0 B15R1.889 CC(C)NCC(O)c1ccc(Cl)c(Cl)c1 T31435 [0,0,0,0,0,0|2,0,0]=2 1 B15R1.889 CC(C)NCC(O)c1ccc(O)c(O)c1 T1056 [0,0,0,0,0,0|0,0,0]=0 2 B15R1.889 CC(C)NCC(O)c1ccc(O)c(O)c1 T21411 [0,0,0,0,0,0|0,0,0]=0 3 B15R1.889 CC(C)NC[C@@H](O)c1ccc(O)c(O)c1 T21411L [0,0,0,0,0,0|0,0,0]=0 4 B15R1.889 CC(C)NC[C@H](O)c1ccc(O)c(O)c1 T25546 [0,0,0,0,0,0|0,0,0]=0 5 B15R1.889 CC(C)NC[C@H](O)c1ccc(O)c(O)c1 T32697 [0,0,0,0,0,0|0,0,0]=0 6 B15R1.889 CC(C)[NH2+]C[C@@H](O)c1ccc(O)c(O)c1 T29262 [0,0,0,0,0,0|0,0,1]=1 7 B14R1.149 CC(C)NCC(O)c1cccc(O)c1 T33305 [1,0,0,0,0,0|0,0,0]=1 8 B14R1.687 CC(=O)OCCc1ccc(O)c(O)c1 T8168 [1,0,0,0,0,0|2,0,1]=4 9 B16R1.1089 CC(C)NC(C)C(O)c1ccc(O)c(O)c1 T33722 [0,1,0,0,0,0|0,0,0]=1 10 B16R1.4709 CC(C)NCC(O)c1ccc(N)c(c1)C#N T19769 [0,1,0,0,0,0|2,0,0]=3 11 B16R1.4709 COc1cc(ccc1O)C(O)CNC(C)C T33361 [0,1,0,0,0,0|0,0,0]=1 12 B14R1.685 CN(C)CC(=O)c1ccc(O)c(O)c1 T50047 [0,0,0,0,1,0|1,0,2]=4 13 B13R1.18 CCNCC(O)c1cccc(O)c1 T3264 [2,0,0,0,0,0|0,0,0]=2 14 B13R1.513 CC(=O)NCCc1ccc(O)cc1 T37341 [2,0,0,0,0,0|1,0,1]=4 15 B13R1.466 CNCC(=O)c1ccc(O)c(O)c1 T0948 [2,0,0,0,0,0|0,0,2]=4 16 B13R1.466 CNCC(=O)c1ccc(O)c(O)c1 T23571 [2,0,0,0,0,0|0,0,2]=4 17 B13R1.466 CNCC(O)c1ccc(O)c(O)c1 T1071L [2,0,0,0,0,0|0,0,0]=2 18 B13R1.466 CNCC(O)c1ccc(O)c(O)c1 T31383 [2,0,0,0,0,0|0,0,0]=2 19 B13R1.466 CNCC(O)c1ccc(O)c(O)c1 T32536 [2,0,0,0,0,0|0,0,0]=2 20 B13R1.466 CNC[C@H](O)c1ccc(O)c(O)c1 T1047 [2,0,0,0,0,0|0,0,0]=2 21 B15R1.5450 CC(C)NCC(O)c1cc(O)cc(O)c1 T16043 [1,1,0,0,0,0|0,0,0]=2 22 B15R1.892 CC(C)(C)NC[C@H](O)c1ccc(N)nc1 T24318 [1,1,0,0,0,0|2,0,0]=4 23 B15R1.3956 CCNC(C)C(O)c1ccc(O)c(O)c1 T31510 [1,1,0,0,0,0|0,0,0]=2 24 B17R1.2672 CCC(NC(C)C)C(O)c1ccc(O)c(O)c1 T4983 [0,2,0,0,0,0|0,0,0]=2 25 B17R1.2672 CCC(NC(C)C)C(O)c1ccc(O)c(O)c1 T4983L [0,2,0,0,0,0|0,0,0]=2 26 B17R1.5286 CC(C)(C)NCC(O)c1ccc(O)c(CO)c1 T1139 [0,2,0,0,0,0|0,0,0]=2 27 B17R1.5286 CC(C)(C)NCC(O)c1ccc(O)c(CO)n1 T28421 [0,2,0,0,0,0|1,0,0]=3 28 B17R1.5286 CC(C)(C)NCC(O)c1ccc(O)c(CO)n1 T34079 [0,2,0,0,0,0|1,0,0]=3 29 B17R1.5286 CC(C)(C)NC[C@@H](O)c1ccc(O)c(CO)n1 T25963 [0,2,0,0,0,0|1,0,0]=3 30 B17R1.5286 CC(C)(C)NC[C@H](O)c1ccc(O)c(CO)c1 T1139L [0,2,0,0,0,0|0,0,0]=2 31 B17R2.57151 OC(CNC1CCC1)c2ccc(O)c(O)c2 T33719 [0,1,0,1,0,0|0,0,0]=2 32 B13R1.511 CC(=O)CCc1ccc(O)c(O)c1 TN3002 [1,0,0,0,1,0|1,0,1]=4 33 B13R1.510 CC(C)C(=O)c1ccc(O)c(O)c1 T29029 [0,0,0,0,2,0|0,0,2]=4 34 B15R1.120 CC(C)NCC(O)Cc1cccc(Cl)c1 T33972 [1,0,0,0,0,1|1,0,0]=3