0 B13R2.32 NC1CCC2=C(C=CC=C2)C1O AK-55883 [1,0,0,0,0,0|2,0,1]=4 1 B13R2.369 O=C1NC2=C(C=CC=C2)CC1N AK-27578 [1,0,0,0,0,0|0,0,0]=1 2 B13R2.369 O=C1NC2=C(C=CC=C2)NC1=O AK-45516 [1,0,0,0,0,0|2,0,1]=4 3 B13R1.135 N[C@@H](CC1=CC=CC=C1)C(OC)=O AK-44164 [0,0,1,0,0,0|2,0,0]=3 4 B13R1.135 O=C(OC)C(N)CC1=CC=CC=C1 AK-88496 [0,0,1,0,0,0|2,0,0]=3 5 B13R1.135 O=C(OC)[C@@H](O)CC1=CC=CC=C1 AK-43989 [0,0,1,0,0,0|3,0,0]=4 6 B13R1.135 O=C(OC)[C@H](N)CC1=CC=CC=C1 AK-44133 [0,0,1,0,0,0|2,0,0]=3 7 B13R1.135 O=C(OC)[C@H](O)CC1=CC=CC=C1 AK-42956 [0,0,1,0,0,0|3,0,0]=4 8 B13R2.3085 O=C1N(C)C2=CC=CC=C2N1C AK189225 [0,0,0,0,1,0|3,0,0]=4 9 B12R1.27 C1=C(CCC(OC)=O)C=CC=C1 AK-41212 [1,0,1,0,0,0|2,0,0]=4 10 B12R1.27 NNC(OCC1=CC=CC=C1)=O AK-77420 [1,0,1,0,0,0|2,0,0]=4 11 B12R1.27 O=C(CCC1=CC=CC=C1)CBr AK-40603 [1,0,1,0,0,0|2,0,0]=4 12 B12R1.27 O=C(OCC1=CC=CC=C1)CO AK117482 [1,0,1,0,0,0|2,0,0]=4 13 B12R1.27 ONC(=O)OCC1=CC=CC=C1 AK-25800 [1,0,1,0,0,0|1,0,0]=3 14 B12R1.43 C1=CC=C(C=C1)C[C@@H](C(=N)O)N AK-46083 [1,0,1,0,0,0|1,0,0]=3 15 B12R1.43 C1=CC=CC=C1CC(C(O)=O)N AK-49411 [1,0,1,0,0,0|0,0,0]=2 16 B12R1.43 C=C(CC1=CC=CC=C1)C(O)=O AK-35891 [1,0,1,0,0,0|1,0,1]=4 17 B12R1.43 CC(CC1=CC=CC=C1)C(C)=O AK-89817 [1,0,1,0,0,0|2,0,0]=4 18 B12R1.43 NC(CC1=NC=CC=C1)C(O)=O AK-33695 [1,0,1,0,0,0|1,0,0]=3 19 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(O)=O AK-46761 [1,0,1,0,0,0|0,0,0]=2 20 B12R1.43 N[C@@H](CC1=NC=CC=C1)C(O)=O AK-49740 [1,0,1,0,0,0|1,0,0]=3 21 B12R1.43 N[C@H](CC1=CC=CN=C1)C(O)=O AK-50057 [1,0,1,0,0,0|1,0,0]=3 22 B12R1.43 O=C(N)C(N)CC1=CC=CC=C1 AK-65798 [1,0,1,0,0,0|0,0,0]=2 23 B12R1.43 O=C(O)C(N)CC1=CC=CN=C1 AK-63469 [1,0,1,0,0,0|1,0,0]=3 24 B12R1.43 O=C(O)C(N)CC1=CC=NC=C1 AK159175 [1,0,1,0,0,0|1,0,0]=3 25 B12R1.43 O=C(O)[C@@H](N)CC1=CC=CN=C1 AK114411 [1,0,1,0,0,0|1,0,0]=3 26 B12R1.43 O=C(O)[C@@H](N)CC1=CC=NC=C1 AK-49504 [1,0,1,0,0,0|1,0,0]=3 27 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 AK-45543 [1,0,1,0,0,0|1,0,0]=3 28 B12R1.43 O=C(O)[C@H](N)CC1=CC=CC=C1 AK-36068 [1,0,1,0,0,0|0,0,0]=2 29 B12R1.43 O=C(O)[C@H](N)CC1=CC=NC=C1 AK170035 [1,0,1,0,0,0|1,0,0]=3 30 B12R1.43 [C@@H](O)(CC1=CC=CC=C1)C(=O)O AK-44083 [1,0,1,0,0,0|1,0,0]=3 31 B12R1.43 [C@H](N)(CC1=CC=CC=C1)C(N)=O AK-81283 [1,0,1,0,0,0|0,0,0]=2 32 B12R1.34 O=C(OC)C(O)C1=CC=CC=C1 AK110711 [1,0,1,0,0,0|2,0,0]=4 33 B12R1.34 O[C@@H](C1=CC=CC=C1)C(OC)=O AK-46674 [1,0,1,0,0,0|2,0,0]=4 34 B12R1.34 O[C@H](C1=CC=CC=C1)C(OC)=O AK-46628 [1,0,1,0,0,0|2,0,0]=4 35 B12R2.24 C1=CC=CC2=C1NC(=O)CC2 AK-26121 [2,0,0,0,0,0|0,0,0]=2 36 B12R2.24 C1=CC=CC2=C1NC(=O)CO2 AK-46795 [2,0,0,0,0,0|1,0,0]=3 37 B12R2.24 CC1CCC2=CC=CC=C2N1 AK-33768 [2,0,0,0,0,0|1,0,1]=4 38 B12R2.24 CC1CNC2=C(C=CC=C2)C1 AK146007 [2,0,0,0,0,0|1,0,1]=4 39 B12R2.24 NC1CC2=C(C=CC=C2)CC1 AK-33697 [2,0,0,0,0,0|1,0,1]=4 40 B12R2.24 NC1CNC2=C(C=CC=C2)C1 AK-78514 [2,0,0,0,0,0|0,0,1]=3 41 B12R2.24 NC1CNC2=CC=CC=C2C1 AK-68575 [2,0,0,0,0,0|0,0,1]=3 42 B12R2.24 N[C@@H]1CC2=C(C=CC=C2)CC1 AK-25606 [2,0,0,0,0,0|1,0,1]=4 43 B12R2.24 N[C@H]1CC2=C(C=CC=C2)CC1 AK128431 [2,0,0,0,0,0|1,0,1]=4 44 B12R2.24 O=C1CC2=CC=CC=C2CO1 AK-35166 [2,0,0,0,0,0|2,0,0]=4 45 B12R2.24 O=C1COC2=CC=CC=C2C1 AK-96048 [2,0,0,0,0,0|2,0,0]=4 46 B12R2.24 O=C1COC2=CC=CN=C2N1 AK-81532 [2,0,0,0,0,0|2,0,0]=4 47 B12R2.24 O=C1NC2=C(C=CC=C2)CN1 AK143293 [2,0,0,0,0,0|1,0,0]=3 48 B12R2.1081 OC1CCCC2=C1C=CC=C2 AK-50542 [2,0,0,0,0,0|1,0,1]=4 49 B14R1.3135 O=C(O)C(N)CC1=CC=CC=C1OC AK-87840 [0,1,1,0,0,0|2,0,0]=4 50 B14R1.60 N[C@@H](CC1=CC=CC=C1)C(OCC)=O AK-46035 [0,1,1,0,0,0|2,0,0]=4 51 B14R1.60 O=C(OCC)C(N)CC1=CC=CC=C1 AK544810 [0,1,1,0,0,0|2,0,0]=4 52 B14R1.134 N[C@@H](CC1=CC=C(C=C1)O)C(OC)=O AK-44175 [0,1,1,0,0,0|2,0,0]=4 53 B14R1.134 N[C@@H](CC1=CC=C(C=C1)O)C(OC)=O AK-49703 [0,1,1,0,0,0|2,0,0]=4 54 B14R1.134 N[C@H](CC1=CC=C(Cl)C=C1)C(OC)=O AK-49701 [0,1,1,0,0,0|2,0,0]=4 55 B14R1.134 O=C(OC)C(N)CC1=CC=C(O)C=C1 AK115635 [0,1,1,0,0,0|2,0,0]=4 56 B14R1.134 O=C(OC)[C@@H](N)CC1=CC=C(Br)C=C1 AK117108 [0,1,1,0,0,0|2,0,0]=4 57 B14R1.134 [C@@H](N)(CC1=CC=C(O)C=C1)C(=O)OC AK-49737 [0,1,1,0,0,0|2,0,0]=4 58 B14R1.135 O=C(OC)[C@@H](N)CC1=CC=CC(O)=C1 AK130675 [0,1,1,0,0,0|2,0,0]=4 59 B14R1.1031 [C@@H](CC1=CC=CC=C1)(NC)C(=O)OC AK-88953 [0,1,1,0,0,0|2,0,0]=4 60 B14R1.1107 O=C(OC)C(C)(N)CC1=CC=CC=C1 AK162596 [0,1,1,0,0,0|2,0,0]=4 61 B14R2.29369 O=C1N(C)C2=C(C=C(Cl)C=C2)NC1 AK138292 [1,1,0,0,0,0|2,0,0]=4 62 B14R2.639 O=C1NC2=C(C=CC=C2)NC1(C)C AK-92381 [1,1,0,0,0,0|2,0,0]=4 63 B12R2.18 O=C1C(CC2=C1C=CC=C2)=O AK-60402 [1,0,0,0,1,0|1,0,1]=4