0 B17R2.143 C1=CC=C(C=C1)CC(=O)NC2=NC=CC=N2 3423290 [0,0,0,0,0,0|3,0,0]=3 1 B17R2.143 C1=CC=C(C=C1)CC(CC2=CC=CC=C2)N 202208 [0,0,0,0,0,0|1,0,1]=2 2 B17R2.143 C1=CC=C(C=C1)CS(=O)CC2=CC=CC=C2 12116 [0,0,0,0,0,0|1,0,0]=1 3 B17R2.143 C1=CC=C(C=C1)C[P+](=O)CC2=CC=CC=C2 6339579 [0,0,0,0,0,0|1,0,0]=1 4 B17R2.143 C1=CC=C(C=C1)NC(=O)C[N+]2=CC=CC=C2 459590 [0,0,0,0,0,0|2,0,0]=2 5 B18R2.199 C1=CC(=CN=C1)CN(CC2=CN=CC=C2)N=O 280147 [0,1,0,0,0,0|3,0,0]=4 6 B18R2.266 C1=CC=C(C=C1)CC(=O)NC2=CC=C(C=C2)F 531987 [0,1,0,0,0,0|1,0,0]=2 7 B18R2.266 C1=CN=C(N=C1)NC(=O)CC2=CC=C(C=C2)Cl 669885 [0,1,0,0,0,0|3,0,0]=4 8 B18R2.266 CC1=CC=C(C=C1)CC(=O)NC2=CN=CC=C2 890802 [0,1,0,0,0,0|2,0,0]=3 9 B18R2.3983 C1=CC=C(C=C1)CC(=O)NC2=C(C=CC=N2)Cl 903998 [0,1,0,0,0,0|2,0,0]=3 10 B18R2.3983 CC1=CC=CC=C1CC(=O)NC2=CN=CC=C2 6465482 [0,1,0,0,0,0|2,0,0]=3 11 B18R2.6478 CC1=CC(=CC=C1)NC(=O)C[N+]2=CC=CC=C2 12331234 [0,1,0,0,0,0|2,0,0]=3 12 B18R2.7204 CC(=CC1=CC=CC=C1)C(=O)C2=CC=CC=C2 99812 [0,1,0,0,0,0|1,0,2]=4 13 B18R2.7204 CN(C1=CC=CC=C1)C(=S)NC2=CC=CC=C2 677665 [0,1,0,0,0,0|2,1,0]=4 14 B18R2.32233 C1=CC=C(C=C1)CS(=O)(=O)NC2=CC=CC=C2 669287 [0,1,0,0,0,0|2,0,0]=3 15 B18R2.32233 C1=CC=C(C=C1)NP(=O)(N)NC2=CC=CC=C2 245525 [0,1,0,0,0,0|3,0,0]=4 16 B18R2.32233 C1=CC=C(C=C1)OP(=O)(N)OC2=CC=CC=C2 74836 [0,1,0,0,0,0|3,0,0]=4 17 B18R3.182 C1=CC=C(C=C1)N2C3=C(C=NC=C3)NC2=O 659338 [0,0,0,1,0,0|3,0,0]=4 18 B18R3.12875 C1=CC=C(C=C1)CC2=NC3=CC=CC=C3N2 12132 [0,0,0,1,0,0|2,0,0]=3 19 B16R2.88 C1=CC=C(C=C1)C(CC2=CN=CC=C2)O 238338 [0,0,0,0,1,0|1,0,2]=4 20 B16R2.88 C1=CC=C(C=C1)CS(=O)C2=CC=CC=C2 239581 [0,0,0,0,1,0|1,0,0]=2 21 B16R2.88 C1=CC=C(C=C1)\C=[N+](\C2=CC=CC=C2)/[O-] 3036381 [0,0,0,0,1,0|1,0,2]=4 22 B16R2.88 C1=CC=NC(=C1)NC(=O)C2=CN=CC=C2 83187 [0,0,0,0,1,0|3,0,0]=4 23 B16R2.524 C1=CC=C(C=C1)CC(=O)NC2=NC=CS2 562362 [0,0,0,0,1,0|3,0,0]=4 24 B18R2.2429 C1=CC=C(C=C1)CC(=O)NCC2=CN=CC=C2 1089285 [0,0,0,0,0,1|1,0,0]=2 25 B18R2.2429 CN(CC1=CC=CC=C1)N=NC2=CC=CC=C2 282532 [0,0,0,0,0,1|3,0,0]=4 26 B17R2.5301 C1=CC(=CC(=C1)Br)CNCC2=CC=NC=C2 834405 [1,1,0,0,0,0|2,0,0]=4 27 B17R2.162 C1=CC=C(C=C1)C(=NC2=CC=CC=C2)C#N 231999 [0,1,0,0,1,0|2,0,0]=4 28 B17R2.162 C1=CC=C(C=C1)C=C(C=O)C2=CC=CC=C2 139550 [0,1,0,0,1,0|0,0,1]=3 29 B17R2.162 C1=CC=C(C=C1)\C(=N/O)\CC2=CC=CC=N2 5718849 [0,1,0,0,1,0|1,0,1]=4 30 B17R2.192 C1=CC(=CC=C1C(=O)NC2=CC=NC=C2)Cl 689742 [0,1,0,0,1,0|2,0,0]=4 31 B17R2.3417 C1=CC=C(C(=C1)C(=O)NC2=CN=CC=C2)F 677046 [0,1,0,0,1,0|2,0,0]=4 32 B17R2.3426 C1=CC=C(C=C1)C(=O)OC2=CC=CNC2=O 320594 [0,1,0,0,1,0|2,0,0]=4 33 B17R2.3426 CC1=CC=CC=C1OC(=O)C2=CN=CC=C2 829373 [0,1,0,0,1,0|2,0,0]=4 34 B17R2.3426 CC1=CC=CC=[N+]1CC(=O)C2=CC=CC=C2 12316824 [0,1,0,0,1,0|1,0,0]=3 35 B17R2.5273 C1=CC(=CC(=C1)F)C(=O)NC2=CN=CC=C2 773637 [0,1,0,0,1,0|2,0,0]=4 36 B17R2.5293 C1=CC(=CC(=C1)F)NC(=O)C2=CN=CC=C2 669130 [0,1,0,0,1,0|2,0,0]=4 37 B17R2.5293 C1=CC=C(C=C1)C(=O)C[N+]2=CC=CC(=C2)N 2831569 [0,1,0,0,1,0|1,0,0]=3 38 B17R2.5293 CC1=CC(=CC=C1)OC(=O)C2=CN=CC=C2 532681 [0,1,0,0,1,0|2,0,0]=4 39 B17R2.5293 C[N+]1=CC=CC(=C1)NC(=O)C2=CC=CC=C2 435107 [0,1,0,0,1,0|2,0,0]=4 40 B17R2.20249 C1=CC=C(C=C1)CP(=O)(C2=CC=CC=C2)O 279489 [0,1,0,0,1,0|1,0,0]=3 41 B17R2.20249 C1=CC=C(C=C1)OP(=O)(C2=CC=CC=C2)N 230484 [0,1,0,0,1,0|2,0,0]=4 42 B17R2.3431 CC1=CC=CC=C1NC(=O)CC2=CC=CS2 670140 [0,1,0,0,1,0|2,0,0]=4 43 B19R2.286 C1=CC=C(C=C1)NC(=O)CSC2=CC=C(C=C2)Cl 302745 [0,1,0,0,0,1|1,0,0]=3 44 B19R2.286 CC1=CC=C(C=C1)SCC(=O)NC2=CN=CC=C2 817616 [0,1,0,0,0,1|2,0,0]=4 45 B19R2.4485 C1=CC=C(C(=C1)CC(=O)NCC2=CN=CC=C2)Cl 2971027 [0,1,0,0,0,1|1,0,0]=3 46 B19R2.4485 C1=CC=C(C(=C1)NC(=O)NCC2=CC=NC=C2)F 310676 [0,1,0,0,0,1|2,0,0]=4 47 B19R2.4485 C1=CC=C(C(=C1)NC(=O)NCC2=CN=CC=C2)Cl 4426513 [0,1,0,0,0,1|2,0,0]=4 48 B19R2.4485 C1=CC=C(C(=C1)NC(=O)NCC2=CN=CC=C2)F 901030 [0,1,0,0,0,1|2,0,0]=4 49 B19R2.4485 CC1=CC=CC=C1NC(=O)NCC2=CC=CC=N2 901028 [0,1,0,0,0,1|2,0,0]=4 50 B19R2.4485 CC1=CC=CC=C1NC(=O)NCC2=CN=CC=C2 853674 [0,1,0,0,0,1|2,0,0]=4 51 B19R2.7672 CC1=CC(=CC=C1)OCC(=O)NC2=CC=NC=C2 814788 [0,1,0,0,0,1|2,0,0]=4 52 B19R2.8924 CN(CC1=CC=CC=C1)C(=O)CC2=CC=CC=C2 692800 [0,1,0,0,0,1|0,0,0]=2 53 B19R2.8929 C1=CC=C(C=C1)C(CC(=O)NC2=CC=CC=N2)O 268039 [0,1,0,0,0,1|2,0,0]=4 54 B19R2.11857 C1=CC=NC(=C1)CNC(=O)NC2=CC=C(C=C2)Cl 853195 [0,1,0,0,0,1|2,0,0]=4 55 B19R2.11857 C1=CC=NC(=C1)CNC(=O)NC2=CC=C(C=C2)F 882129 [0,1,0,0,0,1|2,0,0]=4 56 B19R2.55 COC1=CC=C(C=C1)CC(=O)NC2=CN=CC=C2 799060 [0,2,0,0,0,0|2,0,0]=4 57 B19R2.281 CC1=C(C=C(C=C1)NC(=O)C[N+]2=CC=CC=C2)C 12331236 [0,2,0,0,0,0|2,0,0]=4 58 B19R2.281 CC1=C(C=CC(=C1)OC(=O)NC2=CC=CC=C2)Cl 302777 [0,2,0,0,0,0|2,0,0]=4 59 B19R2.4181 CN(C1=CC=CC=C1)C(=O)OC2=CC=C(C=C2)F 2929031 [0,2,0,0,0,0|2,0,0]=4 60 B19R2.4188 C1=CC=C(C=C1)CS(=O)(=O)NC2=CC=C(C=C2)F 669259 [0,2,0,0,0,0|2,0,0]=4 61 B19R2.11856 CC1=CC=C(C=C1)CC(=O)NC2=NC=CC(=C2)C 891259 [0,2,0,0,0,0|2,0,0]=4 62 B19R2.11856 CC1=CC=[N+](C=C1)CC(=O)NC2=CC=CC(=C2)C 24747032 [0,2,0,0,0,0|2,0,0]=4 63 B19R2.12272 C1=CC(=C(N=C1)Cl)NC(=O)CC2=CC=C(C=C2)Cl 949631 [0,2,0,0,0,0|2,0,0]=4 64 B19R2.12272 C1=CC=C(C(=C1)CC(=O)NC2=CN=C(C=C2)Cl)F 852618 [0,2,0,0,0,0|2,0,0]=4 65 B19R2.3385 COC1=CC=CC=C1NC(=O)C[N+]2=CC=CC=C2 12268923 [0,2,0,0,0,0|2,0,0]=4 66 B19R2.5654 C1=CC=C(C=C1)CS(=O)(=O)NC2=CC=CC=C2Br 884918 [0,2,0,0,0,0|2,0,0]=4 67 B19R2.7682 C1=CC(=C(C(=C1)Cl)CC(=O)NC2=CN=CC=C2)F 974103 [0,2,0,0,0,0|2,0,0]=4 68 B19R2.899 C1=CC=C(C=C1)NC(=O)OC2=CC=CC(=C2)C=O 37618 [0,2,0,0,0,0|2,0,0]=4 69 B19R2.4107 CC1=CC(=CC(=C1)NC(=O)C[N+]2=CC=CC=C2)C 24746820 [0,2,0,0,0,0|2,0,0]=4 70 B19R2.4380 C1=CC=C(C=C1)CS(=O)(=O)NC2=CC(=CC=C2)Br 772065 [0,2,0,0,0,0|2,0,0]=4 71 B19R2.4384 CC1=CC(=CC=C1)NC(=O)C[N+]2=CC=CC(=C2)C 24747104 [0,2,0,0,0,0|2,0,0]=4 72 B19R2.4384 CC1=C[N+](=CC=C1)CC(=O)NC2=CC(=CC=C2)Cl 23724254 [0,2,0,0,0,0|2,0,0]=4 73 B19R2.8927 C1=CC=C(C=C1)NC(=O)P(=O)(C2=CC=CC=C2)O 243338 [0,2,0,0,0,0|2,0,0]=4 74 B19R3.288 C1=CC=C(C=C1)CN2C3=CC=CC=C3NC2=O 736505 [0,0,0,1,0,1|1,0,0]=3 75 B19R3.298 C1C(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3 97891 [0,0,0,1,0,1|1,0,0]=3 76 B19R3.19255 C1=CC=C(C=C1)CCC2=CC3=CC=CC=C3N2 10727712 [0,0,0,1,0,1|1,0,1]=4 77 B19R3.182 C1C2=CC=CC=C2C(=O)N1CC3=CC=CC=C3 1485883 [0,1,0,1,0,0|1,0,0]=3 78 B19R3.241821 CC1=CC=C(C=C1)CC2=NC3=CC=CC=C3N2 772158 [0,1,0,1,0,0|2,0,0]=4 79 B19R3.291 C1[C@H]([C@@H](OC2=CC=CC=C21)C3=CC=CC=C3)O 7309334 [0,1,0,1,0,0|0,0,2]=4 80 B19R3.54463 CC1=CC(=CC=C1)CC2=NC3=CC=CC=C3N2 225501 [0,1,0,1,0,0|2,0,0]=4 81 B19R3.8766 C1=CC=C(C=C1)C2(C3=CC=CC=C3NC2=O)O 15806 [0,1,0,1,0,0|1,0,0]=3 82 B15R2.2195 C1=CC=C(C=C1)CCC2=CC=CC=N2 75028 [1,0,0,0,1,0|1,0,0]=3 83 B15R2.2195 C1=CC=C(C=C1)CCC2=CN=CC=C2 238337 [1,0,0,0,1,0|1,0,0]=3 84 B15R2.2195 C1=CC=C(C=C1)CNC2=CC=CC=[NH+]2 2830234 [1,0,0,0,1,0|2,0,0]=4 85 B15R2.2195 C1=CC=C(C=C1)CNC2=CN=CC=C2 279908 [1,0,0,0,1,0|2,0,0]=4 86 B15R2.2196 C1=CC=C(C=C1)CNCC2=CC=CO2 17386544 [1,0,0,0,1,0|2,0,0]=4 87 B15R2.1259 C1=CC=C(C=C1)C(=O)CN2C=CC=N2 2766375 [0,0,0,0,2,0|2,0,0]=4 88 B15R2.2226 C1=CC=C(C=C1)S(=O)C2=CC=CC=C2 13679 [0,0,0,0,2,0|1,0,0]=3 89 B17R2.2382 C1=CC=C(C=C1)CCCCC2=CC=CC=N2 225399 [1,0,0,0,0,1|1,0,1]=4 90 B19R2.8900 C1=CC=C(C=C1)CC(=O)NN=CC2=CC=CC=C2 250616 [0,0,0,0,0,2|0,0,1]=3 91 B19R2.8900 C1=CC=C(C=C1)CCNC(=S)CC2=CC=CC=C2 3381593 [0,0,0,0,0,2|0,1,0]=3 92 B19R2.16162 C1=CC=C(C=C1)CCC(=O)NCC2=CC=CC=C2 730453 [0,0,0,0,0,2|0,0,0]=2 93 B19R2.16162 C1=CC=C(C=C1)CCC(=O)NCC2=CC=NC=C2 871256 [0,0,0,0,0,2|1,0,0]=3 94 B19R2.16162 C1=CC=C(C=C1)CNC(=S)NCC2=CC=CC=N2 2824624 [0,0,0,0,0,2|1,1,0]=4 95 B19R2.16162 C1=CC=C(C=C1)SCC(=O)NCC2=CC=CC=N2 817456 [0,0,0,0,0,2|1,0,0]=3 96 B19R2.16162 C1=CC=C(C=C1)\C=C\C(=O)NCC2=CN=CC=C2 5546298 [0,0,0,0,0,2|1,0,1]=4