0 B13R2.1069 BrC1=CN=C(NC2COC2)N=C1 MC121195 [0,0,0,0,0,0|4,0,0]=4 1 B13R2.1069 NC1=CC=C(OC2COC2)C=C1 MC102494 [0,0,0,0,0,0|0,0,0]=0 2 B13R2.1069 NC1=CC=C(OC2COC2)N=C1 MC102496 [0,0,0,0,0,0|1,0,0]=1 3 B13R2.1069 NC1=CN=C(OC2COC2)N=C1 MC102498 [0,0,0,0,0,0|2,0,0]=2 4 B14R2.331 NCC1=CC=C(OC2COC2)C=C1 MC115795 [0,1,0,0,0,0|0,0,0]=1 5 B12R1.1 COCCOC1=CC=C(N)C=C1 CS13382 [0,0,1,0,0,0|0,0,0]=1 6 B12R1.1 COCCOC1=CN=C(N)C=N1 CS14433 [0,0,1,0,0,0|2,0,0]=3 7 B12R1.1 OC1=CC=C(OCCCBr)C=C1 MC103168 [0,0,1,0,0,0|3,0,0]=4 8 B12R1.49 NC(CO)CC1=CC=C(I)C=C1 MC115448 [0,0,1,0,0,0|3,0,0]=4 9 B12R1.49 NC(CO)Cc1ccc(O)cc1 MC439069 [0,0,1,0,0,0|3,0,0]=4 10 B12R2.294 BrC1=CC=C(OC2CC2)C=C1 MC430493 [0,0,0,0,1,0|1,0,0]=2 11 B12R2.2302 BrC1=CC=C(C2COC2)C=C1 MC102461 [0,0,0,0,1,0|1,0,0]=2 12 B14R2.72 FC1=CC=C(OC2CCNC2)C=C1 CS13827 [0,0,0,0,0,1|2,0,0]=3 13 B11R1.1 CCCOC1=CC=C(N)N=N1 CS10765 [1,0,1,0,0,0|2,0,0]=4 14 B11R1.1 CNCCC1=CC=C(N)C=C1 MC40974 [1,0,1,0,0,0|1,0,0]=3 15 B11R1.1 CNCCC1=CC=C(O)C=C1 MC426074 [1,0,1,0,0,0|2,0,0]=4 16 B11R1.1 COCCC1=CC=C(O)C=C1 MC445496 [1,0,1,0,0,0|1,0,0]=3 17 B11R1.1 COCOC1=CN=C(Cl)C=C1 MC425484 [1,0,1,0,0,0|2,0,0]=4 18 B11R1.1 ClC1=CC=C(OCCBr)C=C1 MC20815 [1,0,1,0,0,0|2,0,0]=4 19 B11R1.1 FC1=CC=C(OCCBr)C=C1 MC41373 [1,0,1,0,0,0|2,0,0]=4 20 B11R1.1 NCCOC1=CC=C(F)C=C1 MC40921 [1,0,1,0,0,0|2,0,0]=4 21 B11R1.1 NCCOC1=CC=C(I)C=C1 MC112558 [1,0,1,0,0,0|2,0,0]=4 22 B11R1.28 BrCCCOC1=CC=CC=C1 CS15031 [1,0,1,0,0,0|2,0,0]=4 23 B11R1.28 CNCCCC1=CC=CC=C1 MC425598 [1,0,1,0,0,0|2,0,0]=4 24 B11R1.20 CC(C)CC1=CC=C(Br)C=C1 MC433485 [1,0,1,0,0,0|2,0,0]=4 25 B11R1.20 CC(C)NC1=CC=C(Br)C=C1 MC443740 [1,0,1,0,0,0|2,0,0]=4 26 B11R1.20 CC(C)NC1=CC=C(F)C=C1 CS22842 [1,0,1,0,0,0|2,0,0]=4 27 B11R1.20 CC(C)OC1=CC=C(N)C=C1 CS10912 [1,0,1,0,0,0|0,0,0]=2 28 B11R1.20 CC(C)OC1=CC=C(O)C=C1 MC443483 [1,0,1,0,0,0|1,0,0]=3 29 B11R1.20 CC(C)OC1=CN=C(Br)C=C1 MC443766 [1,0,1,0,0,0|2,0,0]=4 30 B11R1.20 CC(C)SC1=CC=C(O)C=C1 MC112512 [1,0,1,0,0,0|1,1,0]=4 31 B11R1.20 NC1=CC=C(OC(F)F)C=C1 CS13962 [1,0,1,0,0,0|2,0,0]=4 32 B11R1.40 NC(CO)CC1=CC=CC=C1 CS21216 [1,0,1,0,0,0|2,0,0]=4 33 B11R1.40 NC(CO)CC1=CC=CC=C1 MC425862 [1,0,1,0,0,0|2,0,0]=4 34 B13R1.9 CCCCCCC1=CC=C(N)C=C1 CS22853 [0,1,1,0,0,0|2,0,0]=4 35 B13R1.9 CCOCCOC1=NC=C(Br)C=C1 MC111249 [0,1,1,0,0,0|2,0,0]=4 36 B13R1.9 COCCCOC1=CC=C(Br)C=C1 MC41812 [0,1,1,0,0,0|1,0,0]=3 37 B13R1.9 NCCCCOC1=CC=C(Br)C=C1 MC112157 [0,1,1,0,0,0|2,0,0]=4 38 B13R1.369 COCCOC1=C(F)C=C(N)C=C1 MC112113 [0,1,1,0,0,0|0,0,0]=2 39 B13R1.371 CCCCOC1=CC=C(CO)C=C1 MC40692 [0,1,1,0,0,0|2,0,0]=4 40 B13R1.513 CN(C)CCOC1=CC=C(N)C=N1 MC431618 [0,1,1,0,0,0|2,0,0]=4 41 B13R1.513 CN(C)CCOC1=CN=C(N)C=C1 MC443431 [0,1,1,0,0,0|2,0,0]=4 42 B13R2.221 NC1(CC2=CC=CC=C2)COC1 MC103534 [1,1,0,0,0,0|1,0,0]=3 43 B13R2.3021 BrC1=CC(OC2CCC2)=NC=C1 MC430486 [1,1,0,0,0,0|2,0,0]=4 44 B13R2.5225 ClC1=CC=CN=C1OC2CCC2 MC103349 [1,1,0,0,0,0|2,0,0]=4 45 B13R2.5225 NC1=CC=CN=C1OC2COC2 MC102495 [1,1,0,0,0,0|1,0,0]=3 46 B13R2.520 O=C(C1=CC=C(O)C=C1)C2CC2 MC30319 [0,1,0,0,1,0|2,0,0]=4 47 B13R2.521 NC1=NC=C(OC2CC2)C=C1Br MC443577 [0,1,0,0,1,0|1,0,0]=3 48 B13R2.2986 CC1=CC=C(C2(N)COC2)C=C1 MC102483 [0,1,0,0,1,0|1,0,0]=3 49 B13R2.2986 NC1(C2=CC=C(Br)C=C2)CCC1 CS12829 [0,1,0,0,1,0|2,0,0]=4 50 B13R2.2986 NC1(C2=CC=C(Br)C=C2)COC1 MC102460 [0,1,0,0,1,0|1,0,0]=3 51 B13R2.2986 NC1(C2=CC=C(Cl)C=C2)COC1 MC115763 [0,1,0,0,1,0|1,0,0]=3 52 B13R2.2986 NC1(C2=CC=C(I)C=C2)COC1 MC102477 [0,1,0,0,1,0|1,0,0]=3 53 B13R2.2986 OC1(C2=CC=C(Br)C=C2)COC1 MC102170 [0,1,0,0,1,0|1,0,0]=3 54 B15R2.91950 N#CC1=CC(F)=C(OC2COC2)C=C1 MC102474 [0,2,0,0,0,0|0,0,1]=3 55 B15R2.91950 NCC1=CC(F)=C(OC2COC2)C=C1 MC115772 [0,2,0,0,0,0|0,0,0]=2 56 B13R2.162 CN1CCCC2=CC=C(N)C=C21 CS11790 [0,0,1,1,0,0|2,0,0]=4 57 B13R2.3683 CC1CNC2=C(C=CC(F)=C2)O1 MC430156 [0,0,1,1,0,0|2,0,0]=4 58 B11R1.22 CC(CN)C1=CC=C(Br)C=C1 MC103018 [0,0,1,0,1,0|2,0,0]=4 59 B11R1.22 CC(CN)C1=CC=C(Br)C=C1 MC427281 [0,0,1,0,1,0|2,0,0]=4 60 B11R1.22 CC(CN)C1=CC=C(O)C=C1 MC116255 [0,0,1,0,1,0|2,0,0]=4 61 B11R1.22 CCC(C)C1=CC=C(Br)C=C1 CS18281 [0,0,1,0,1,0|2,0,0]=4 62 B11R1.22 OCC(O)C1=CC=C(Br)C=C1 MC442284 [0,0,1,0,1,0|2,0,0]=4 63 B11R2.238 C1=CC=C(CC2CN2)C=C1 CS19482 [1,0,0,0,1,0|2,0,0]=4 64 B11R2.238 C1=CC=C(SC2CC2)C=C1 MC20576 [1,0,0,0,1,0|0,1,0]=3 65 B11R2.34 BrC1=CC=C(C2CC2)C=C1 CS22811 [0,0,0,0,2,0|1,0,0]=3 66 B11R2.34 BrC1=NC=C(C2CC2)C=C1 MC442244 [0,0,0,0,2,0|2,0,0]=4 67 B11R2.34 CC1=CC=C(C2CO2)C=C1 MC112355 [0,0,0,0,2,0|1,0,0]=3 68 B11R2.34 NC1=CC=C(C2CC2)C=C1 CS17100 [0,0,0,0,2,0|0,0,0]=2 69 B11R2.352 NC1=CN(C2COC2)N=C1 MC115800 [0,0,0,0,2,0|2,0,0]=4 70 B13R2.64 C1=CN=C(OC2CCNC2)C=C1 MC106938 [1,0,0,0,0,1|2,0,0]=4 71 B13R2.64 C1=CN=CC(OC2CCNC2)=C1 MC431348 [1,0,0,0,0,1|2,0,0]=4 72 B13R2.2383 C1=CC=C(COC2CNC2)C=C1 MC107180 [1,0,0,0,0,1|1,0,0]=3 73 B13R2.2383 C1=CC=C(OCC2CNC2)C=C1 MC112095 [1,0,0,0,0,1|1,0,0]=3 74 B15R2.29 NC1=CC=C(CN2CCOCC2)C=C1 CS18342 [0,0,0,0,0,2|2,0,0]=4 75 B15R2.29 OC1=CC=C(OC2CCCCO2)C=C1 CS15766 [0,0,0,0,0,2|2,0,0]=4