0 B41R6.163363023 COC(=O)C1C(C2(C(=O)C3=C(C2=O)C=CC=C3)C4N1C5=CC=CC=C5C=C4)C6=CC=C(C=C6)N(=O)=O MCULE-8164438751 [0,0,0,0,0,0|3,0,0]=3 1 B41R6.163363023 COC(=O)[C@H]1[C@@H](C2(C(=O)C3=C(C2=O)C=CC=C3)C4N1C5=C(C=C4)C=CC=C5)C6=CC=C(C=C6)C(C)C MCULE-3388798398 [0,0,0,0,0,0|0,0,0]=0 2 B41R6.163363023 COC(=O)[C@H]1[C@@H](C2(C(=O)C3=C(C2=O)C=CC=C3)C4N1C5=CC=CC=C5C=C4)C6=CC=C(C=C6)[N+](=O)[O-] MCULE-2194655699 [0,0,0,0,0,0|3,0,0]=3 3 B40R6.107581541 COC(=O)[C@H]1[C@@H](C2(C(=O)C3=C(C2=O)C=CC=C3)C4N1C5=C(C=C4)C=CC=C5)C6=CC=C(C=C6)OC MCULE-8093229906 [1,0,0,0,0,0|1,0,0]=2 4 B40R6.119813369 CC(=O)C1C(C2(C(=O)C3=C(C2=O)C=CC=C3)C4N1C5=C(C=C4)C=CC=C5)C6=CC=C(C=C6)N(=O)=O MCULE-7956010714 [1,0,0,0,0,0|3,0,0]=4 5 B40R6.119813369 CC(=O)[C@H]1[C@@H](C2(C(=O)C3=C(C2=O)C=CC=C3)C4N1C5=C(C=C4)C=CC=C5)C6=CC=C(C=C6)[N+](=O)[O-] MCULE-5651530481 [1,0,0,0,0,0|3,0,0]=4 6 B42R6.188084951 COC(=O)C1C(C2(C(=O)C3=C(C2=O)C=CC=C3)C4N1C5=C(C=C4)C=CC=C5)C6=CC=C(C=C6)C(F)(F)F MCULE-8182349198 [0,1,0,0,0,0|2,0,0]=3 7 B42R6.188084951 COC(=O)[C@H]1[C@@H](C2(C(=O)C3=C(C2=O)C=CC=C3)C4N1C5=C(C=C4)C=CC=C5)C6=CC=C(C=C6)C(F)(F)F MCULE-3935675214 [0,1,0,0,0,0|2,0,0]=3 8 B39R6.68544267 COC1=CC=C(C=C1)C2C(N3C4=C(C=CC=C4)C=CC3C25C(=O)C6=C(C5=O)C=CC=C6)C(=O)C MCULE-9414515385 [2,0,0,0,0,0|1,0,0]=3 9 B39R6.68544267 COC1=CC=C(C=C1)[C@H]2[C@@H](N3C4=C(C=CC=C4)C=CC3C25C(=O)C6=C(C5=O)C=CC=C6)C(=O)C MCULE-9082285888 [2,0,0,0,0,0|1,0,0]=3 10 B39R6.101698764 COC(=O)C1C(C2(C(=O)C3=C(C2=O)C=CC=C3)C4N1C5=C(C=C4)C=CC=C5)C6=CC=C(C=C6)Br MCULE-3858583334 [2,0,0,0,0,0|1,0,0]=3 11 B39R6.101698764 COC(=O)C1C(C2(C(=O)C3=C(C2=O)C=CC=C3)C4N1C5=C(C=C4)C=CC=C5)C6=CC=C(C=C6)C MCULE-8336423197 [2,0,0,0,0,0|0,0,0]=2 12 B39R6.101698764 COC(=O)C1C(C2(C(=O)C3=C(C2=O)C=CC=C3)C4N1C5=C(C=C4)C=CC=C5)C6=CC=C(C=C6)Cl MCULE-4064427399 [2,0,0,0,0,0|1,0,0]=3 13 B39R6.101698764 COC(=O)C1C(C2(C(=O)C3=C(C2=O)C=CC=C3)C4N1C5=C(C=C4)C=CC=C5)C6=CC=C(C=C6)F MCULE-6338990237 [2,0,0,0,0,0|1,0,0]=3 14 B39R6.101698764 COC(=O)[C@@H]1[C@H](C2(C(=O)C3=C(C2=O)C=CC=C3)C4N1C5=C(C=C4)C=CC=C5)C6=CC=C(C=C6)Br MCULE-3851740477 [2,0,0,0,0,0|1,0,0]=3 15 B39R6.101698764 COC(=O)[C@H]1[C@@H](C2(C(=O)C3=C(C2=O)C=CC=C3)C4N1C5=C(C=C4)C=CC=C5)C6=CC=C(C=C6)C MCULE-6298793201 [2,0,0,0,0,0|0,0,0]=2 16 B39R6.101698764 COC(=O)[C@H]1[C@@H](C2(C(=O)C3=C(C2=O)C=CC=C3)C4N1C5=C(C=C4)C=CC=C5)C6=CC=C(C=C6)Cl MCULE-3782073501 [2,0,0,0,0,0|1,0,0]=3 17 B39R6.101698764 COC(=O)[C@H]1[C@@H](C2(C(=O)C3=C(C2=O)C=CC=C3)C4N1C5=C(C=C4)C=CC=C5)C6=CC=C(C=C6)F MCULE-9736041170 [2,0,0,0,0,0|1,0,0]=3 18 B41R6.154251451 CCOC(=O)C1C(C2(C(=O)C3=C(C2=O)C=CC=C3)C4N1C5=CC=CC=C5C=C4)C6=CC=C(C=C6)OC MCULE-5547783415 [1,1,0,0,0,0|1,0,0]=3 19 B41R6.154251451 CCOC(=O)[C@H]1[C@@H](C2(C(=O)C3=C(C2=O)C=CC=C3)C4N1C5=CC=CC=C5C=C4)C6=CC=C(C=C6)OC MCULE-5140224363 [1,1,0,0,0,0|1,0,0]=3 20 B41R6.34684892 CC(=O)C1C(C2(C(=O)C3=C(C2=O)C=CC=C3)C4N1C5=C(C=C4)C=C(C=C5)Cl)C6=CC=C(C=C6)C(C)C MCULE-6188772426 [1,1,0,0,0,0|0,0,0]=2 21 B41R6.34684892 CC(=O)[C@H]1[C@@H](C2(C(=O)C3=C(C2=O)C=CC=C3)C4N1C5=C(C=C4)C=C(C=C5)Cl)C6=CC=C(C=C6)C(C)C MCULE-7007004072 [1,1,0,0,0,0|0,0,0]=2 22 B41R6.122510457 CC(=O)C1C(C2(C(=O)C3=C(C2=O)C=CC=C3)C4N1C5=C(C=C4)C=CC=C5)C6=CC=C(C=C6)C(F)(F)F MCULE-6905128798 [1,1,0,0,0,0|2,0,0]=4 23 B41R6.122510457 CC(=O)[C@H]1[C@@H](C2(C(=O)C3=C(C2=O)C=CC=C3)C4N1C5=C(C=C4)C=CC=C5)C6=CC=C(C=C6)C(F)(F)F MCULE-9311320241 [1,1,0,0,0,0|2,0,0]=4