0 B11R1.12 CN[C@@H](CO)C1=CC=CC=C1 O10205 [0,0,0,0,0,0|3,0,0]=3 1 B11R1.12 CN[C@@H](CO)C1=CC=CC=C1 Y13039 [0,0,0,0,0,0|3,0,0]=3 2 B10R1.15 C=C[C@H](N)C1=CC=CC=C1 Y10835 [1,0,0,0,0,0|2,0,1]=4 3 B10R1.15 N[C@@H](CF)C1=CC=CC=C1 72624 [1,0,0,0,0,0|3,0,0]=4 4 B12R1.12 CCC(CC)C1=CC=C(N)C=C1 79032 [0,1,0,0,0,0|2,0,0]=3 5 B12R2.2 C1=CC=C([C@@H]2CCCO2)C=C1 38197 [0,0,0,1,0,0|1,0,0]=2 6 B12R2.2 C1=CN=C([C@@H]2CCCN2)C=C1 CS3567 [0,0,0,1,0,0|3,0,0]=4 7 B12R2.48 O=CC1(C2=CC=CC=C2)CC1 70899 [0,0,0,1,0,0|3,0,0]=4 8 B9R1.8 CSCC1=NC=CC=C1 W19655 [2,0,0,0,0,0|1,1,0]=4 9 B11R1.7 C#CC(C)(C)C1=CC=CC=C1 C12343 [1,1,0,0,0,0|1,0,1]=4 10 B11R1.22 CN[C@@H](C)C1=CC=C(Br)C=C1 Y13906 [1,1,0,0,0,0|1,0,0]=3 11 B11R1.22 CN[C@@H](C)C1=CC=C(C)C=C1 Y13931 [1,1,0,0,0,0|1,0,0]=3 12 B11R1.22 CN[C@@H](C)C1=CC=C(F)C=C1 Y13728 [1,1,0,0,0,0|1,0,0]=3 13 B11R1.23 CN[C@@H](C)C1=CC(C)=CC=C1 Y11427 [1,1,0,0,0,0|1,0,0]=3 14 B11R1.23 CN[C@@H](C)C1=CC=CC(Cl)=C1 Y12191 [1,1,0,0,0,0|1,0,0]=3 15 B11R1.23 CN[C@@H](C)C1=CC=CC(F)=C1 Y13726 [1,1,0,0,0,0|1,0,0]=3 16 B11R1.23 CN[C@@H](C)C1=CC=CC(F)=C1 Y13727 [1,1,0,0,0,0|1,0,0]=3 17 B11R1.36 C[C@@H](O)[C@H](N)C1=CC=CC=C1 Y10854 [1,1,0,0,0,0|2,0,0]=4 18 B11R1.36 C[C@H](O)[C@H](N)C1=CC=CC=C1 N15521 [1,1,0,0,0,0|2,0,0]=4 19 B11R1.36 C[C@H](O)[C@H](N)C1=CC=CC=C1 Y10855 [1,1,0,0,0,0|2,0,0]=4 20 B11R1.36 C[C@H](O)[C@H](N)C1=CC=CC=C1 Y11162 [1,1,0,0,0,0|2,0,0]=4 21 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 D78838 [1,1,0,0,0,0|2,0,0]=4 22 B11R2.1 C[C@H]1CCC2=C1C=CC=C2 A12834 [1,0,0,1,0,0|1,0,0]=3 23 B11R2.1 O[C@H]1CCC2=C1C=CC=C2 D72211 [1,0,0,1,0,0|1,0,0]=3 24 B11R2.4 N[C@H]1C[C@H]1C2=CC=CC=C2 P19281 [1,0,0,1,0,0|2,0,0]=4 25 B11R2.239 C1=CC=C(C2CNC2)C=C1 P11102 [1,0,0,1,0,0|2,0,0]=4 26 B13R2.3 C1=CC([C@@H]2COCCN2)=CN=C1 AR1469 [0,1,0,1,0,0|2,0,0]=4 27 B13R2.15 OC1COCC1C2=CC=CC=C2 90595 [0,1,0,1,0,0|2,0,0]=4 28 B13R2.1613 CN[C@H]1CCCC2=C1C=CC=C2 N14195 [0,1,0,1,0,0|2,0,0]=4 29 B13R2.1613 CN[C@H]1CCCC2=C1C=CC=C2 N14196 [0,1,0,1,0,0|2,0,0]=4 30 B13R2.12 BrC1=CC=C([C@@H]2CCCN2)C=C1 Y11037 [0,1,0,1,0,0|2,0,0]=4 31 B13R2.12 CC1=CC=C([C@@H]2CCCN2)C=C1 D85218 [0,1,0,1,0,0|2,0,0]=4 32 B13R2.13 ClC1=CC([C@@H]2CCCN2)=CC=C1 Y11557 [0,1,0,1,0,0|2,0,0]=4 33 B13R2.13 ClC1=CC([C@@H]2CCCN2)=CC=C1 Y11574 [0,1,0,1,0,0|2,0,0]=4 34 B13R2.13 NC1=CC=CC([C@@H]2CCCN2)=C1 Y11196 [0,1,0,1,0,0|2,0,0]=4 35 B13R2.18 CC1=C([C@@H]2CCCN2)C=CC=C1 Y13690 [0,1,0,1,0,0|2,0,0]=4 36 B11R1.40 CC[C@H](N)CC1=CC=CC=C1 Y13611 [1,0,0,0,0,1|2,0,0]=4 37 B11R1.40 CC[C@H](N)CC1=CC=CC=C1 Y13862 [1,0,0,0,0,1|2,0,0]=4 38 B11R1.40 C[C@@H](CO)OC1=CC=CC=C1 98059 [1,0,0,0,0,1|2,0,0]=4