ccccc1c2ccccn2 1P0008P0 [1,0,0,0,0,0|3,0,0]=4 77 B14R2.24 Cc1cccnc1c2ccccc2 1P0008OZ [1,0,0,0,0,0|3,0,0]=4 78 B14R2.24 Cc1ccncc1c2ccccc2 1P007RF0 [1,0,0,0,0,0|3,0,0]=4 79 B14R2.24 Clc1ccccc1c2ccccc2 1P002ABM [1,0,0,0,0,0|2,0,0]=3 80 B14R2.24 Fc1ccccc1c2ccccc2 1P003HSE [1,0,0,0,0,0|2,0,0]=3 81 B14R2.24 Fc1ccccc1c2ccccn2 1P003YLA [1,0,0,0,0,0|3,0,0]=4 82 B14R2.24 Ic1ccccc1c2ccccc2 1P002LQQ [1,0,0,0,0,0|2,0,0]=3 83 B14R2.24 Nc1ccccc1c2ccccc2 1P0033KT [1,0,0,0,0,0|2,0,0]=3 84 B14R2.24 Nc1ccccc1c2ccccc2 1P003GZV [1,0,0,0,0,0|2,0,0]=3 85 B14R2.24 Nc1ccccc1c2ccccn2 1P002Z3M [1,0,0,0,0,0|3,0,0]=4 86 B14R2.24 Nc1ccccc1c2cccnc2 1P0025N5 [1,0,0,0,0,0|3,0,0]=4 87 B14R2.24 Nc1ccccc1c2ccncc2 1P008SBI [1,0,0,0,0,0|3,0,0]=4 88 B14R2.24 Nc1cccnc1c2ccccc2 1P0005FF [1,0,0,0,0,0|3,0,0]=4 89 B14R2.24 Nc1cccnc1c2ccccc2 1P006Z2I [1,0,0,0,0,0|3,0,0]=4 90 B14R2.24 Nc1ccncc1c2ccccc2 1P0095X3 [1,0,0,0,0,0|3,0,0]=4 91 B14R2.24 Nc1cnccc1c2ccccc2 1P001E79 [1,0,0,0,0,0|3,0,0]=4 92 B14R2.24 Nc1cnccc1c2ccccc2 1P01BEMD [1,0,0,0,0,0|3,0,0]=4 93 B14R2.24 Nc1ncccc1c2ccccc2 1P004UGB [1,0,0,0,0,0|3,0,0]=4 94 B14R2.24 O=c1[nH]ccnc1c2ccccc2 1P002X4B [1,0,0,0,0,0|3,0,0]=4 95 B14R2.24 O=c1cccnn1c2ccccc2 1P001GQO [1,0,0,0,0,0|1,0,0]=2 96 B14R2.24 Oc1ccccc1c2ccccn2 1P00CBFH [1,0,0,0,0,0|2,0,1]=4 97 B14R2.24 Oc1ccccc1c2ccncc2 1P00VVCQ [1,0,0,0,0,0|2,0,1]=4 98 B14R2.24 Oc1cccnc1c2ccccc2 1P00BYA3 [1,0,0,0,0,0|2,0,1]=4 99 B14R2.24 Oc1cnccc1c2ccccc2 1P0006F0 [1,0,0,0,0,0|2,0,1]=4 100 B14R2.24 Oc1ncccc1c2ccccc2 1P007OJK [1,0,0,0,0,0|2,0,1]=4 101 B14R2.24 Sc1ccccc1c2ccccc2 1P00BG0O [1,0,0,0,0,0|1,1,0]=3 102 B14R2.24 [O-][n+]1ccccc1c2ccccc2 1P008YC3 [1,0,0,0,0,0|2,0,1]=4 103 B16R2.27 COc1ccc(c(c1)c2ccccc2)N 1P020DXR [0,1,0,0,0,0|2,0,0]=3 104 B16R2.27 OCc1ccc(c(c1)c2ccncc2)F 1P028ORS [0,1,0,0,0,0|3,0,0]=4 105 B16R2.314 CC1CNC(=O)N(C1=O)c2ccccc2 1P01AHNG [0,1,0,0,0,0|1,0,2]=4 106 B16R2.2443 COc1ccc(cc1c2ccccc2)N 1P00IHGN [0,1,0,0,0,0|2,0,1]=4 107 B16R2.2443 NCc1ccc(cc1c2ccccc2)F 1P01KKG6 [0,1,0,0,0,0|3,0,0]=4 108 B16R2.2859 Cc1ccc(cc1)n2cc(Cl)ccc2=O 1P01C45L [0,1,0,0,0,0|1,0,0]=2 109 B16R2.2859 Clc1ccc(cc1)c2cc(Cl)ccc2N 1P01BGZL [0,1,0,0,0,0|3,0,0]=4 110 B16R2.2859 Clc1ccc(cc1)c2cc(F)ccc2N 1P01AB0S [0,1,0,0,0,0|3,0,0]=4 111 B16R2.2859 Fc1ccc(cc1)c2cc(F)ccc2N 1P01AB0T [0,1,0,0,0,0|3,0,0]=4 112 B16R2.2859 Fc1ccc(cc1)c2cc(I)ccc2Br 1P029373 [0,1,0,0,0,0|3,0,0]=4 113 B16R2.2859 Oc1ccc(cc1)n2cc(C)ccc2=O 1P00G5QH [0,1,0,0,0,0|0,0,0]=1 114 B16R2.2911 Cc1cccc(c1)c2cc(Cl)ccc2N 1P01BHX1 [0,1,0,0,0,0|3,0,0]=4 115 B16R2.2911 Clc1ccc(c(c1)c2cccc(c2)Cl)N 1P01BG8M [0,1,0,0,0,0|3,0,0]=4 116 B16R2.2911 Fc1cccc(c1)n2cc(C)ccc2=O 1P004XJE [0,1,0,0,0,0|0,0,0]=1 117 B16R2.2996 Cc1ccc(c(c1)c2ccccc2F)N 1P02899F [0,1,0,0,0,0|2,0,0]=3 118 B16R2.2996 Clc1ccc(c(c1)c2ccccc2Cl)N 1P01BG8G [0,1,0,0,0,0|3,0,0]=4 119 B16R2.2996 Clc1ccc(c(c1)c2ccccc2N)Cl 1P028RBS [0,1,0,0,0,0|3,0,0]=4 120 B16R2.2996 Oc1ccc(c(c1)c2ccccc2Cl)O 1P00311C [0,1,0,0,0,0|2,0,1]=4 121 B16R2.6164 Clc1cc(N)c(=O)n(n1)c2ccccc2 1P00IENK [0,1,0,0,0,0|2,0,0]=3 122 B16R2.6164 Fc1cc(F)c(c(c1)c2ccccc2)N 1P019WTG [0,1,0,0,0,0|3,0,0]=4 123 B14R1.423 O=C(Nc1ccccc1)\C=C/C(=O)O 1P00D8Z5 [0,0,1,0,0,0|2,0,0]=3 124 B16R3.2583 Brc1ccc2c(c1)c3ccccc3C2 1P01BO7Y [0,0,0,1,0,0|3,0,0]=4 125 B16R3.2583 Brc1ccc2c(c1)c3ccccc3[nH]2 1P001R0Z [0,0,0,1,0,0|3,0,0]=4 126 B16R3.2583 Brc1ccc2c(c1)c3ccccc3o2 1P0033MY [0,0,0,1,0,0|2,0,1]=4 127 B16R3.2583 Brc1ccc2c(c1)c3ccccc3s2 1P003899 [0,0,0,1,0,0|2,1,0]=4 128 B16R3.2583 Brc1cnc2n(c1)c3ccccc3n2 1P0001CY [0,0,0,1,0,0|3,0,0]=4 129 B16R3.2583 Cc1ccc2c(c1)c3ccccc3[nH]2 1P00738P [0,0,0,1,0,0|2,0,0]=3 130 B16R3.2583 Clc1ccc2c(c1)c3ccccc3[nH]2 1P007LNK [0,0,0,1,0,0|3,0,0]=4 131 B16R3.2583 Clc1ccc2c(c1)c3ccccc3o2 1P00DF8W [0,0,0,1,0,0|2,0,1]=4 132 B16R3.2583 Fc1ccc2c(c1)c3ccccc3[nH]2 1P00CM42 [0,0,0,1,0,0|3,0,0]=4 133 B16R3.2583 Ic1ccc2c(c1)c3ccccc3[nH]2 1P001Y8J [0,0,0,1,0,0|3,0,0]=4 134 B16R3.2583 Ic1ccc2c(c1)c3ccccc3o2 1P00DK09 [0,0,0,1,0,0|2,0,1]=4 135 B16R3.2583 Ic1ccc2c(c1)c3ccccc3s2 1P00AL3I [0,0,0,1,0,0|2,1,0]=4 136 B16R3.2583 Nc1ccc2c(c1)c3ccccc3[nH]2 1P00EFXR [0,0,0,1,0,0|3,0,0]=4 137 B16R3.2583 Nc1ccc2c(c1)c3ccccc3o2 1P007836 [0,0,0,1,0,0|2,0,1]=4 138 B16R3.2583 Nc1ccc2c(c1)c3ccccc3s2 1P005YMX [0,0,0,1,0,0|2,1,0]=4 139 B16R3.2583 Oc1ccc2c(c1)c3ccccc3[nH]2 1P00FE53 [0,0,0,1,0,0|3,0,0]=4 140 B16R3.2583 Oc1ccc2c(c1)c3ccccc3o2 1P008FHA [0,0,0,1,0,0|2,0,1]=4 141 B14R2.277 Cc1c[nH]c(=O)n1c2ccccc2 1P019XNV [0,0,0,0,1,0|1,0,0]=2 142 B14R2.277 Cc1ccc(n1[n+]2ccccc2)C 1P01EXUR [0,0,0,0,1,0|2,0,0]=3 143 B14R2.277 Cc1ccc(n1c2ccccc2)C 1P003GG0 [0,0,0,0,1,0|1,0,0]=2 144 B14R2.277 Cc1ccc(n1c2ccccn2)C 1P00CLI6 [0,0,0,0,1,0|2,0,0]=3 145 B14R2.277 Cc1n[nH]c(=O)n1c2ccccc2 1P0003X3 [0,0,0,0,1,0|2,0,0]=3 146 B14R2.277 Cc1nnc(n1c2ccccc2)Cl 1P019N41 [0,0,0,0,1,0|3,0,0]=4 147 B14R2.277 Cc1nnc(n1c2ccccc2)S 1P00EHP9 [0,0,0,0,1,0|2,1,0]=4 148 B14R2.277 O=C1C=CC(=O)N1c2ccccc2 1P003TS1 [0,0,0,0,1,0|1,0,0]=2 149 B14R2.277 O=C1C=CC(=O)N1c2nccnc2 1P01AH3K [0,0,0,0,1,0|3,0,0]=4 150 B14R2.277 O=C1CCC(=O)N1c2ccccc2 1P003F3J [0,0,0,0,1,0|1,0,2]=4 151 B14R2.277 O=C1CNC(=S)N1c2ccccc2 1P002DLV [0,0,0,0,1,0|2,0,1]=4 152 B14R2.277 O=C1CSC(=[Se])N1c2ccccc2 1P00GUZ8 [0,0,0,0,1,0|2,0,1]=4 153 B14R2.277 O=C1N=NC(=O)N1c2ccccc2 1P0034LJ [0,0,0,0,1,0|3,0,0]=4 154 B14R2.277 O=C1NCC(=O)N1c2ccccc2 1P00BCQB [0,0,0,0,1,0|2,0,1]=4 155 B14R2.277 O=c1[nH][nH]c(=O)n1c2ccccc2 1P001RYL [0,0,0,0,1,0|3,0,0]=4 156 B14R2.598 Brc1nc(nn1c2ccccc2)C 1P02900V [0,0,0,0,1,0|3,0,0]=4 157 B14R2.598 Cc1[nH]n(c(=O)c1)c2ccccc2 1P002B8M [0,0,0,0,1,0|1,0,0]=2 158 B14R2.598 Cc1cc([nH]c1c2ccccc2)C 1P0289KK [0,0,0,0,1,0|3,0,0]=4 159 B14R2.598 Cc1cc(c(s1)c2ccccc2)C 1P003GAU [0,0,0,0,1,0|3,0,0]=4 160 B14R2.598 Cc1cn(c(=O)[nH]1)c2ccccc2 1P01EI9H [0,0,0,0,1,0|1,0,0]=2 161 B14R2.598 Cc1nn(c(c1)Br)c2ccccc2 1P00BYCH [0,0,0,0,1,0|2,0,0]=3 162 B14R2.598 Cc1nn(c(c1)C)c2ccccc2 1P003J54 [0,0,0,0,1,0|2,0,0]=3 163 B14R2.598 Cc1nn(c(c1)C)c2ccccn2 1P002L35 [0,0,0,0,1,0|3,0,0]=4 164 B14R2.598 Cc1nn(c(c1)Cl)c2ccccc2 1P003N4O [0,0,0,0,1,0|2,0,0]=3 165 B14R2.598 Cc1nn(c(c1)N)c2ccccc2 1P003MUI [0,0,0,0,1,0|2,0,0]=3 166 B14R2.598 Cc1nn(c(c1)N)c2ccccc2 1P019WVI [0,0,0,0,1,0|2,0,0]=3 167 B14R2.598 Cc1nn(c(c1)N)c2ccccc2 1P01ABWW [0,0,0,0,1,0|2,0,0]=3 168 B14R2.598 Cc1nn(c(c1)N)c2ccccn2 1P00ADAO [0,0,0,0,1,0|3,0,0]=4 169 B14R2.598 Cc1nn(c(c1)N)c2ccncc2 1P019T9Y [0,0,0,0,1,0|3,0,0]=4 170 B14R2.598 Cc1nn(c(c1)O)c2ccccc2 1P00GWEK [0,0,0,0,1,0|1,0,1]=3 171 B14R2.598 Clc1nc(nn1c2ccccc2)C 1P01ZYCX [0,0,0,0,1,0|3,0,0]=4 172 B14R2.598 Nc1[nH]n(c(=O)c1)c2ccccc2 1P002WNV [0,0,0,0,1,0|2,0,0]=3 173 B14R2.598 Nc1nc(nn1c2ccccc2)C 1P019ZBA [0,0,0,0,1,0|3,0,0]=4 174 B14R2.598 Nc1nn(c(c1)C)c2ccccc2 1P00GBTN [0,0,0,0,1,0|3,0,0]=4 175 B14R2.598 O=C1CC(=NN1c2ccccc2)C 1P0088DQ [0,0,0,0,1,0|1,0,1]=3 176 B14R2.598 O=C1CC(=NN1c2ccccc2)N 1P003JAI [0,0,0,0,1,0|2,0,1]=4 177 B14R2.598 O=C1CC(=O)CN1c2ccccc2 1P000EYC [0,0,0,0,1,0|1,0,2]=4 178 B14R2.598 O=C1CC(=O)NN1c2ccccc2 1P002CJ7 [0,0,0,0,1,0|2,0,1]=4 179 B14R2.598 O=C1NC(=O)C=C1c2ccccc2 1P007HKY [0,0,0,0,1,0|3,0,0]=4 180 B14R2.598 O=C1NC(=O)CN1c2ccccc2 1P019LSD [0,0,0,0,1,0|2,0,1]=4 181 B14R2.598 O=C1OC(=O)C=C1c2ccccc2 1P003KCB [0,0,0,0,1,0|3,0,0]=4 182 B14R2.598 O=c1[nH]c(=O)[nH]n1c2ccccc2 1P005MUC [0,0,0,0,1,0|3,0,0]=4 183 B14R2.598 O=c1[nH]n(c(c1)C)c2ccccc2 1P01EUNQ [0,0,0,0,1,0|3,0,0]=4 184 B14R2.598 O=c1[nH]n(c(c1)N)c2ccccc2 1P01A4ON [0,0,0,0,1,0|3,0,0]=4 185 B14R2.598 Oc1nn(c(c1)N)c2ccccc2 1P009903 [0,0,0,0,1,0|3,0,0]=4 186 B14R2.598 S=C1CC(=NN1c2ccccc2)C 1P007OGI [0,0,0,0,1,0|1,1,1]=4 187 B14R2.598 Sc1[nH]c(=O)n(n1)c2ccccc2 1P01EJAA [0,0,0,0,1,0|3,0,0]=4 188 B16R2.317 Cc1ccc(c(c1)Oc2ccccc2)F 1P005BEW [0,0,0,0,0,1|2,0,0]=3 189 B16R2.317 Clc1ccc(=O)n(n1)Cc2ccccc2 1P019063 [0,0,0,0,0,1|2,0,0]=3 190 B16R2.317 Clc1ccc(c(c1)Cc2ccccc2)O 1P000QGM [0,0,0,0,0,1|2,0,1]=4 191 B16R2.317 Clc1ccc(c(c1)Nc2ccccc2)N 1P00FGPD [0,0,0,0,0,1|3,0,0]=4 192 B16R2.317 Clc1ccc(c(c1)Oc2ccccc2)N 1P00IC1O [0,0,0,0,0,1|3,0,0]=4 193 B16R2.317 Nc1ccc(=O)n(c1)Cc2ccccc2 1P019VI5 [0,0,0,0,0,1|1,0,0]=2 194 B16R2.317 Nc1ccc(=O)n(c1)Cc2cccnc2 1P01ACH2 [0,0,0,0,0,1|2,0,0]=3 195 B16R2.317 Nc1ccc(=O)n(c1)Cc2cccnc2 1P01AFIL [0,0,0,0,0,1|2,0,0]=3 196 B16R2.317 Nc1ccc(c(c1)Sc2ccccc2)C 1P01EJW0 [0,0,0,0,0,1|3,0,0]=4 197 B16R2.317 O=c1ccc(=O)n([nH]1)Cc2ccccc2 1P0078MO [0,0,0,0,0,1|2,0,0]=3 198 B13R2.3 c1cc[n+](cc1)c2ccncc2 1P003DHQ [2,0,0,0,0,0|1,0,1]=4 199 B13R2.3 c1ccc(cc1)c2ccccc2 1P0039ZL [2,0,0,0,0,0|1,0,0]=3 200 B13R2.3 c1ccc(cc1)c2ccccn2 1P0003DX [2,0,0,0,0,0|2,0,0]=4 201 B13R2.3 c1ccc(cc1)c2ccccn2 1P003A3Q [2,0,0,0,0,0|2,0,0]=4 202 B13R2.3 c1ccc(cc1)c2ccccn2 1P003PUK [2,0,0,0,0,0|2,0,0]=4 203 B13R2.3 c1ccc(cc1)c2ccccn2 1P00IJ4E [2,0,0,0,0,0|2,0,0]=4 204 B13R2.3 c1ccc(cc1)c2cccnc2 1P0003DY [2,0,0,0,0,0|2,0,0]=4 205 B13R2.3 c1ccc(cc1)c2ccncc2 1P0034LN [2,0,0,0,0,0|2,0,0]=4 206 B15R1.1078 CN(c1ccccc1)C(=O)\C=C\C(=O)O 1P006POZ [0,1,1,0,0,0|1,0,1]=4 207 B15R1.111 O=C(Nc1ccc(cc1)F)C=CC(=O)O 1P01A9BX [0,1,1,0,0,0|2,0,0]=4 208 B15R1.111 O=C(Nc1ccc(cc1)F)\C=C\C(=O)O 1P00EAWX [0,1,1,0,0,0|2,0,0]=4 209 B15R1.111 O=C(Nc1ccc(cc1)O)\C=C/C(=O)O 1P007K65 [0,1,1,0,0,0|2,0,0]=4 210 B15R1.256 O=C(Nc1ccccc1Br)C=CC(=O)O 1P00CKF2 [0,1,1,0,0,0|2,0,0]=4 211 B15R1.256 O=C(Nc1ccccc1O)C=CC(=O)O 1P01BEJ7 [0,1,1,0,0,0|2,0,0]=4 212 B15R2.17 BrCc1cccc(c1)c2ccccc2 1P001F13 [1,1,0,0,0,0|1,0,0]=3 213 B15R2.17 C#Cc1cccc(c1)c2ccccc2 1P01AM9B [1,1,0,0,0,0|1,0,1]=4 214 B15R2.17 C=Cc1cccc(c1)c2ccccc2 1P003990 [1,1,0,0,0,0|1,0,1]=4 215 B15R2.17 CCc1cccc(c1)c2ccccc2 1P00ED26 [1,1,0,0,0,0|1,0,0]=3 216 B15R2.17 COc1cccc(c1)c2ccccc2 1P002LQN [1,1,0,0,0,0|1,0,0]=3 217 B15R2.17 ClCc1cccc(c1)c2ccccc2 1P00C6QD [1,1,0,0,0,0|1,0,0]=3 218 B15R2.17 N#Cc1cccc(c1)c2ccccc2 1P002QIW [1,1,0,0,0,0|1,0,1]=4 219 B15R2.17 NCc1cccc(c1)c2ccccc2 1P00265W [1,1,0,0,0,0|1,0,0]=3 220 B15R2.17 NCc1cccc(c1)c2ccccc2 1P003AI2 [1,1,0,0,0,0|1,0,0]=3 221 B15R2.17 NCc1cccc(c1)c2ccccn2 1P021U0O [1,1,0,0,0,0|2,0,0]=4 222 B15R2.17 NCc1cccc(c1)c2cccnc2 1P00LP3K [1,1,0,0,0,0|2,0,0]=4 223 B15R2.17 NCc1cccc(c1)c2cccnc2 1P028BKR [1,1,0,0,0,0|2,0,0]=4 224 B15R2.17 NCc1cccc(c1)c2ccncc2 1P00GYTT [1,1,0,0,0,0|2,0,0]=4 225 B15R2.17 NCc1cccc(n1)c2ccccc2 1P0280AZ [1,1,0,0,0,0|2,0,0]=4 226 B15R2.17 NNc1cccc(c1)c2ccccc2 1P008SBD [1,1,0,0,0,0|2,0,0]=4 227 B15R2.17 O=Cc1cccc(c1)c2ccccc2 1P007QEQ [1,1,0,0,0,0|1,0,1]=4 228 B15R2.17 OCc1cccc(c1)c2ccccc2 1P005KIP [1,1,0,0,0,0|1,0,0]=3 229 B15R2.17 OCc1cccc(c1)c2cccnc2 1P008HWU [1,1,0,0,0,0|2,0,0]=4 230 B15R2.17 OCc1cncc(c1)c2ccccc2 1P00ARA7 [1,1,0,0,0,0|2,0,0]=4 231 B15R2.17 OCc1nccc(c1)c2ccccc2 1P00DGTN [1,1,0,0,0,0|2,0,0]=4 232 B15R2.27 Brc1cc(Br)cc(c1)c2ccccc2 1P001UTL [1,1,0,0,0,0|2,0,0]=4 233 B15R2.27 Cc1cc(N)cc(c1)c2ccccc2 1P004UQ4 [1,1,0,0,0,0|1,0,0]=3 234 B15R2.27 Cc1cc(N)cc(c1)c2cccnc2 1P01JLRH [1,1,0,0,0,0|2,0,0]=4 235 B15R2.27 Oc1c[n+](C)cc(c1)c2ccccc2 1P01J0QP [1,1,0,0,0,0|2,0,0]=4 236 B15R2.27 Oc1cc(Cl)cc(c1)c2ccccc2 1P00ID54 [1,1,0,0,0,0|2,0,0]=4 237 B15R2.27 Oc1cc(O)cc(c1)c2ccccc2 1P00FHY4 [1,1,0,0,0,0|2,0,0]=4 238 B15R2.28 Brc1ccc(cc1)c2cccc(c2)Br 1P003EKC [1,1,0,0,0,0|2,0,0]=4 239 B15R2.28 Brc1ccc(cc1)c2cccc(c2)Cl 1P00GTD5 [1,1,0,0,0,0|2,0,0]=4 240 B15R2.28 Brc1ccc(cc1)c2cccc(c2)F 1P00BZ6P [1,1,0,0,0,0|2,0,0]=4 241 B15R2.28 Brc1ccc(cc1)c2cccc(c2)I 1P01ENV0 [1,1,0,0,0,0|2,0,0]=4 242 B15R2.28 Brc1ccc(cc1)c2cccc(c2)N 1P00C7BW [1,1,0,0,0,0|2,0,0]=4 243 B15R2.28 Cc1ccc(cc1)c2cccc(c2)C 1P005BFQ [1,1,0,0,0,0|1,0,0]=3 244 B15R2.28 Cc1ccc(cc1)c2cccc(c2)N 1P00I8BH [1,1,0,0,0,0|2,0,0]=4 245 B15R2.28 Cc1ccc(cc1)c2cccc(c2)N 1P00J3TQ [1,1,0,0,0,0|2,0,0]=4 246 B15R2.28 Cc1ccc(cc1)c2nccc(c2)C 1P00G3SB [1,1,0,0,0,0|2,0,0]=4 247 B15R2.28 Cc1cccc(c1)c2ccc(nc2)N 1P003XEF [1,1,0,0,0,0|2,0,0]=4 248 B15R2.28 Clc1ccc(cc1)c2cccc(c2)Br 1P001V9E [1,1,0,0,0,0|2,0,0]=4 249 B15R2.28 Clc1ccc(cc1)c2cccc(c2)N 1P000EI7 [1,1,0,0,0,0|2,0,0]=4 250 B15R2.28 Clc1ccc(cc1)c2cccc(c2)N 1P00EBUV [1,1,0,0,0,0|2,0,0]=4 251 B15R2.28 Clc1ccc(cc1)c2cccc(c2)O 1P00BJ6T [1,1,0,0,0,0|2,0,0]=4 252 B15R2.28 Clc1ccc(cc1)c2cccc(n2)C 1P00MHIL [1,1,0,0,0,0|2,0,0]=4 253 B15R2.28 Fc1ccc(cc1)c2cccc(c2)Br 1P009MAM [1,1,0,0,0,0|2,0,0]=4 254 B15R2.28 Fc1ccc(cc1)c2cccc(c2)N 1P008ST3 [1,1,0,0,0,0|2,0,0]=4 255 B15R2.28 Fc1ccc(cc1)c2cccc(c2)N 1P00J1LU [1,1,0,0,0,0|2,0,0]=4 256 B15R2.28 Fc1ccc(cc1)c2cccc(c2)O 1P007F59 [1,1,0,0,0,0|2,0,0]=4 257 B15R2.28 Ic1ccc(cc1)c2cccc(c2)Br 1P003AJ5 [1,1,0,0,0,0|2,0,0]=4 258 B15R2.28 Nc1ccc(cc1)c2cccc(c2)C 1P00EC65 [1,1,0,0,0,0|1,0,0]=3 259 B15R2.28 Nc1ccc(cc1)c2cccc(c2)C 1P00G82E [1,1,0,0,0,0|1,0,0]=3 260 B15R2.28 Nc1ccc(cc1)c2cccc(c2)Cl 1P00G82B [1,1,0,0,0,0|2,0,0]=4 261 B15R2.28 Nc1ccc(cc1)c2cccc(c2)F 1P00EAAS [1,1,0,0,0,0|2,0,0]=4 262 B15R2.28 Nc1ccc(cc1)c2cccc(c2)N 1P00CQRF [1,1,0,0,0,0|2,0,0]=4 263 B15R2.28 Oc1ccc(cc1)c2cccc(c2)Cl 1P00HRYX [1,1,0,0,0,0|2,0,0]=4 264 B15R2.28 Oc1ccc(cc1)c2cccc(c2)N 1P008V9V [1,1,0,0,0,0|2,0,0]=4 265 B15R2.30 Brc1cccc(c1)c2cccc(c2)Br 1P003EKB [1,1,0,0,0,0|2,0,0]=4 266 B15R2.30 Cc1cccc(c1)c2cccc(c2)C 1P003IU2 [1,1,0,0,0,0|1,0,0]=3 267 B15R2.30 Cc1cccc(c1)c2cccc(c2)N 1P00BZW6 [1,1,0,0,0,0|1,0,0]=3 268 B15R2.30 Cc1cccc(c1)c2cccc(c2)N 1P00J1LX [1,1,0,0,0,0|1,0,0]=3 269 B15R2.30 Cc1ccnc(c1)c2cccc(c2)Cl 1P01XEQF [1,1,0,0,0,0|2,0,0]=4 270 B15R2.30 Clc1cccc(c1)c2cccc(c2)Br 1P00G3KT [1,1,0,0,0,0|2,0,0]=4 271 B15R2.30 Clc1cccc(c1)c2cccc(c2)I 1P00IN6C [1,1,0,0,0,0|2,0,0]=4 272 B15R2.30 Fc1cccc(c1)c2cccc(c2)F 1P003ITL [1,1,0,0,0,0|2,0,0]=4 273 B15R2.30 Nc1cccc(c1)c2cccc(c2)Br 1P01C7L9 [1,1,0,0,0,0|2,0,0]=4 274 B15R2.30 Nc1cccc(c1)c2cccc(c2)Cl 1P00EC5S [1,1,0,0,0,0|2,0,0]=4 275 B15R2.30 Nc1cccc(c1)c2cccc(c2)Cl 1P00G7FK [1,1,0,0,0,0|2,0,0]=4 276 B15R2.30 Nc1cccc(c1)c2cccc(c2)F 1P0076AK [1,1,0,0,0,0|2,0,0]=4 277 B15R2.30 Nc1cccc(c1)c2cccc(c2)F 1P008SZ9 [1,1,0,0,0,0|2,0,0]=4 278 B15R2.30 Nc1cccc(c1)c2cccc(c2)N 1P002AAL [1,1,0,0,0,0|2,0,0]=4 279 B15R2.30 Oc1cccc(c1)c2cccc(c2)Cl 1P00CMLY [1,1,0,0,0,0|2,0,0]=4 280 B15R2.32 Cc1c(N)cccc1c2ccccc2 1P01DIGX [1,1,0,0,0,0|2,0,0]=4 281 B15R2.32 Cc1c(O)cccc1c2ccccc2 1P0083BC [1,1,0,0,0,0|2,0,0]=4 282 B15R2.32 Clc1c(N)cccc1c2ccccc2 1P028CIT [1,1,0,0,0,0|2,0,0]=4 283 B15R2.32 Fc1c(N)cccc1c2ccccc2 1P027UUK [1,1,0,0,0,0|2,0,0]=4 284 B15R2.32 Nc1c(C)cccc1c2ccccc2 1P003B38 [1,1,0,0,0,0|1,0,0]=3 285 B15R2.32 O=c1c(N)cccn1c2ccccc2 1P028WBN [1,1,0,0,0,0|1,0,0]=3 286 B15R2.32 Oc1c(C)cccc1c2ccccc2 1P0025V4 [1,1,0,0,0,0|1,0,0]=3 287 B15R2.94 Brc1ccc(cc1C)c2ccccc2 1P00GYWB [1,1,0,0,0,0|1,0,0]=3 288 B15R2.94 Brc1ccc(cc1Cl)c2ccccc2 1P01KLO9 [1,1,0,0,0,0|2,0,0]=4 289 B15R2.94 Cc1ccc(cc1N)c2ccccc2 1P005101 [1,1,0,0,0,0|2,0,0]=4 290 B15R2.94 Fc1ccc(cc1Br)c2ccccc2 1P0031CU [1,1,0,0,0,0|2,0,0]=4 291 B15R2.94 Fc1ccc(cc1N)c2ccccc2 1P00DKP0 [1,1,0,0,0,0|2,0,0]=4 292 B15R2.94 IC1=CC=C(C2=CC=CC=C2)C=C1Br 1P01K6BX [1,1,0,0,0,0|2,0,0]=4 293 B15R2.94 Ic1ccc(cc1C)c2ccccc2 1P023T53 [1,1,0,0,0,0|1,0,0]=3 294 B15R2.94 Nc1ccc(cc1Br)c2ccccc2 1P01715Z [1,1,0,0,0,0|2,0,0]=4 295 B15R2.94 Nc1ccc(cc1C)c2ccccc2 1P00C01V [1,1,0,0,0,0|1,0,0]=3 296 B15R2.94 Nc1ccc(cc1C)c2ccncc2 1P0293U6 [1,1,0,0,0,0|2,0,0]=4 297 B15R2.94 Nc1ccc(cc1Cl)c2ccccc2 1P00FIFB [1,1,0,0,0,0|2,0,0]=4 298 B15R2.94 Nc1ccc(cc1Cl)c2ccccc2 1P019MQV [1,1,0,0,0,0|2,0,0]=4 299 B15R2.94 Nc1ccc(cc1F)c2ccccc2 1P019MHD [1,1,0,0,0,0|2,0,0]=4 300 B15R2.94 Nc1ccc(cc1F)c2ccccc2 1P01A7MH [1,1,0,0,0,0|2,0,0]=4 301 B15R2.94 Nc1ccc(cc1I)c2ccccc2 1P01DX71 [1,1,0,0,0,0|2,0,0]=4 302 B15R2.94 Oc1ccc(cc1Br)c2ccccc2 1P00GYW4 [1,1,0,0,0,0|2,0,0]=4 303 B15R2.94 Oc1ccc(cc1C)c2ccccc2 1P0030MY [1,1,0,0,0,0|1,0,0]=3 304 B15R2.94 Oc1ccc(cc1C)c2cccnc2 1P01EN11 [1,1,0,0,0,0|2,0,0]=4 305 B15R2.94 Oc1ccc(cc1Cl)c2ccccc2 1P00IMVE [1,1,0,0,0,0|2,0,0]=4 306 B15R2.94 Oc1ccc(cc1N)c2ccccc2 1P0008WR [1,1,0,0,0,0|2,0,0]=4 307 B15R2.94 Oc1ccc(cc1O)c2ccccc2 1P003BCQ [1,1,0,0,0,0|2,0,0]=4 308 B15R2.332 Cc1cccc(c1)c2ccccc2N 1P001C52 [1,1,0,0,0,0|1,0,0]=3 309 B15R2.332 Cc1cccc(c1)c2ncccc2N 1P01DIJC [1,1,0,0,0,0|2,0,0]=4 310 B15R2.332 Cc1ccnc(c1)c2ccccc2F 1P00GS5E [1,1,0,0,0,0|2,0,0]=4 311 B15R2.332 Clc1cccc(c1)c2ccccc2N 1P0076AU [1,1,0,0,0,0|2,0,0]=4 312 B15R2.332 Clc1cccc(c1)c2ccccc2N 1P008T3B [1,1,0,0,0,0|2,0,0]=4 313 B15R2.332 Nc1cccc(c1)c2ccccc2C 1P003JAZ [1,1,0,0,0,0|2,0,0]=4 314 B15R2.332 Nc1cccc(c1)c2ccccc2C 1P00FGDN [1,1,0,0,0,0|2,0,0]=4 315 B15R2.332 Nc1cccc(c1)c2ccccc2Cl 1P01JMJ9 [1,1,0,0,0,0|2,0,0]=4 316 B15R2.332 Nc1cccc(c1)c2ccccc2F 1P01FF7K [1,1,0,0,0,0|2,0,0]=4 317 B15R2.332 Oc1cccc(c1)c2ccccc2C 1P00ICO6 [1,1,0,0,0,0|2,0,0]=4 318 B15R2.332 Oc1cccc(c1)c2ccccc2Cl 1P00ABGT [1,1,0,0,0,0|2,0,0]=4 319 B15R2.21 BrCc1ccccc1c2ccccc2 1P002C27 [1,1,0,0,0,0|2,0,0]=4 320 B15R2.21 C#Cc1ccccc1c2ccccc2 1P01AM9K [1,1,0,0,0,0|2,0,0]=4 321 B15R2.21 CCc1ccccc1c2ccccc2 1P00237F [1,1,0,0,0,0|2,0,0]=4 322 B15R2.21 CNc1ccccc1c2ccccc2 1P001LZS [1,1,0,0,0,0|2,0,0]=4 323 B15R2.21 CNc1ccccc1c2ccccc2 1P019Y58 [1,1,0,0,0,0|2,0,0]=4 324 B15R2.21 N#Cc1ccccc1c2ccccc2 1P002QIX [1,1,0,0,0,0|2,0,0]=4 325 B15R2.21 NCc1ccccc1c2ccccc2 1P002GEA [1,1,0,0,0,0|2,0,0]=4 326 B15R2.21 NCc1ccccc1c2ccccc2 1P01DMCA [1,1,0,0,0,0|2,0,0]=4 327 B15R2.21 O=Cc1ccccc1c2ccccc2 1P0033LC [1,1,0,0,0,0|1,0,0]=3 328 B15R2.21 O=Cc1ccccc1c2cccnc2 1P0025A4 [1,1,0,0,0,0|2,0,0]=4 329 B15R2.21 O=Cc1ccccc1c2ccncc2 1P00256P [1,1,0,0,0,0|2,0,0]=4 330 B15R2.21 OCc1ccccc1c2ccccc2 1P002YF6 [1,1,0,0,0,0|1,0,1]=4 331 B15R2.21 [C-]#[N+]c1ccccc1c2ccccc2 1P00CQPT [1,1,0,0,0,0|2,0,0]=4 332 B15R2.308 Brc1ccc(cc1)c2ccccc2F 1P019F8G [1,1,0,0,0,0|2,0,0]=4 333 B15R2.308 Brc1ccc(cc1)c2ccccc2O 1P01ENIP [1,1,0,0,0,0|1,0,1]=4 334 B15R2.308 Brc1ccc(cc1)n2ccccc2=O 1P01KL10 [1,1,0,0,0,0|0,0,0]=2 335 B15R2.308 Brc1ccc(cc1)n2ncccc2=O 1P023J8F [1,1,0,0,0,0|1,0,0]=3 336 B15R2.308 Cc1ccc(cc1)c2ccccc2C 1P00EM40 [1,1,0,0,0,0|2,0,0]=4 337 B15R2.308 Clc1ccc(cc1)c2ccccc2Br 1P0027J0 [1,1,0,0,0,0|2,0,0]=4 338 B15R2.308 Fc1ccc(cc1)c2ccccc2Br 1P003ZTI [1,1,0,0,0,0|2,0,0]=4 339 B15R2.308 Fc1ccc(cc1)c2ccccc2N 1P00BZDA [1,1,0,0,0,0|2,0,0]=4 340 B15R2.308 Nc1ccc(cc1)c2ccccc2C 1P00G7HO [1,1,0,0,0,0|2,0,0]=4 341 B15R2.308 Nc1ccc(cc1)c2ccccc2F 1P00CWPB [1,1,0,0,0,0|2,0,0]=4 342 B15R2.308 Nc1ccc(cc1)n2ccccc2=O 1P000WMQ [1,1,0,0,0,0|0,0,0]=2 343 B15R2.308 Oc1ccc(cc1)c2ccccc2Cl 1P00HY7R [1,1,0,0,0,0|2,0,0]=4 344 B15R2.308 Oc1ccc(cc1)c2ccccc2F 1P00CMAO [1,1,0,0,0,0|2,0,0]=4 345 B15R2.308 Oc1ccc(cc1)c2ccccc2O 1P00EPYO [1,1,0,0,0,0|1,0,1]=4 346 B15R2.389 Brc1ccc(c(c1)Br)c2ccccc2 1P00DEYP [1,1,0,0,0,0|2,0,0]=4 347 B15R2.389 Brc1ccc(c(c1)C)c2ccccc2 1P003LDW [1,1,0,0,0,0|2,0,0]=4 348 B15R2.389 Brc1ccc(c(c1)F)c2ccccc2 1P003LD8 [1,1,0,0,0,0|2,0,0]=4 349 B15R2.389 Brc1ccc(c(c1)N)c2ccccc2 1P00CRSW [1,1,0,0,0,0|2,0,0]=4 350 B15R2.389 Brc1ccn(c(=O)c1)c2ccccc2 1P01KKO3 [1,1,0,0,0,0|0,0,0]=2 351 B15R2.389 Cc1ccc(c(c1)F)c2ccccc2 1P00FC15 [1,1,0,0,0,0|2,0,0]=4 352 B15R2.389 Cc1ccc(c(c1)I)c2ccccc2 1P028TCU [1,1,0,0,0,0|2,0,0]=4 353 B15R2.389 Cc1ccc(c(c1)N)c2ccccc2 1P00E4GX [1,1,0,0,0,0|2,0,0]=4 354 B15R2.389 Clc1ccc(c(c1)F)c2ccccc2 1P00D4HS [1,1,0,0,0,0|2,0,0]=4 355 B15R2.389 Fc1ccc(c(c1)F)c2ccccc2 1P003G9B [1,1,0,0,0,0|2,0,0]=4 356 B15R2.389 Ic1cnn(c(=O)c1)c2ccccc2 1P028VK3 [1,1,0,0,0,0|1,0,0]=3 357 B15R2.389 Nc1ccc(c(c1)C)c2ccccc2 1P00EC5O [1,1,0,0,0,0|2,0,0]=4 358 B15R2.389 Nc1ccn(c(=O)c1)c2ccccc2 1P02852N [1,1,0,0,0,0|0,0,0]=2 359 B15R2.389 Nc1cnn(c(=O)c1)c2ccccc2 1P0072QV [1,1,0,0,0,0|1,0,0]=3 360 B15R2.389 O=c1ccn(c(=O)[nH]1)c2cccnc2 1P028P6J [1,1,0,0,0,0|2,0,0]=4 361 B15R2.389 O=c1cnn(c(=O)[nH]1)c2ccccc2 1P01ACRW [1,1,0,0,0,0|2,0,0]=4 362 B15R2.389 Oc1ccc(c(c1)Br)c2ccccc2 1P01X9XM [1,1,0,0,0,0|2,0,0]=4 363 B15R2.389 Oc1ccc(c(c1)F)c2ccccc2 1P00DE18 [1,1,0,0,0,0|2,0,0]=4 364 B15R2.389 Oc1ccc(c(c1)O)c2ccccc2 1P009Z64 [1,1,0,0,0,0|1,0,1]=4 365 B15R2.541 Oc1cccc(c1c2ccccc2)O 1P01C3B0 [1,1,0,0,0,0|1,0,1]=4 366 B15R2.555 Brc1ccccc1c2ccccc2Br 1P000UP3 [1,1,0,0,0,0|2,0,0]=4 367 B15R2.555 Brc1ccccc1c2ccccc2Cl 1P019FAF [1,1,0,0,0,0|2,0,0]=4 368 B15R2.555 Cc1ccccc1c2ccccc2C 1P00BZUC [1,1,0,0,0,0|2,0,0]=4 369 B15R2.555 Fc1ccccc1c2ccccc2F 1P00780Y [1,1,0,0,0,0|2,0,0]=4 370 B15R2.555 Fc1ccccc1c2ccccc2N 1P00BZVW [1,1,0,0,0,0|2,0,0]=4 371 B15R2.555 Fc1ccccc1c2ccccc2O 1P00I8TS [1,1,0,0,0,0|1,0,1]=4 372 B15R2.555 Ic1ccccc1c2ccccc2I 1P003FRQ [1,1,0,0,0,0|2,0,0]=4 373 B15R2.555 Nc1ccccc1c2ccccc2C 1P008TC6 [1,1,0,0,0,0|2,0,0]=4 374 B15R2.555 Nc1ccccc1c2ccccc2C 1P00IU8U [1,1,0,0,0,0|2,0,0]=4 375 B15R2.555 Nc1ccccc1c2ccccc2N 1P001LC1 [1,1,0,0,0,0|2,0,0]=4 376 B15R2.555 Oc1ccccc1c2ccccc2C 1P005EYZ [1,1,0,0,0,0|1,0,1]=4 377 B15R2.555 Oc1ccccc1c2ccccc2O 1P0022LW [1,1,0,0,0,0|1,0,1]=4 378 B15R2.323 BrC1=CC(=O)N(C1=O)c2ccccc2 1P0060T6 [0,1,0,0,1,0|1,0,0]=3 379 B15R2.323 CC1C(=O)NC(=O)N1c2ccccc2 1P00857W [0,1,0,0,1,0|1,0,1]=4 380 B15R2.323 O=C1NC(=O)N(C1=O)c2ccccc2 1P007Q0L [0,1,0,0,1,0|2,0,0]=4 381 B15R2.323 O=c1cc(n(n1c2ccccc2)C)C 1P00IB3R [0,1,0,0,1,0|1,0,0]=3 382 B15R2.2280 CCc1n[nH]c(=O)n1c2ccccc2 1P01BRXE [0,1,0,0,1,0|2,0,0]=4 383 B15R2.2280 NCc1cnc(n1c2ccccc2)C 1P01AJXA [0,1,0,0,1,0|2,0,0]=4 384 B15R2.2280 O=Cc1ccc(n1c2cccnc2)C 1P00GVXF [0,1,0,0,1,0|1,0,0]=3 385 B15R2.2280 O=Cc1cnc(n1c2ccccc2)C 1P00JGZR [0,1,0,0,1,0|1,0,0]=3 386 B15R2.2280 OCc1cnc(n1c2ccccc2)C 1P00JGZU [0,1,0,0,1,0|1,0,1]=4 387 B15R2.7148 Brc1cccc(c1)N2C(=O)C=CC2=O 1P003DD2 [0,1,0,0,1,0|1,0,0]=3 388 B15R2.7148 Brc1cccc(c1)n2c(C)ccc2C 1P000XAI [0,1,0,0,1,0|1,0,0]=3 389 B15R2.7148 Cc1cccc(c1)N2C(=O)C=CC2=O 1P002936 [0,1,0,0,1,0|1,0,0]=3 390 B15R2.7148 Fc1cccc(c1)n2c(C)ccc2C 1P001E6V [0,1,0,0,1,0|1,0,0]=3 391 B15R2.7148 Fc1cccc(c1)n2c(C)n[nH]c2=O 1P01BIM4 [0,1,0,0,1,0|2,0,0]=4 392 B15R2.7148 Nc1cccc(c1)n2c(C)c[nH]c2=O 1P01DUSQ [0,1,0,0,1,0|1,0,0]=3 393 B15R2.7148 Nc1cccc(c1)n2c(C)ccc2C 1P002POI [0,1,0,0,1,0|1,0,0]=3 394 B15R2.7148 Oc1cccc(c1)N2C(=O)C=CC2=O 1P00EARU [0,1,0,0,1,0|1,0,0]=3 395 B15R2.7148 Oc1cccc(c1)n2c(C)ccc2C 1P00IKFG [0,1,0,0,1,0|1,0,0]=3 396 B15R2.7458 Brc1cccnc1n2c(C)ccc2C 1P0096YD [0,1,0,0,1,0|2,0,0]=4 397 B15R2.7458 Clc1ccccc1n2c(C)c[nH]c2=O 1P019XFV [0,1,0,0,1,0|1,0,0]=3 398 B15R2.7458 Fc1ccccc1n2c(C)c[nH]c2=O 1P019X7B [0,1,0,0,1,0|1,0,0]=3 399 B15R2.7458 Nc1ccccc1n2c(C)c[nH]c2=O 1P01A8HN [0,1,0,0,1,0|1,0,0]=3 400 B15R2.7458 O=C1C=CC(=O)N1c2ccccc2Br 1P003DA7 [0,1,0,0,1,0|1,0,0]=3 401 B15R2.7458 O=C1C=CC(=O)N1c2ccccc2C 1P00BZPD [0,1,0,0,1,0|1,0,0]=3 402 B15R2.7458 O=C1C=CC(=O)N1c2ccccc2Cl 1P007QTP [0,1,0,0,1,0|1,0,0]=3 403 B15R2.7458 O=C1C=CC(=O)N1c2ccccc2F 1P00EAOQ [0,1,0,0,1,0|1,0,0]=3 404 B15R2.7458 Oc1cccnc1n2c(C)ccc2C 1P0020OI [0,1,0,0,1,0|2,0,0]=4 405 B15R2.18925 Brc1ccc(cc1)n2c(C)ccc2C 1P003DF0 [0,1,0,0,1,0|1,0,0]=3 406 B15R2.18925 Brc1ccc(nc1)n2c(C)ccc2C 1P0070ER [0,1,0,0,1,0|2,0,0]=4 407 B15R2.18925 Cc1ccc(cc1)n2c(C)c[nH]c2=O 1P019XFT [0,1,0,0,1,0|1,0,0]=3 408 B15R2.18925 Clc1ccc(cc1)n2c(C)c[nH]c2=O 1P019XLZ [0,1,0,0,1,0|1,0,0]=3 409 B15R2.18925 Fc1ccc(cc1)n2c(C)n[nH]c2=O 1P008G05 [0,1,0,0,1,0|2,0,0]=4 410 B15R2.18925 Fc1ccc(nc1)n2c(C)ccc2C 1P01ANUG [0,1,0,0,1,0|2,0,0]=4 411 B15R2.18925 Ic1ccc(cc1)n2c(C)ccc2C 1P002XC5 [0,1,0,0,1,0|1,0,0]=3 412 B15R2.18925 Ic1ccc(nc1)n2c(C)ccc2C 1P00DKLF [0,1,0,0,1,0|2,0,0]=4 413 B15R2.18925 Nc1ccc(cc1)n2c(C)ccc2C 1P00EAQG [0,1,0,0,1,0|1,0,0]=3 414 B15R2.18925 Nc1ccc(cc1)n2c(C)ccc2C 1P02897M [0,1,0,0,1,0|1,0,0]=3 415 B15R2.18925 Nc1ccc(cn1)n2c(C)ccc2C 1P0292DH [0,1,0,0,1,0|2,0,0]=4 416 B15R2.18925 O=C1C=CC(=O)N1c2ccc(cc2)Br 1P003SSL [0,1,0,0,1,0|1,0,0]=3 417 B15R2.18925 O=C1C=CC(=O)N1c2ccc(cc2)C 1P001U8C [0,1,0,0,1,0|1,0,0]=3 418 B15R2.18925 O=C1C=CC(=O)N1c2ccc(cc2)Cl 1P00AQDV [0,1,0,0,1,0|1,0,0]=3 419 B15R2.18925 O=C1C=CC(=O)N1c2ccc(cc2)F 1P00FB59 [0,1,0,0,1,0|1,0,0]=3 420 B15R2.18925 O=C1C=CC(=O)N1c2ccc(cc2)I 1P00FB5F [0,1,0,0,1,0|1,0,0]=3 421 B15R2.18925 O=C1C=CC(=O)N1c2ccc(cc2)N 1P002ZRO [0,1,0,0,1,0|1,0,0]=3 422 B15R2.18925 O=C1C=CC(=O)N1c2ccc(cc2)N 1P01BHGG [0,1,0,0,1,0|1,0,0]=3 423 B15R2.18925 O=C1C=CC(=O)N1c2ccc(cc2)O 1P0039QB [0,1,0,0,1,0|1,0,0]=3 424 B15R2.18925 Oc1ccc(cc1)n2c(C)ccc2C 1P00JJVV [0,1,0,0,1,0|1,0,0]=3 425 B15R2.309 Brc1ccc(cc1)n2nc(cc2C)C 1P003DF2 [0,1,0,0,1,0|2,0,0]=4 426 B15R2.309 Brc1ccc(cc1)n2nc(cc2N)C 1P00J9A3 [0,1,0,0,1,0|2,0,0]=4 427 B15R2.309 Cc1ccc(cc1)N2N=C(CC2=O)C 1P003G9K [0,1,0,0,1,0|1,0,1]=4 428 B15R2.309 Cc1ccc(cc1)n2nc(cc2N)C 1P003K4Y [0,1,0,0,1,0|2,0,0]=4 429 B15R2.309 Clc1ccc(cc1)n2nc(cc2N)C 1P003DFK [0,1,0,0,1,0|2,0,0]=4 430 B15R2.309 Clc1ccc(cc1)n2nc(cc2N)C 1P019MF9 [0,1,0,0,1,0|2,0,0]=4 431 B15R2.309 Fc1ccc(cc1)n2nc(cc2Cl)C 1P01ANAC [0,1,0,0,1,0|2,0,0]=4 432 B15R2.309 Fc1ccc(cc1)n2nc(cc2N)C 1P005JRA [0,1,0,0,1,0|2,0,0]=4 433 B15R2.309 Fc1ccc(cc1)n2nc(cc2O)C 1P00I0RX [0,1,0,0,1,0|1,0,1]=4 434 B15R2.309 Nc1ccc(cc1)n2nc([nH]c2=O)C 1P01FK23 [0,1,0,0,1,0|2,0,0]=4 435 B15R2.309 Nc1ccc(cc1)n2nc(cc2C)C 1P00J1MH [0,1,0,0,1,0|2,0,0]=4 436 B15R2.309 O=C1CC(=NN1c2ccc(cc2)Br)C 1P001DVY [0,1,0,0,1,0|1,0,1]=4 437 B15R2.309 O=C1CC(=NN1c2ccc(cc2)Cl)C 1P000UNL [0,1,0,0,1,0|1,0,1]=4 438 B15R2.309 O=C1CC(=NN1c2ccc(cc2)F)C 1P009SAH [0,1,0,0,1,0|1,0,1]=4 439 B15R2.309 Oc1ccc(cc1)n2nc(cc2C)C 1P01C3RV [0,1,0,0,1,0|2,0,0]=4 440 B15R2.321 CC1=NN(C(=O)C1=O)c2ccccc2 1P003EVC [0,1,0,0,1,0|1,0,0]=3 441 B15R2.321 Cc1nn(c(c1Br)C)c2ccccc2 1P00DAAL [0,1,0,0,1,0|2,0,0]=4 442 B15R2.321 Cc1nn(c(c1Br)N)c2ccccc2 1P003LF1 [0,1,0,0,1,0|2,0,0]=4 443 B15R2.321 Cc1nn(c(c1Br)N)c2ccccc2 1P01C3Z2 [0,1,0,0,1,0|2,0,0]=4 444 B15R2.321 Cc1nn(c(c1Cl)N)c2ccccc2 1P01C734 [0,1,0,0,1,0|2,0,0]=4 445 B15R2.321 Cc1nn(c(c1I)N)c2ccccc2 1P019MUP [0,1,0,0,1,0|2,0,0]=4 446 B15R2.321 Cc1nn(c(c1N)C)c2ccccc2 1P00BFS7 [0,1,0,0,1,0|2,0,0]=4 447 B15R2.321 Cc1nn(c(c1N)C)c2ccccc2 1P028WD3 [0,1,0,0,1,0|2,0,0]=4 448 B15R2.321 Cc1nn(c(c1N)N)c2ccccc2 1P00DBA0 [0,1,0,0,1,0|2,0,0]=4 449 B15R2.321 Cc1nn(c(c1N)N)c2ccccc2 1P01FLE2 [0,1,0,0,1,0|2,0,0]=4 450 B15R2.321 NC1C(=NN(C1=O)c2ccccc2)C 1P00I8UI [0,1,0,0,1,0|1,0,1]=4 451 B15R2.334 Brc1cccc(c1)n2nc(cc2C)C 1P002Z0I [0,1,0,0,1,0|2,0,0]=4 452 B15R2.334 Brc1cccc(c1)n2nc(cc2N)C 1P00IJQG [0,1,0,0,1,0|2,0,0]=4 453 B15R2.334 Cc1cccc(c1)n2nc(cc2N)C 1P006F70 [0,1,0,0,1,0|2,0,0]=4 454 B15R2.334 Clc1cccc(c1)N2N=C(CC2=O)C 1P006G5U [0,1,0,0,1,0|1,0,1]=4 455 B15R2.334 Clc1cccc(c1)n2nc(cc2N)C 1P00C7U9 [0,1,0,0,1,0|2,0,0]=4 456 B15R2.334 Fc1cccc(c1)n2nc(cc2N)C 1P01DVET [0,1,0,0,1,0|2,0,0]=4 457 B15R2.334 Nc1cccc(c1)N2N=C(CC2=O)C 1P00BL9Q [0,1,0,0,1,0|1,0,1]=4 458 B15R2.334 Nc1cccc(c1)N2N=C(CC2=O)C 1P00H1GH [0,1,0,0,1,0|1,0,1]=4 459 B15R2.334 Nc1cccc(c1)n2nc(cc2C)C 1P019NGV [0,1,0,0,1,0|2,0,0]=4 460 B15R2.557 CC1=NN(C(=O)C1)c2ccccc2C 1P002Y66 [0,1,0,0,1,0|1,0,1]=4 461 B15R2.557 CC1=NN(C(=O)C1)c2ccccc2Cl 1P001DVX [0,1,0,0,1,0|1,0,1]=4 462 B15R2.557 Cc1nn(c(c1)C)c2ccccc2N 1P00ECGB [0,1,0,0,1,0|2,0,0]=4 463 B15R2.557 Cc1nn(c(c1)N)c2ccccc2C 1P00GW7N [0,1,0,0,1,0|2,0,0]=4 464 B15R2.557 Cc1nn(c(c1)N)c2ccccc2F 1P00JGF9 [0,1,0,0,1,0|2,0,0]=4 465 B15R2.1682 CCc1nn(c(c1)N)c2ccccc2 1P0005YT [0,1,0,0,1,0|2,0,0]=4 466 B15R2.1682 ClCc1nn(c(c1)C)c2ccccc2 1P028GWM [0,1,0,0,1,0|2,0,0]=4 467 B15R2.1682 NCc1nn(c(c1)C)c2ccccc2 1P027TYO [0,1,0,0,1,0|2,0,0]=4 468 B15R2.1682 OCc1nn(c(c1)C)c2ccccc2 1P00VUKX [0,1,0,0,1,0|2,0,0]=4 469 B17R2.467 Clc1ccc(cc1)Cn2cc(N)ccc2=O 1P01CASL [0,1,0,0,0,1|1,0,0]=3 470 B17R2.467 Nc1ccc(cc1)Sc2cc(C)ccc2C 1P019IW6 [0,1,0,0,0,1|2,0,0]=4 471 B17R2.1349 N#Cc1ccc(cc1Sc2ccccc2)C 1P01A6LI [0,1,0,0,0,1|2,0,0]=4 472 B17R2.1349 NCc1ccc(cc1Oc2ccccc2)C 1P019ZNA [0,1,0,0,0,1|2,0,0]=4 473 B17R2.3493 Cc1ccc(c(c1)Oc2ccccc2Cl)N 1P0217EB [0,1,0,0,0,1|2,0,0]=4 474 B17R2.3493 Cc1ccc(c(c1)Sc2ccccc2N)C 1P01EJX8 [0,1,0,0,0,1|2,0,0]=4 475 B17R2.3493 Nc1ccc(=O)n(c1)Cc2ccccc2Cl 1P019VH5 [0,1,0,0,0,1|1,0,0]=3 476 B17R2.5352 Brc1cn(Cc2ccccc2)c(=O)[nH]c1=O 1P01A11K [0,1,0,0,0,1|2,0,0]=4 477 B17R2.5356 Cc1ccc(c(c1)C(=O)c2ccccc2)C 1P0073A7 [0,1,0,0,0,1|2,0,0]=4 478 B17R2.5356 Cc1ccc(c(c1)C(=O)c2ccccc2)N 1P0026LO [0,1,0,0,0,1|2,0,0]=4 479 B17R2.5356 Cc1ccc(c(c1)C(=O)c2ccccc2)O 1P001EYW [0,1,0,0,0,1|1,0,1]=4 480 B17R2.5356 Cc1ccc(c(c1)C(c2ccccc2)C)N 1P00IL17 [0,1,0,0,0,1|2,0,0]=4 481 B17R2.5356 Cc1ccc(c(c1)C(c2ccccc2)N)C 1P01AFR1 [0,1,0,0,0,1|2,0,0]=4 482 B17R2.5356 Cc1ccc(c(c1)C(c2ccccc2)O)N 1P00AQ7E [0,1,0,0,0,1|2,0,0]=4 483 B17R2.23434 Cc1cn(Cc2ccccc2)c(=O)c(c1)Br 1P0287JW [0,1,0,0,0,1|0,0,0]=2 484 B17R2.41855 Clc1cccc(c1)Cn2cc(N)ccc2=O 1P01EJUJ [0,1,0,0,0,1|1,0,0]=3 485 B17R2.41855 Fc1cccc(c1)Cn2cc(N)ccc2=O 1P01CASI [0,1,0,0,0,1|1,0,0]=3 486 B17R2.41855 Nc1cccc(c1)Cn2[nH]c(=O)ccc2=O 1P019WE6 [0,1,0,0,0,1|2,0,0]=4 487 B17R2.220 OC(=O)c1ccc(=O)n(c1)c2ccccc2 1P005FBL [0,2,0,0,0,0|0,0,1]=3 488 B17R2.220 OC(=O)c1ccc(=O)n(n1)c2ccccc2 1P00I8JA [0,2,0,0,0,0|1,0,1]=4 489 B17R2.2806 OCc1ccc(c(c1)c2ccccc2F)F 1P01PLNZ [0,2,0,0,0,0|2,0,0]=4 490 B17R2.1939 OCc1cc(=O)c(cn1c2ccccc2)O 1P00ICGT [0,2,0,0,0,0|1,0,1]=4 491 B17R2.3479 Cc1ccc(c(c1)c2ccccc2)C(=O)O 1P003NB8 [0,2,0,0,0,0|1,0,0]=3 492 B17R2.3479 Nc1ccc(c(c1)c2ccccc2)C(=O)O 1P00G8OJ [0,2,0,0,0,0|2,0,0]=4 493 B17R2.3479 Oc1ccc(c(c1)c2ccccc2)C(=O)O 1P01B70L [0,2,0,0,0,0|2,0,0]=4 494 B17R2.3472 Cc1ccc(cc1c2cc(C)ccc2C)C 1P0031M2 [0,2,0,0,0,0|2,0,0]=4 495 B17R2.3472 Clc1ccc(cc1C2=CC(=O)C=CC2=O)Cl 1P01EBIF [0,2,0,0,0,0|2,0,0]=4 496 B17R2.20931 Cc1ccc(c(c1)c2c(F)cccc2F)N 1P028C4A [0,2,0,0,0,0|2,0,0]=4 497 B15R2.38 Brc1ccccc1Nc2ccccc2 1P00EC6F [0,0,1,1,0,0|2,0,0]=4 498 B15R2.38 Brc1cccnc1Nc2ccccc2 1P01A2UP [0,0,1,1,0,0|2,0,0]=4 499 B15R2.38 Cc1ccccc1Nc2ccccc2 1P008TCE [0,0,1,1,0,0|1,0,0]=3 500 B15R2.38 Cc1cccnc1Nc2ccccc2 1P01EWEE [0,0,1,1,0,0|1,0,0]=3 501 B15R2.38 Clc1ccccc1Nc2ccccc2 1P00764O [0,0,1,1,0,0|2,0,0]=4 502 B15R2.38 Fc1ccccc1Nc2ccccc2 1P00C1I9 [0,0,1,1,0,0|2,0,0]=4 503 B15R2.38 Nc1ccccc1Nc2ccccc2 1P00IA01 [0,0,1,1,0,0|2,0,0]=4 504 B15R2.38 Nc1ccccc1Nc2ccccc2 1P01EKIV [0,0,1,1,0,0|2,0,0]=4 505 B15R2.38 Nc1cccnc1Nc2ccccc2 1P00C8QM [0,0,1,1,0,0|2,0,0]=4 506 B15R2.21211 O=Cc1cc(=O)n(c2c1cccc2)C 1P001NKO [0,0,1,1,0,0|1,0,1]=4 507 B15R2.29 Brc1ccc(cc1)Nc2ccccc2 1P003AQ2 [0,0,1,1,0,0|2,0,0]=4 508 B15R2.29 Cc1ccc(cc1)Cc2ccccc2 1P00EC7N [0,0,1,1,0,0|2,0,0]=4 509 B15R2.29 Cc1ccc(cc1)Nc2ccccc2 1P0037F0 [0,0,1,1,0,0|1,0,0]=3 510 B15R2.29 Cc1ccc(cc1)Nc2cccnc2 1P002W9M [0,0,1,1,0,0|2,0,0]=4 511 B15R2.29 Cc1ccc(cc1)Oc2ccccc2 1P00AQEM [0,0,1,1,0,0|2,0,0]=4 512 B15R2.29 Cc1ccc(cc1)Sc2ccccc2 1P003M8J [0,0,1,1,0,0|2,0,0]=4 513 B15R2.29 Cc1ccc(nc1)Nc2ccccc2 1P024KQV [0,0,1,1,0,0|1,0,0]=3 514 B15R2.29 Clc1ccc(cc1)Nc2ccccc2 1P007QGN [0,0,1,1,0,0|2,0,0]=4 515 B15R2.29 Fc1ccc(cc1)Nc2ccccc2 1P003LW3 [0,0,1,1,0,0|2,0,0]=4 516 B15R2.29 Nc1ccc(cc1)Nc2ccccc2 1P003L7Z [0,0,1,1,0,0|2,0,0]=4 517 B15R2.29 Nc1ccc(cc1)Nc2ccccc2 1P003L80 [0,0,1,1,0,0|2,0,0]=4 518 B15R2.29 Nc1ccc(cc1)Nc2ccccc2 1P019GD6 [0,0,1,1,0,0|2,0,0]=4 519 B15R2.29 Nc1ccc(nc1)Nc2ccccc2 1P00DDPZ [0,0,1,1,0,0|2,0,0]=4 520 B15R2.29 Oc1ccc(cc1)Nc2ccccc2 1P001703 [0,0,1,1,0,0|2,0,0]=4 521 B15R2.988 O=c1[nH]c2ccccc2c(c1)C(=O)O 1P001PV5 [0,0,1,1,0,0|2,0,0]=4 522 B15R2.988 O=c1[nH]c2ccccc2c(c1)C(=O)O 1P00J1WD [0,0,1,1,0,0|2,0,0]=4 523 B15R2.988 O=c1[nH]c2ccccc2c(c1)C(C)C 1P028VDI [0,0,1,1,0,0|0,0,2]=4 524 B15R2.993 CN(\C=C/1\C(=O)Nc2c1cccc2)C 1P01BFSM [0,0,1,1,0,0|1,0,1]=4 525 B15R2.79765 C=CC(=O)N1CCCc2c1cccc2 1P01BAJR [0,0,1,1,0,0|0,0,2]=4 526 B15R3.3 c1ccc2c(c1)Cc3c2cccc3 1P0035E8 [1,0,0,1,0,0|2,0,0]=4 527 B15R3.3 c1ccc2c(c1)Pc3c2cccc3 1P006V09 [1,0,0,1,0,0|2,0,0]=4 528 B15R3.3 c1ccc2c(c1)[I+]c3c2cccc3 1P0036N6 [1,0,0,1,0,0|2,0,0]=4 529 B15R3.3 c1ccc2c(c1)[n-]c3c2cccc3 1P003P5T [1,0,0,1,0,0|2,0,0]=4 530 B15R3.3 c1ccc2c(c1)[nH]c3c2cccc3 1P00351K [1,0,0,1,0,0|2,0,0]=4 531 B15R3.3 c1ccc2c(c1)oc3c2cccc3 1P0010I5 [1,0,0,1,0,0|1,0,1]=4 532 B15R3.3 c1ccc2c(c1)sc3c2cccc3 1P0010I4 [1,0,0,1,0,0|1,1,0]=4 533 B17R3.56301 Cc1ccc(c2c1c3ccccc3[nH]2)C 1P0022CB [0,0,0,1,0,1|2,0,0]=4 534 B17R3.1513 COc1ccc2c(c1)c3ccccc3[nH]2 1P002EM7 [0,1,0,1,0,0|2,0,0]=4 535 B17R3.1513 COc1ccc2c(c1)c3ccccc3o2 1P0029G6 [0,1,0,1,0,0|1,0,1]=4 536 B17R3.1513 OCc1ccc2c(c1)c3ccccc3o2 1P004UH8 [0,1,0,1,0,0|1,0,1]=4 537 B17R3.18998 Cc1ccc2c(c1)c3ccccc3cc2 1P003483 [0,1,0,1,0,0|2,0,0]=4 538 B17R3.31713 Brc1ccc2c(c1)c3ccccc3C2=O 1P00BH1D [0,1,0,1,0,0|2,0,0]=4 539 B17R3.31627 Cc1ccc2c(c1)c3cc(C)ccc3[nH]2 1P0037QK [0,1,0,1,0,0|2,0,0]=4 540 B17R3.31627 Cc1ccc2c(c1)c3cc(C)ccc3s2 1P003GNY [0,1,0,1,0,0|1,1,0]=4 541 B17R3.34483 Cc1cc(C)c2c(c1)c3ccccc3[nH]2 1P002EKW [0,1,0,1,0,0|2,0,0]=4 542 B13R1.45 CN(C=CC(=O)c1ccccc1)C 1P000QRF [0,0,1,0,1,0|1,0,1]=4 543 B13R1.45 CN(\C=C\C(=O)c1ccccc1)C 1P007B6H [0,0,1,0,1,0|1,0,1]=4 544 B13R1.45 O=C(c1ccccc1)C=CC(=O)O 1P00E9PD [0,0,1,0,1,0|2,0,0]=4 545 B13R1.45 O=C(c1ccccc1)\C=C\C(=O)O 1P00268F [0,0,1,0,1,0|2,0,0]=4 546 B13R1.348 O=C(Nc1ccccc1)C=C(C)C 1P0010NL [0,0,1,0,1,0|0,0,1]=3 547 B13R1.348 O=C(Nc1ccccc1)CC(=O)C 1P0006P0 [0,0,1,0,1,0|1,0,1]=4 548 B13R2.10 Brc1ccn(n1)c2ccccc2 1P00DR8T [1,0,0,0,1,0|2,0,0]=4 549 B13R2.10 Brc1cnn(c1)c2ccccc2 1P001NLH [1,0,0,0,1,0|2,0,0]=4 550 B13R2.10 Brc1ncn(c1)c2ccccc2 1P01KAZ3 [1,0,0,0,1,0|2,0,0]=4 551 B13R2.10 Cc1c[nH]c(c1)c2ccccc2 1P01CATU [1,0,0,0,1,0|2,0,0]=4 552 B13R2.10 Cc1ccn(n1)c2ccccc2 1P003K5I [1,0,0,0,1,0|1,0,0]=3 553 B13R2.10 Cc1cnn(c1)c2ccncc2 1P019ZQM [1,0,0,0,1,0|2,0,0]=4 554 B13R2.10 Clc1cnn(c1)c2ccccc2 1P00FCTG [1,0,0,0,1,0|2,0,0]=4 555 B13R2.10 Ic1ccn(n1)c2ccccc2 1P003M0V [1,0,0,0,1,0|2,0,0]=4 556 B13R2.10 Ic1cnn(c1)c2ccccc2 1P00BG0A [1,0,0,0,1,0|2,0,0]=4 557 B13R2.10 Nc1ccn(n1)c2ccccc2 1P0039FF [1,0,0,0,1,0|2,0,0]=4 558 B13R2.10 Nc1ccn(n1)c2ccccc2 1P00A1BR [1,0,0,0,1,0|2,0,0]=4 559 B13R2.10 Nc1cnn(c1)c2ccccc2 1P0095OB [1,0,0,0,1,0|2,0,0]=4 560 B13R2.10 O=c1ccn([nH]1)c2ccccc2 1P0003DZ [1,0,0,0,1,0|2,0,0]=4 561 B13R2.10 Oc1cnn(c1)c2ccccc2 1P009QWG [1,0,0,0,1,0|2,0,0]=4 562 B13R2.13 Cc1cccc(c1)c2ccc[nH]2 1P008QHC [1,0,0,0,1,0|2,0,0]=4 563 B13R2.15 Brc1nccn1c2ccccc2 1P007XZ2 [1,0,0,0,1,0|2,0,0]=4 564 B13R2.15 Cc1ccnn1c2ccccc2 1P0065CH [1,0,0,0,1,0|1,0,0]=3 565 B13R2.15 Cc1nccn1c2cccnc2 1P004T7R [1,0,0,0,1,0|2,0,0]=4 566 B13R2.15 Fc1ccnn1c2ccccc2 1P01B97O [1,0,0,0,1,0|2,0,0]=4 567 B13R2.15 Ic1ccnn1c2ccccc2 1P009YUG [1,0,0,0,1,0|2,0,0]=4 568 B13R2.15 N=c1[nH]ccn1c2ccccc2 1P00I4OK [1,0,0,0,1,0|2,0,0]=4 569 B13R2.15 Nc1ccnn1c2ccccc2 1P0034N9 [1,0,0,0,1,0|2,0,0]=4 570 B13R2.15 O=c1[nH]ccn1c2ccccc2 1P00J387 [1,0,0,0,1,0|2,0,0]=4 571 B13R2.15 O=c1cc[nH]n1c2ccccc2 1P01KL8X [1,0,0,0,1,0|2,0,0]=4 572 B13R2.15 Oc1ccnn1c2ccccc2 1P0036S1 [1,0,0,0,1,0|2,0,0]=4 573 B13R2.15 S=c1[nH]ccn1c2ccccc2 1P00207M [1,0,0,0,1,0|2,0,0]=4 574 B13R2.373 O=C1C(=C)CN1c2ccccc2 1P01C2TE [0,0,0,0,2,0|0,0,2]=4 575 B15R1.1081 CN(C\C=C\C(=O)Nc1ccccc1)C 1P0289BB [0,0,1,0,0,1|1,0,1]=4 576 B15R2.31 Brc1cccc(c1)Cc2ccccc2 1P002V8N [1,0,0,0,0,1|2,0,0]=4 577 B15R2.31 Brc1cccc(c1)Nc2ccccc2 1P00GTWL [1,0,0,0,0,1|2,0,0]=4 578 B15R2.31 Brc1cccc(c1)Oc2ccccc2 1P003JKZ [1,0,0,0,0,1|2,0,0]=4 579 B15R2.31 Brc1cccc(c1)Sc2ccccc2 1P023PSO [1,0,0,0,0,1|2,0,0]=4 580 B15R2.31 Cc1cccc(c1)Cc2ccccc2 1P00EK54 [1,0,0,0,0,1|1,0,0]=3 581 B15R2.31 Cc1cccc(c1)Nc2ccccc2 1P003K7V [1,0,0,0,0,1|1,0,0]=3 582 B15R2.31 Cc1cccc(c1)Oc2ccccc2 1P003KBW [1,0,0,0,0,1|1,0,0]=3 583 B15R2.31 Clc1cccc(c1)Nc2ccccc2 1P0003WE [1,0,0,0,0,1|2,0,0]=4 584 B15R2.31 Fc1cccc(c1)Nc2ccccc2 1P006WU1 [1,0,0,0,0,1|2,0,0]=4 585 B15R2.31 Ic1cccc(c1)Cc2ccccc2 1P020LI6 [1,0,0,0,0,1|2,0,0]=4 586 B15R2.31 Ic1cccc(c1)Oc2ccccc2 1P01JMS3 [1,0,0,0,0,1|2,0,0]=4 587 B15R2.31 Nc1cccc(c1)Cc2ccccc2 1P003JFB [1,0,0,0,0,1|2,0,0]=4 588 B15R2.31 Nc1cccc(c1)Nc2ccccc2 1P00ECZ7 [1,0,0,0,0,1|2,0,0]=4 589 B15R2.31 Nc1cccc(c1)Nc2ccccc2 1P00FAER [1,0,0,0,0,1|2,0,0]=4 590 B15R2.31 Nc1cccc(c1)Oc2ccccc2 1P003KBN [1,0,0,0,0,1|2,0,0]=4 591 B15R2.31 Nc1cccc(c1)Sc2ccccc2 1P01AH79 [1,0,0,0,0,1|2,0,0]=4 592 B15R2.31 Nc1cccc(c1)Sc2ccccc2 1P01B6SY [1,0,0,0,0,1|2,0,0]=4 593 B15R2.31 Oc1ccc[n+](c1)Cc2ccccc2 1P00C0TO [1,0,0,0,0,1|1,0,1]=4 594 B15R2.31 Oc1cccc(c1)Cc2ccccc2 1P006ZJ4 [1,0,0,0,0,1|2,0,0]=4 595 B15R2.31 Oc1cccc(c1)Nc2ccccc2 1P0003WD [1,0,0,0,0,1|2,0,0]=4 596 B15R2.31 Oc1cccc(c1)Oc2ccccc2 1P003KBP [1,0,0,0,0,1|2,0,0]=4 597 B15R2.31 Sc1cccc(c1)Oc2ccccc2 1P01X93N [1,0,0,0,0,1|2,0,0]=4 598 B15R2.325 Cc1nn(c(c1)C)Cc2ccccc2 1P009L7C [0,0,0,0,1,1|2,0,0]=4 599 B15R2.325 Cc1nn(c(c1)N)Cc2ccccc2 1P0008WH [0,0,0,0,1,1|2,0,0]=4 600 B15R2.325 O=C1CC(=NN1Cc2ccccc2)C 1P0069VT [0,0,0,0,1,1|1,0,1]=4 601 B17R2.5365 Cc1ccc(c(c1)OCc2ccccc2)N 1P019WCE [0,0,0,0,0,2|2,0,0]=4 602 B17R2.5365 Cc1ccc(c(c1)\N=N\c2ccccc2)O 1P003IBT [0,0,0,0,0,2|1,0,1]=4 603 B17R2.5365 O=C/1C=CC(=N\C1=N/Nc2ccccc2)C 1P00C0QT [0,0,0,0,0,2|2,0,0]=4