0 B13R1.669 CC1=C(C=C(C=C1)CCCCO)C MCULE-9978835532 [0,0,0,0,0,0|4,0,0]=4 1 B13R1.669 CC1=CC(=NC=C1Br)NCCCO MCULE-3305742628 [0,0,0,0,0,0|4,0,0]=4 2 B13R1.669 OCCCCC1=CC(=C(C=C1)Cl)Cl MCULE-1331091807 [0,0,0,0,0,0|4,0,0]=4 3 B12R1.1 CCCCCC1=CC=C(C=N1)O MCULE-8445153917 [1,0,0,0,0,0|2,0,1]=4 4 B12R1.1 CCCCOC1=NNC(=S)C=C1 MCULE-5338244614 [1,0,0,0,0,0|2,1,0]=4 5 B12R1.1 NC1=CC=C(C=C1)CCCCO MCULE-3059080015 [1,0,0,0,0,0|3,0,0]=4 6 B12R1.1 NC1=CN=C(C=C1)NCCCO MCULE-8822622385 [1,0,0,0,0,0|3,0,0]=4 7 B12R1.1 NC1=CN=C(C=C1)NCCCO MCULE-9191142868 [1,0,0,0,0,0|3,0,0]=4 8 B12R1.1 OCCCCC1=CC=C(C=C1)Br MCULE-6127744393 [1,0,0,0,0,0|3,0,0]=4 9 B12R1.1 OCCCCC1=CC=C(C=C1)F MCULE-5160690383 [1,0,0,0,0,0|3,0,0]=4 10 B12R1.1 OCCCCC1=CC=C(C=C1)O MCULE-4460665362 [1,0,0,0,0,0|2,0,1]=4 11 B12R1.1 OCCCNC1=NC=C(C=C1)Br MCULE-6029704917 [1,0,0,0,0,0|3,0,0]=4 12 B12R1.1 OCCCOC1=NC=C(C=C1)Br MCULE-8313492283 [1,0,0,0,0,0|3,0,0]=4 13 B12R1.1 OCCNCC1=NC=C(C=C1)Br MCULE-7326417207 [1,0,0,0,0,0|3,0,0]=4 14 B12R1.1 OCCNCC1=NN=C(C=C1)Cl MCULE-5982846149 [1,0,0,0,0,0|2,0,1]=4 15 B12R1.28 CCCCCC1=CC=CC(=C1)O MCULE-1153309638 [1,0,0,0,0,0|3,0,0]=4 16 B12R1.28 NC1=CC(=NC=C1)NCCCO MCULE-8167321024 [1,0,0,0,0,0|3,0,0]=4 17 B12R1.28 OCCCCC1=CC(=CC=C1)Br MCULE-3217566034 [1,0,0,0,0,0|3,0,0]=4 18 B12R1.28 OCCCCC1=CC(=CC=C1)Cl MCULE-8916666497 [1,0,0,0,0,0|3,0,0]=4 19 B12R1.385 CCCCC1=CC=C(C(=C1)O)O MCULE-2126985528 [1,0,0,0,0,0|2,0,1]=4 20 B12R1.385 CCCCC1=NC=C(C(=C1)C)N MCULE-9801639942 [1,0,0,0,0,0|3,0,0]=4 21 B14R1.941 N[C@@H](CCCO)C1=CC=C(C(=C1)O)O MCULE-2001449808 [0,1,0,0,0,0|2,0,1]=4 22 B14R1.941 N[C@@H](CCCO)C1=CC=C(C(=C1)O)O MCULE-3487880883 [0,1,0,0,0,0|2,0,1]=4 23 B14R1.941 N[C@H](CCCO)C1=CC=C(C(=C1)O)O MCULE-1977232240 [0,1,0,0,0,0|2,0,1]=4 24 B14R1.941 N[C@H](CCCO)C1=CC=C(C(=C1)O)O MCULE-2269584618 [0,1,0,0,0,0|2,0,1]=4 25 B12R0.251 C=C(C)C(=O)NCCCCCCO MCULE-7834644420 [0,0,1,0,0,0|2,0,1]=4 26 B12R1.527 CCCCOC1=C(C(=O)NS1)O MCULE-6865345584 [0,0,0,0,1,0|3,0,0]=4 27 B11R1.1 CCCCC1=NN=C(C=C1)Cl MCULE-9597552076 [2,0,0,0,0,0|1,0,1]=4 28 B11R1.1 CCCCC1=NN=C(C=C1)N MCULE-2160512519 [2,0,0,0,0,0|1,0,1]=4 29 B11R1.28 CCCCCC1=CC=CC=N1 MCULE-5660438217 [2,0,0,0,0,0|2,0,0]=4 30 B11R1.28 NCCCCC1=NC=CC=C1 MCULE-2767397054 [2,0,0,0,0,0|2,0,0]=4 31 B11R1.28 OCCCCC1=CC=CC=C1 MCULE-2245500822 [2,0,0,0,0,0|2,0,0]=4 32 B11R1.28 OCCCCC1=CC=CN=C1 MCULE-2205588715 [2,0,0,0,0,0|1,0,1]=4 33 B11R1.28 OCCCCC1=NC=CC=C1 MCULE-9593580777 [2,0,0,0,0,0|1,0,0]=3 34 B11R1.28 OCCCCC1=NC=CN=C1 MCULE-2672180218 [2,0,0,0,0,0|2,0,0]=4 35 B11R1.28 OCCCNC1=NC=CC=C1 MCULE-1261421452 [2,0,0,0,0,0|2,0,0]=4 36 B11R1.28 OCCNCC1=NC=CC=C1 MCULE-2043225437 [2,0,0,0,0,0|2,0,0]=4 37 B11R1.28 OCCNCC1=NC=CC=C1 MCULE-9155171744 [2,0,0,0,0,0|2,0,0]=4 38 B11R1.24 CCCCC1=CC(=CC=C1)O MCULE-4819192360 [2,0,0,0,0,0|2,0,0]=4 39 B11R1.24 NC1=CC(=NC=C1)CCCO MCULE-6028001967 [2,0,0,0,0,0|2,0,0]=4 40 B11R1.24 OCCCC1=CC(=CC=C1)O MCULE-5187970951 [2,0,0,0,0,0|2,0,0]=4 41 B13R1.9 OCCCCNC1=NC=C(C=C1)Br MCULE-2395827711 [1,1,0,0,0,0|2,0,0]=4 42 B13R1.17 N[C@@H](CCCO)C1=NC=C(C=C1)Br MCULE-2129356849 [1,1,0,0,0,0|2,0,0]=4 43 B13R1.17 N[C@@H](CCCO)C1=NC=C(C=C1)Br MCULE-5461803111 [1,1,0,0,0,0|2,0,0]=4 44 B13R1.17 N[C@H](CCCO)C1=NC=C(C=C1)Br MCULE-3415029000 [1,1,0,0,0,0|2,0,0]=4 45 B13R1.17 N[C@H](CCCO)C1=NC=C(C=C1)Br MCULE-9355441711 [1,1,0,0,0,0|2,0,0]=4 46 B13R1.17 O=C1C=CC(=NN1)C(=O)NCCO MCULE-5967410013 [1,1,0,0,0,0|1,0,1]=4 47 B13R1.369 O=C1NN=C(C(=O)N1)SCCCO MCULE-9709543285 [1,1,0,0,0,0|2,0,0]=4 48 B13R1.18 N[C@@H](CCCO)C1=CC(=CC=C1)O MCULE-4816589800 [1,1,0,0,0,0|2,0,0]=4 49 B13R1.18 N[C@@H](CCCO)C1=CC(=CC=C1)O MCULE-7212847043 [1,1,0,0,0,0|2,0,0]=4 50 B13R1.18 N[C@H](CCCO)C1=CC(=CC=C1)O MCULE-4064643519 [1,1,0,0,0,0|2,0,0]=4 51 B13R1.18 N[C@H](CCCO)C1=CC(=CC=C1)O MCULE-5949089958 [1,1,0,0,0,0|2,0,0]=4 52 B13R1.666 COC1=CC(=CC=C1)CCCCO MCULE-6356155369 [1,1,0,0,0,0|2,0,0]=4 53 B13R2.162 CC1CCCC2=NNC(=O)C=C12 MCULE-7921102887 [1,0,0,1,0,0|1,0,0]=3 54 B13R2.3729 O=C1C=C2CCCCCC2=NN1 MCULE-8348393734 [1,0,0,1,0,0|1,0,0]=3 55 B13R2.369 NC1=CC2=C(CCCC2)NC1=O MCULE-9248403184 [1,0,0,1,0,0|2,0,0]=4 56 B13R2.369 O=C1NC2=C(C=C1Br)CCCC2 MCULE-8858340213 [1,0,0,1,0,0|2,0,0]=4 57 B13R2.2348 CN1C(=O)NN=C1C2CCCO2 MCULE-1664138476 [0,0,0,1,1,0|2,0,0]=4