0 B14R2.8239 O=C1NC2=C(C=C(Cl)C=C2)C=C1O 67214 [1,0,0,0,0,0|1,0,2]=4 1 B14R2.29369 CN1C(=O)CCC2=CC(I)=CN=C21 AT15609 [1,0,0,0,0,0|2,1,0]=4 2 B14R1.135 COC(=O)[C@@H](N)CC1=CC=CC(Br)=C1 AC2356 [0,0,1,0,0,0|2,1,0]=4 3 B13R1.133 CC(C)C(=O)CC1=CC=C(Cl)C=C1 N12699 [1,0,1,0,0,0|2,0,0]=4 4 B13R1.135 COC(=O)[C@@H](N)CC1=CC=CC=C1 N12610 [1,0,1,0,0,0|2,0,0]=4 5 B13R1.148 CC1=CC=CC(C[C@H](N)C(=O)O)=C1 N14313 [1,0,1,0,0,0|1,0,0]=3 6 B13R1.148 C[C@@H](CC1=CC=CC(Br)=C1)C(=O)O 91423 [1,0,1,0,0,0|1,1,0]=4 7 B13R1.148 NC1=CC=CC(C[C@H](N)C(=O)O)=C1 Y11481 [1,0,1,0,0,0|1,0,0]=3 8 B13R1.148 O=C(O)C(=O)CC1=CC=CC(Cl)=C1 C91153 [1,0,1,0,0,0|1,0,1]=4 9 B13R1.148 O=C(O)[C@@H](O)CC1=CC(O)=CC=C1 AC5897 [1,0,1,0,0,0|2,0,0]=4 10 B13R1.148 O=C(O)[C@@H](O)CC1=CC=CC(Br)=C1 AC5087 [1,0,1,0,0,0|1,1,0]=4 11 B13R1.148 O=C(O)[C@@H](O)CC1=CC=CC(F)=C1 AC5720 [1,0,1,0,0,0|1,1,0]=4 12 B13R1.163 CC(=O)N(C)C1=C(C)C=C(Br)C=C1 96865 [1,0,1,0,0,0|1,1,0]=4 13 B13R1.163 CC(=O)[C@H](N)C1=C(C)C=C(Cl)C=C1 N16202 [1,0,1,0,0,0|2,0,0]=4 14 B13R1.2679 CC1=C(NC(=O)CCl)C=CC(Br)=C1 N16796 [1,0,1,0,0,0|1,1,0]=4 15 B13R1.2679 CC1=C(NC(=O)CCl)C=CC(Cl)=C1 F50777 [1,0,1,0,0,0|1,0,0]=3 16 B13R2.32 CN1C(=O)CNC2=C1C=CC=C2 D76287 [2,0,0,0,0,0|2,0,0]=4 17 B13R2.328 N[C@H]1CC2=C(C=CC=C2)N(O)C1 W17569 [2,0,0,0,0,0|0,0,1]=3 18 B13R2.369 C[C@@H]1SC2=C(C=CC=C2)NC1=O 77381 [2,0,0,0,0,0|2,0,0]=4 19 B13R2.369 NC1=NC2=C(C=CC=C2)NC1=O 38523 [2,0,0,0,0,0|1,0,1]=4 20 B13R2.369 N[C@H]1CC2=C(C=CC=C2)NC1=O 81089 [2,0,0,0,0,0|0,0,0]=2 21 B13R2.369 N[C@H]1CC2=C(C=CC=N2)NC1=O C13580 [2,0,0,0,0,0|1,0,0]=3 22 B13R2.369 N[C@H]1CC2=C(C=CN=C2)NC1=O C13586 [2,0,0,0,0,0|1,0,0]=3 23 B13R2.155 N[C@@H]1COC2=C(C=C(Cl)C=C2)C1 E72383 [2,0,0,0,0,0|1,0,1]=4 24 B13R2.155 N[C@@H]1COC2=C(C=C(Cl)C=C2)C1 W14985 [2,0,0,0,0,0|1,0,1]=4 25 B13R2.3683 CC1=CC2=C(C=C1)NC(=O)CO2 AC6060 [2,0,0,0,0,0|2,0,0]=4 26 B13R2.3683 NC1=CC2=C(C=C1)NC(=O)OC2 AC7323 [2,0,0,0,0,0|2,0,0]=4 27 B13R2.3683 O=C1CNC2=C(C=CC(Cl)=N2)N1 97254 [2,0,0,0,0,0|2,0,0]=4 28 B13R2.3683 O=C1COC2=C(C=CC(F)=C2)N1 25433 [2,0,0,0,0,0|1,1,0]=4 29 B13R2.3683 O=C1N=CC2=C(C=CC(Cl)=C2)N1 F15803 [2,0,0,0,0,0|1,0,1]=4 30 B13R2.3683 O=C1NC2=C(C=C(F)C=C2)CO1 AC4756 [2,0,0,0,0,0|1,1,0]=4 31 B13R2.3683 O=C1NC2=C(C=C(I)C=C2)CO1 AC5099 [2,0,0,0,0,0|1,1,0]=4 32 B13R2.5179 O[C@H]1CCCC2=C1C=CC(Cl)=C2 N14446 [2,0,0,0,0,0|1,0,1]=4 33 B15R2.13982 CC1(C)OC2=C(C=CC(Cl)=C2)NC1=O AC3453 [1,1,0,0,0,0|2,0,0]=4 34 B15R2.13972 CN1C(=O)CCC2=CC(Br)=CC(Cl)=C21 P13627 [1,1,0,0,0,0|1,1,0]=4 35 B15R2.63814 C[C@H]1CC(=O)N(C)C2=C1C=C(O)C=C2 W12882 [1,1,0,0,0,0|2,0,0]=4 36 B15R2.18933 N[C@H]1CCN(C2=CC=C(Br)C=C2)C1=O AT15042 [0,0,1,1,0,0|1,1,0]=4 37 B13R2.3085 CN1C(=O)[C@@H](N)C2=C1C=CC=C2 W10171 [1,0,0,0,1,0|1,0,0]=3 38 B13R2.3028 CC1=CC2=C(C=C1)NC(=O)[C@H]2N W10170 [1,0,0,0,1,0|1,0,0]=3 39 B13R2.3028 C[C@@H]1C(=O)NC2=C1C=C(I)C=C2 F30779 [1,0,0,0,1,0|1,1,0]=4 40 B13R2.3028 C[C@@H]1C(=O)NC2=C1C=C(O)C=C2 71575 [1,0,0,0,1,0|2,0,0]=4 41 B13R2.5190 CC1=CC2=C(C=C1)C(=O)[C@@H](C)C2 N14232 [1,0,0,0,1,0|2,0,0]=4 42 B13R2.5190 C[C@H]1CC2=C(C=CC(Cl)=C2)C1=O N13213 [1,0,0,0,1,0|1,0,0]=3 43 B15R2.62000 C[C@H]1CNC2=C(C=CC(Cl)=C2)NC1=O VT1300 [1,0,0,0,0,1|1,0,0]=3