0 B33R5.893317428 C12CCCNC1CN(C2)C3=C(C4=C(C=C3F)C(=O)C(=CN4C5CC5)C(=O)O)OC MCULE-2557797264 [0,0,0,0,0,0|0,0,0]=0 1 B33R5.893317428 C12CN(CC1OCCN2)C3=C(C4=C(C=C3F)C(=O)C(=CN4C5CC5)C(=O)O)C#N MCULE-1566583250 [0,0,0,0,0,0|3,0,0]=3 2 B33R5.893317428 COC1=C(C(=CC2=C1N(C=C(C2=O)C(=O)O)C3CC3)F)N4C[C@@H]5CCCN[C@@H]5C4 MCULE-3620294823 [0,0,0,0,0,0|0,0,0]=0 3 B33R5.893317428 COC1=C(C(=CC2=C1N(C=C(C2=O)C(=O)O)C3CC3)F)N4C[C@@H]5CCCN[C@@H]5C4 MCULE-6493821396 [0,0,0,0,0,0|0,0,0]=0 4 B33R5.893317428 COC1=C2C(=CC(=C1N3CC4CCCNC4C3)C)C(=O)C(=CN2C5CC5)C(=O)O MCULE-8683709196 [0,0,0,0,0,0|1,0,0]=1 5 B33R5.893317428 COC1=C2C(=CC(=C1N3CC4CCCNC4C3)C)C(=O)C(=CN2C5CC5)C(=O)O MCULE-9009124322 [0,0,0,0,0,0|1,0,0]=1 6 B33R5.893317428 COC1=C2C(=CC(=C1N3CC4CCCNC4C3)F)C(=O)C(=CN2C5CC5)C(=O)O MCULE-5554194387 [0,0,0,0,0,0|0,0,0]=0 7 B33R5.893317428 N#CC1=C2C(=CC(=C1N3CC4CCCNC4C3)F)C(=O)C(=CN2C5CC5)C(=O)O MCULE-6843140997 [0,0,0,0,0,0|2,0,0]=2 8 B33R5.893317428 N#CC1=C2C(=CC(=C1N3CC4NCCOC4C3)F)C(=O)C(=CN2C5CC5)C(=O)O MCULE-1111735800 [0,0,0,0,0,0|3,0,0]=3 9 B33R5.893317428 N#CC1=C2C(=CC(=C1N3C[C@@H]4NCCO[C@H]4C3)F)C(=O)C(=CN2C5CC5)C(=O)O MCULE-2404456534 [0,0,0,0,0,0|3,0,0]=3 10 B33R5.893317428 [C@@H]12CCCN[C@@H]1CN(C2)C3=C(C4=C(C=C3F)C(=O)C(=CN4C5CC5)C(=O)O)OC MCULE-1466255816 [0,0,0,0,0,0|0,0,0]=0 11 B33R5.893317428 [C@@H]12CCCN[C@@H]1CN(C2)C3=C(C4=C(C=C3F)C(=O)C(=CN4C5CC5)C(=O)O)OC MCULE-3191526132 [0,0,0,0,0,0|0,0,0]=0 12 B33R5.893317428 [C@@H]12CCCN[C@@H]1CN(C2)C3=C(C4=C(C=C3F)C(=O)C(=CN4C5CC5)C(=O)O)OC MCULE-4746643326 [0,0,0,0,0,0|0,0,0]=0 13 B33R5.893317428 [C@@H]12CCCN[C@@H]1CN(C2)C3=C(C4=C(C=C3F)C(=O)C(=CN4C5CC5)C(=O)O)OC MCULE-8863913454 [0,0,0,0,0,0|0,0,0]=0 14 B33R5.893317428 [C@H]12CN(C[C@@H]1OCCN2)C3=C(C4=C(C=C3F)C(=O)C(=CN4C5CC5)C(=O)O)C#N MCULE-3180282771 [0,0,0,0,0,0|3,0,0]=3 15 B33R5.893317428 [C@H]12CN(C[C@@H]1OCCN2)C3=C(C4=C(C=C3F)C(=O)C(=CN4C5CC5)C(=O)O)C#N MCULE-3332861410 [0,0,0,0,0,0|3,0,0]=3 16 B33R5.893317428 [C@H]12CN(C[C@@H]1OCCN2)C3=C(C4=C(C=C3F)C(=O)C(=CN4C5CC5)C(=O)O)C#N MCULE-9609932988 [0,0,0,0,0,0|3,0,0]=3 17 B32R5.437838745 C12CCCNC1CN(C2)C3=C(C4=C(C=C3F)C(=O)C(=CN4C5CC5)C(=O)O)F MCULE-4759964943 [1,0,0,0,0,0|1,0,0]=2 18 B32R5.437838745 O=C(O)C1=CN(C2=C(C(=C(C=C2C1=O)F)N3CC4CCCNC4C3)O)C5CC5 MCULE-5580019835 [1,0,0,0,0,0|0,0,0]=1 19 B32R5.437838745 O=C(O)C1=CN(C2=C(C(=C(C=C2C1=O)F)N3C[C@@H]4CCCN[C@@H]4C3)F)C5CC5 MCULE-2818935547 [1,0,0,0,0,0|1,0,0]=2 20 B32R5.437838745 O=C(O)C1=CN(C2=C(C(=C(C=C2C1=O)F)N3C[C@@H]4CCCN[C@@H]4C3)O)C5CC5 MCULE-6697061964 [1,0,0,0,0,0|0,0,0]=1 21 B32R5.437838745 O=C(O)C1=CN(C2=C(C1=O)C=C(C(=C2Cl)N3C[C@@H]4CCCN[C@@H]4C3)F)C5CC5 MCULE-2719441295 [1,0,0,0,0,0|1,0,0]=2 22 B32R5.437838745 O=C(O)C1=CN(C2=C(C1=O)C=C(C(=C2Cl)N3C[C@@H]4CCCN[C@@H]4C3)F)C5CC5 MCULE-5623069129 [1,0,0,0,0,0|1,0,0]=2 23 B32R5.437838745 [C@@H]12CCCN[C@@H]1CN(C2)C3=C(C4=C(C=C(C(=O)N4C=C3F)C(=O)O)C5CC5)C MCULE-5333672154 [1,0,0,0,0,0|2,0,0]=3 24 B32R5.437838745 [C@@H]12CCCN[C@@H]1CN(C2)C3=C(C4=C(C=C(C(=O)N4C=C3F)C(=O)O)C5CC5)C MCULE-6836998584 [1,0,0,0,0,0|2,0,0]=3 25 B32R5.437838745 [C@@H]12CCCN[C@@H]1CN(C2)C3=C(C4=C(C=C3F)C(=O)C(=CN4C5CC5)C(=O)O)F MCULE-2507951784 [1,0,0,0,0,0|1,0,0]=2 26 B32R5.437838745 [C@@H]12CCCN[C@@H]1CN(C2)C3=C(C4=C(C=C3F)C(=O)C(=CN4C5CC5)C(=O)O)F MCULE-2970705967 [1,0,0,0,0,0|1,0,0]=2 27 B32R5.437838745 [C@@H]12CCCN[C@@H]1CN(C2)C3=C(C4=C(C=C3F)C(=O)C(=CN4C5CC5)C(=O)O)O MCULE-2282016534 [1,0,0,0,0,0|0,0,0]=1 28 B32R5.437838745 [C@@H]12CCCN[C@@H]1CN(C2)C3=C(C4=C(C=C3F)C(=O)C(=CN4C5CC5)C(=O)O)O MCULE-7920644116 [1,0,0,0,0,0|0,0,0]=1 29 B34R5.507891604 COC(=O)C1=CN(C2=C(C(=C(C=C2C1=O)F)N3C[C@@H]4CCCN[C@@H]4C3)OC)C5CC5 MCULE-2240813595 [0,1,0,0,0,0|0,0,0]=1 30 B34R5.507891604 COC(=O)C1=CN(C2=C(C(=C(C=C2C1=O)F)N3C[C@@H]4CCCN[C@@H]4C3)OC)C5CC5 MCULE-3890373276 [0,1,0,0,0,0|0,0,0]=1 31 B34R5.507891604 COC(=O)C1=CN(C2=C(C1=O)C=C(C(=C2OC)N3CC4CCCNC4C3)F)C5CC5 MCULE-5388574498 [0,1,0,0,0,0|0,0,0]=1 32 B34R5.507892475 [C@@H]12CCCN([C@@H]1CN(C2)C3=C(C4=C(C=C3F)C(=O)C(=CN4C5CC5)C(=O)O)OC)C MCULE-7618488243 [0,1,0,0,0,0|0,0,0]=1 33 B34R5.707372655 [C@@H]12CCCN[C@@H]1CN(C2)C3=C(C4=C(C=C3OC)C(=O)C(=CN4C5CC5)C(=O)O)OC MCULE-4395865422 [0,1,0,0,0,0|1,0,0]=2 34 B34R5.707372655 [C@@H]12CCCN[C@@H]1CN(C2)C3=C(C4=C(C=C3OC)C(=O)C(=CN4C5CC5)C(=O)O)OC MCULE-9280677896 [0,1,0,0,0,0|1,0,0]=2 35 B34R5.744937884 CCOC1=C2C(=CC(=C1N3CC4CCCNC4C3)F)C(=O)C(=CN2C5CC5)C(=O)O MCULE-4808453970 [0,1,0,0,0,0|0,0,0]=1 36 B34R5.744937884 [C@@H]12CCCN[C@@H]1CN(C2)C3=C(C4=C(C=C3F)C(=O)C(=CN4C5CC5)C(=O)O)OCC MCULE-1631876842 [0,1,0,0,0,0|0,0,0]=1 37 B34R5.744937884 [C@@H]12CCCN[C@@H]1CN(C2)C3=C(C4=C(C=C3F)C(=O)C(=CN4C5CC5)C(=O)O)OCC MCULE-3740453790 [0,1,0,0,0,0|0,0,0]=1 38 B31R5.286434589 COC1=C2C(=CC(=C1N3CC4CCCNC4C3)F)C(=O)C(=CN2C5CC5)C MCULE-7749655508 [2,0,0,0,0,0|0,0,1]=3 39 B33R5.1244093661 COC1=CC2=C(C(=C1N3CC4CCCNC4C3)F)N(C=C(C2=O)C(=O)O)C5CC5 MCULE-4732137000 [1,1,0,0,0,0|2,0,0]=4 40 B33R5.1244093661 COC1=CC2=C(C(=C1N3C[C@@H]4CCCN[C@@H]4C3)F)N(C=C(C2=O)C(=O)O)C5CC5 MCULE-4700410965 [1,1,0,0,0,0|2,0,0]=4 41 B35R5.1047081726 O=C(O)C1=CN(C2=C(C(=C(C=C2C1=O)F)N3CC4CCCNC4C3)OC(F)F)C5CC5 MCULE-1987199820 [0,2,0,0,0,0|0,0,0]=2