0 B17R1.626 CCN(CC)CCNC(=O)C1=CC=C(C=C1)I Z27720938 [0,0,0,0,0,0|2,0,0]=2 1 B17R1.626 CCN(CC)CCNC(=O)C1=CC=C(C=C1)N Z104477706 [0,0,0,0,0,0|1,0,0]=1 2 B17R1.626 CCN(CC)CCNC(=O)C1=CC=C(C=C1)O Z68117995 [0,0,0,0,0,0|2,0,0]=2 3 B17R1.626 CCN(CC)CCOC(=O)C1=CC=C(C=C1)N Z104476766 [0,0,0,0,0,0|0,0,0]=0 4 B18R1.287 CCN(CC)CCNC(=O)C1=CC=C(C=C1)CN Z406680026 [0,1,0,0,0,0|1,0,0]=2 5 B18R1.570 CCN(CC)CCNS(=O)(=O)C1=CC=C(C=C1)Br Z45507872 [0,1,0,0,0,0|3,0,0]=4 6 B18R1.570 CCN(CC)CCNS(=O)(=O)C1=CC=C(C=C1)Cl Z48800803 [0,1,0,0,0,0|3,0,0]=4 7 B18R1.167384 CCN(CC)CCNC(=O)C1=C(C=C(C=C1)Br)F Z108604700 [0,1,0,0,0,0|2,0,0]=3 8 B18R1.167384 CCN(CC)CCNC(=O)C1=C(C=C(C=C1)C)C Z31448437 [0,1,0,0,0,0|2,0,0]=3 9 B18R1.167384 CCN(CC)CCNC(=O)C1=C(C=C(C=C1)N)C Z877632786 [0,1,0,0,0,0|1,0,0]=2 10 B18R1.167384 CCN(CC)CCNC(=O)C1=C(C=C(C=C1)N)F Z851815248 [0,1,0,0,0,0|1,0,0]=2 11 B18R1.167384 CCN(CC)CCOC(=O)C1=C(C=C(C=C1)N)Cl Z802864938 [0,1,0,0,0,0|0,0,0]=1 12 B18R2.99 CCN1CCN(CC1)C(=O)C2=CC=C(C=C2)Cl Z107728886 [0,0,0,1,0,0|2,0,0]=3 13 B18R2.99 CCN1CCN(CC1)C(=O)C2=CC=C(C=C2)F Z31472195 [0,0,0,1,0,0|2,0,0]=3 14 B18R2.99 CCN1CCN(CC1)C(=O)C2=CC=C(C=C2)I Z27743465 [0,0,0,1,0,0|2,0,0]=3 15 B18R2.99 CCN1CCN(CC1)C(=O)C2=CC=C(C=C2)N Z234897687 [0,0,0,1,0,0|1,0,0]=2 16 B18R2.99 CCN1CCN(CC1)C(=O)C2=CC=[N+](C=C2)[O-] Z31472803 [0,0,0,1,0,0|3,0,0]=4 17 B18R2.99 CCN1CCN(CC1)C(=O)C2=CN=C(C=C2)C Z237772838 [0,0,0,1,0,0|3,0,0]=4 18 B18R2.99 CCN1CCN(CC1)C(=O)C2=CN=C(C=C2)Cl Z31472390 [0,0,0,1,0,0|3,0,0]=4 19 B18R2.99 CCN1CCN(CC1)C(=O)C2=CN=C(C=C2)N Z1869802209 [0,0,0,1,0,0|2,0,0]=3 20 B18R2.99 NC1=CC=C(C=C1)C(=O)N2CCC(CC2)CO Z380969636 [0,0,0,1,0,0|3,0,0]=4 21 B18R2.9270 NC1=CC=C(C=C1)C(=O)NCCN2CCCC2 Z425845406 [0,0,0,1,0,0|1,0,0]=2 22 B18R1.25741 CCN(CC)CCNC(=O)NC1=CC=C(C=C1)F Z44585174 [0,0,0,0,0,1|2,0,0]=3 23 B15R1.452 CCN(CC)CCNCC1=CC=CC=C1 Z111521758 [2,0,0,0,0,0|1,0,1]=4 24 B15R1.882 CN(C)CCNC(=O)C1=CC=C(C=C1)Br Z30277689 [2,0,0,0,0,0|2,0,0]=4 25 B15R1.882 CN(C)CCNC(=O)C1=CC=C(C=C1)N Z239124768 [2,0,0,0,0,0|1,0,0]=3 26 B17R1.591 CCN(CC)CCNS(=O)(=O)C1=CC=CC=C1 Z48800807 [1,1,0,0,0,0|2,0,0]=4 27 B17R1.627 CCN(CC)CCNC(=O)C1=CC(=CC=C1)N Z239892184 [1,1,0,0,0,0|1,0,0]=3 28 B17R1.627 CCN(CC)CCNC(=O)C1=CC(=CN=C1)Br Z27720984 [1,1,0,0,0,0|2,0,0]=4 29 B17R1.15639 CCN(CC)CCNC(=O)C1=C(C=CC=C1)Cl Z31448019 [1,1,0,0,0,0|1,0,0]=3 30 B17R1.15639 CCN(CC)CCNC(=O)C1=C(C=CC=C1)I Z27720966 [1,1,0,0,0,0|1,0,0]=3 31 B17R1.15639 CCN(CC)CCNC(=O)C1=C(C=CC=C1)O Z68118006 [1,1,0,0,0,0|1,0,0]=3 32 B17R1.210 C#CC1=CC=C(C=C1)C(=O)NCCN(C)CC Z2878874825 [1,1,0,0,0,0|2,0,0]=4 33 B17R1.1061 CC(C)N(C)CCNC(=O)C1=CC=C(C=C1)F Z994006938 [1,1,0,0,0,0|2,0,0]=4 34 B17R1.139047 CCN(C)CCNC(=O)C1=C(C=C(C=C1)N)Cl Z993995058 [1,1,0,0,0,0|1,0,0]=3 35 B19R1.7248 CCN(CC)C(=O)CCCC(=O)C1=CC=C(C=C1)Br Z1890002947 [0,1,0,0,0,1|2,0,0]=4 36 B19R1.15153 CCN(CC)CCCNC(=O)C1=CC=C(C=C1)OC Z32747308 [0,1,0,0,0,1|2,0,0]=4 37 B19R1.267253 CCN(CC)CCCNC(=O)C1=C(C=C(C=C1)N)Cl Z1449624366 [0,1,0,0,0,1|1,0,0]=3 38 B19R1.7253 CCN(CC)C(C)CNC(=O)NC1=CC=C(C=C1)Cl Z402478826 [0,1,0,0,0,1|2,0,0]=4 39 B19R1.14840 CCC1=CC=C(C=C1)C(=O)OCC(=O)N(CC)CC Z18503463 [0,2,0,0,0,0|1,0,1]=4 40 B19R1.267752 CCN(CC)C(=O)COC(=O)C1=C(C=C(C=C1)O)O Z25218357 [0,2,0,0,0,0|1,0,1]=4 41 B19R1.924697 CCN(CC)CC(C)NC(=O)C1=C(C=C(C=C1)N)Cl Z904994254 [0,2,0,0,0,0|1,0,0]=3 42 B19R1.924697 CCN(CC)CC(C)OC(=O)C1=C(C=C(C=C1)Cl)Cl Z56906739 [0,2,0,0,0,0|1,0,0]=3 43 B19R1.89875 CCN(CC)CCNC(=O)C1=C(C=C(C=C1)N)OC Z1464110569 [0,2,0,0,0,0|1,0,0]=3 44 B19R1.89875 CCN(CC)CCNC(=O)C1=C(C=C(C=C1)O)OC Z2524928902 [0,2,0,0,0,0|2,0,0]=4 45 B17R2.2 CCN1CCN(CC1)CC2=CC=C(C=C2)N Z240089324 [1,0,0,1,0,0|1,0,1]=4 46 B17R2.68 CCN1CCN(CC1)C(=O)C2=CC=CC=C2 Z31472242 [1,0,0,1,0,0|1,0,0]=3 47 B17R2.68 CCN1CCN(CC1)C(=O)C2=CC=NC=C2 Z31472190 [1,0,0,1,0,0|2,0,0]=4 48 B17R2.68 CCN1CCN(CC1)C(=O)C2=CN=CC=C2 Z31472199 [1,0,0,1,0,0|2,0,0]=4 49 B17R2.68 CCN1CCN(CC1)C(=O)C2=NC=CC=C2 Z31472116 [1,0,0,1,0,0|2,0,0]=4 50 B17R2.217 CC1CCN(CC1)C(=O)C2=CC=C(C=C2)N Z111686258 [1,0,0,1,0,0|2,0,0]=4 51 B17R2.217 CN1CCN(CC1)C(=O)C2=CC=C(C=C2)Br Z27705141 [1,0,0,1,0,0|2,0,0]=4 52 B17R2.217 CN1CCN(CC1)C(=O)C2=CC=C(C=C2)F Z31434043 [1,0,0,1,0,0|2,0,0]=4 53 B17R2.217 CN1CCN(CC1)C(=O)C2=CC=C(C=C2)I Z27705152 [1,0,0,1,0,0|2,0,0]=4 54 B17R2.217 CN1CCN(CC1)C(=O)C2=CC=C(C=C2)N Z239124496 [1,0,0,1,0,0|1,0,0]=3 55 B19R2.113 CCN1CCN(CC1)CC(=O)C2=CC=C(C=C2)C Z56042011 [0,0,0,1,0,1|2,0,0]=4 56 B19R2.176320 CCN1CCCN(CC1)C(=O)C2=CC=C(C=C2)Br Z974421648 [0,0,0,1,0,1|2,0,0]=4 57 B19R2.176320 CCN1CCCN(CC1)C(=O)C2=CC=C(C=C2)Cl Z821848496 [0,0,0,1,0,1|2,0,0]=4 58 B19R2.176320 CCN1CCCN(CC1)C(=O)C2=CC=C(C=C2)F Z321256204 [0,0,0,1,0,1|2,0,0]=4 59 B19R2.82 CCN1CCN(CC1)C(=O)CC2=CC=C(C=C2)N Z240086676 [0,0,0,1,0,1|1,0,0]=3 60 B19R2.82 CCN1CCN(CC1)C(=O)NC2=CC=C(C=C2)Br Z409537660 [0,0,0,1,0,1|2,0,0]=4 61 B19R2.82 CCN1CCN(CC1)C(=O)NC2=CC=C(C=C2)C Z44585618 [0,0,0,1,0,1|2,0,0]=4 62 B19R2.82 CCN1CCN(CC1)C(=O)NC2=CC=C(C=C2)Cl Z44585592 [0,0,0,1,0,1|2,0,0]=4 63 B19R2.3258 CCN1CCCC(C1)OC(=O)C2=CC=C(C=C2)Br Z26749925 [0,1,0,1,0,0|1,0,0]=3 64 B19R2.4201 NC1=CC=C(C=C1)C(=O)NCCN2CCOCC2 Z240087956 [0,1,0,1,0,0|1,0,0]=3 65 B19R2.4201 O=C(CCCN1CCCCC1)C2=CC=C(C=C2)F Z137503452 [0,1,0,1,0,0|2,0,0]=4 66 B19R2.4201 O=C(NCCN1CCCCC1)C2=CC=C(C=C2)I Z422647636 [0,1,0,1,0,0|2,0,0]=4 67 B19R2.4201 O=C(NCCN1CCOCC1)C2=CC=C(C=C2)Cl Z32409934 [0,1,0,1,0,0|2,0,0]=4 68 B19R2.4201 O=C(OCCN1CCCCC1)C2=CC=C(C=C2)O Z252955710 [0,1,0,1,0,0|1,0,0]=3 69 B19R2.4313 CC1=CC=C(C=C1)C(=O)N2CCN(CC2)CCO Z57704281 [0,1,0,1,0,0|2,0,0]=4 70 B19R2.11963 O=C(OCCN1CCCC1=O)C2=CC=C(C=C2)Br Z30867421 [0,1,0,1,0,0|1,0,1]=4 71 B19R2.13849 CCN1CCCC1CNC(=O)C2=CC=C(C=C2)Br Z29697518 [0,1,0,1,0,0|2,0,0]=4 72 B19R2.13849 CCN1CCCC1CNC(=O)C2=CC=C(C=C2)F Z68672346 [0,1,0,1,0,0|2,0,0]=4 73 B19R2.13849 CCN1CCCC1CNC(=O)C2=CC=C(C=C2)I Z29697529 [0,1,0,1,0,0|2,0,0]=4 74 B19R2.5079 CCN1CCN(CC1)C(=O)C2=CC=C(C=C2)C#N Z31472391 [0,1,0,1,0,0|1,0,1]=4 75 B19R2.5079 CCN1CCN(CC1)C(=O)C2=CC=C(C=C2)OC Z31472228 [0,1,0,1,0,0|2,0,0]=4 76 B19R2.5079 CCN1CCN(CC1)C(=O)C2=CC=C(C=C2)SC Z51817504 [0,1,0,1,0,0|2,0,0]=4 77 B19R2.5336 NCC1=CC=C(C=C1)C(=O)NCCN2CCCC2 Z1266823248 [0,1,0,1,0,0|1,0,0]=3 78 B19R2.94 CCN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)N Z147642686 [0,1,0,1,0,0|2,0,0]=4 79 B19R2.12159 NC1=CC=C(C=C1)S(=O)(=O)CCCN2CCCC2 Z820776010 [0,1,0,1,0,0|2,0,0]=4 80 B19R2.11868 CC(CNC(=O)C1=CC=C(C=C1)Br)N2CCCC2 Z403707522 [0,1,0,1,0,0|2,0,0]=4 81 B19R2.11868 CC(CNC(=O)C1=CC=C(C=C1)F)N2CCCC2 Z403707492 [0,1,0,1,0,0|2,0,0]=4 82 B19R2.11868 CC(CNC(=O)C1=CC=C(C=C1)I)N2CCCC2 Z403707724 [0,1,0,1,0,0|2,0,0]=4 83 B19R2.11868 CC1=CC=C(C=C1)C(=O)OCC(=O)N2CCCC2 Z18312469 [0,1,0,1,0,0|1,0,1]=4 84 B19R2.11868 O=C(OCC(=O)N1CCCC1)C2=CC=C(C=C2)F Z19696137 [0,1,0,1,0,0|1,0,1]=4 85 B19R2.11868 O=C(OCC(=O)N1CCCC1)C2=CC=C(C=C2)O Z19675172 [0,1,0,1,0,0|1,0,1]=4 86 B19R2.11948 CC(C)N1CCN(CC1)C(=O)C2=CC=C(C=C2)Cl Z297772016 [0,1,0,1,0,0|2,0,0]=4 87 B19R2.11948 CC(C)N1CCN(CC1)C(=O)C2=CC=C(C=C2)F Z319126102 [0,1,0,1,0,0|2,0,0]=4 88 B19R2.5091 CCN1CCN(CC1)C(=O)C2=CC(=C(C=C2)C)F Z116336598 [0,1,0,1,0,0|2,0,0]=4 89 B19R2.12397 O=C(NCCN1CCCC1)C2=CC(=C(C=C2)Cl)Br Z1505728419 [0,1,0,1,0,0|2,0,0]=4 90 B19R2.51046 NC1=CC(=C(C=C1)C(=O)NCCN2CCCC2)Cl Z1480780425 [0,1,0,1,0,0|1,0,0]=3 91 B15R1.9 CCN(CC)CCOC1=CC=C(C=C1)N Z239548816 [1,0,0,0,1,0|0,0,0]=2 92 B15R1.464 CCN(CC)CCNC(=O)C1=CSC=C1 Z220737540 [1,0,0,0,1,0|2,0,0]=4 93 B15R1.652 CCN(CC)CCC(=O)C1=CC=CC=C1 Z993668806 [1,0,0,0,1,0|0,0,0]=2 94 B17R1.19382 CCN(CC)CCNC(=S)NC1=CC=CC=C1 Z45793024 [1,0,0,0,0,1|1,1,0]=4 95 B19R1.486 CCN(CC)CCNC(=O)NCC1=CC=C(C=C1)C Z432440312 [0,0,0,0,0,2|2,0,0]=4