0 B12R1.20 CC1=CC=C([C@@H](N)[C@H](C)O)C=C1 N15706 [1,0,0,0,0,0|3,0,0]=4 1 B12R1.20 C[C@H](O)[C@H](N)C1=CC=C(Br)C=C1 N15663 [1,0,0,0,0,0|3,0,0]=4 2 B12R1.20 C[C@H](O)[C@H](N)C1=CC=C(Cl)C=C1 N15658 [1,0,0,0,0,0|3,0,0]=4 3 B12R1.20 C[C@H](O)[C@H](N)C1=CC=C(F)C=C1 N15646 [1,0,0,0,0,0|3,0,0]=4 4 B12R1.20 C[C@H](O)[C@H](N)C1=CC=C(O)C=C1 N15679 [1,0,0,0,0,0|3,0,0]=4 5 B12R1.20 NC1=CC=C([C@@H](N)C(=O)O)C=C1 N14372 [1,0,0,0,0,0|2,0,1]=4 6 B14R2.29369 N[C@@H]1C2=C(C=C(Cl)C=C2)OC[C@@H]1O 58538 [0,0,0,1,0,0|3,0,0]=4 7 B14R2.29369 N[C@@H]1C2=C(C=C(F)C=C2)OC[C@@H]1O 58535 [0,0,0,1,0,0|3,0,0]=4 8 B11R1.16 OCC[C@H](O)C1=CC=NC=C1 D76515 [2,0,0,0,0,0|1,0,0]=3 9 B11R1.22 OC[C@H](O)C1=CC=C(Br)C=C1 AT17335 [2,0,0,0,0,0|1,0,0]=3 10 B11R1.22 OC[C@H](O)C1=CC=C(Br)C=C1 AT17408 [2,0,0,0,0,0|1,0,0]=3 11 B11R1.20 C[C@H](N)CC1=CC=C(I)C=C1 A10374 [2,0,0,0,0,0|1,0,0]=3 12 B11R1.36 CC(C)[C@H](C)C1=CC=CC=C1 T70930 [2,0,0,0,0,0|2,0,0]=4 13 B11R1.36 C[C@@H](O)[C@H](N)C1=CC=CC=C1 N15520 [2,0,0,0,0,0|2,0,0]=4 14 B11R1.36 O[C@H](C1=CC=CC=C1)C(F)F AT21494 [2,0,0,0,0,0|2,0,0]=4 15 B11R1.36 O[C@H](C1=CC=CC=C1)C(F)F AT21495 [2,0,0,0,0,0|2,0,0]=4 16 B11R1.40 N#C[C@@H](N)CC1=CC=CC=C1 D76472 [2,0,0,0,0,0|1,0,1]=4 17 B11R1.40 N[C@H](CF)CC1=CC=CC=C1 AC6790 [2,0,0,0,0,0|1,0,0]=3 18 B11R1.40 N[C@H](CF)CC1=CC=CC=C1 AC6791 [2,0,0,0,0,0|1,0,0]=3 19 B13R1.29 NC1=CC=C(S(=O)(=O)CCO)C=C1 C15919 [1,1,0,0,0,0|1,0,1]=4 20 B13R1.466 N[C@@H](CCO)C1=CC(F)=C(Cl)C=C1 N13155 [1,1,0,0,0,0|2,0,0]=4 21 B13R1.152 C[C@@H](C1=CC=CC=C1)[C@H](N)C(=O)O AT21380 [1,1,0,0,0,0|1,0,1]=4 22 B13R1.152 C[C@@H](C1=CC=CC=C1)[C@H](N)C(=O)O AT21393 [1,1,0,0,0,0|1,0,1]=4 23 B13R1.152 C[C@H](C1=CC=CC=C1)[C@H](N)C(=O)O AT10108 [1,1,0,0,0,0|1,0,1]=4 24 B13R1.708 N[C@@H](CO)C(F)(F)C1=CC=CC=C1 AC1521 [1,1,0,0,0,0|1,0,0]=3 25 B15R1.1333 N[C@H](CF)[C@H](O)C1=CC=C(C(=O)O)C=C1 86919 [0,2,0,0,0,0|2,0,0]=4 26 B13R2.42 OC[C@H]1C[C@@H]1C2=CC=C(F)C=C2 58119 [1,0,0,1,0,0|2,0,0]=4 27 B13R2.147 O[C@H]1C[C@@H](C2=CC=C(Br)C=C2)C1 AT11011 [1,0,0,1,0,0|2,0,0]=4 28 B13R2.2986 NC1=CC=C(C2(N)CCC2)C=C1 AC3598 [1,0,0,1,0,0|2,0,0]=4 29 B13R2.5179 CN1CCOC2=C1C=CC(N)=C2 AT20462 [1,0,0,1,0,0|2,0,0]=4 30 B13R2.146 NC1CCC1C2=CC=C(Br)C=C2 AT20239 [1,0,0,1,0,0|2,0,0]=4 31 B13R2.32 N[C@@H]1C2=C(C=CC=C2)OC[C@@H]1O 66096 [1,0,0,1,0,0|2,0,0]=4 32 B13R2.3683 N[C@@H]1COC2=C(C=CC(Br)=C2)C1 AT10045 [1,0,0,1,0,0|1,0,0]=3 33 B13R2.3683 N[C@@H]1COC2=C(C=CC(O)=C2)C1 96398 [1,0,0,1,0,0|1,0,0]=3 34 B13R2.3683 N[C@@H]1COC2=C(C=CC(O)=C2)C1 96400 [1,0,0,1,0,0|1,0,0]=3