0 B16R1.94545 C[C@@](CC1=CC(=C(C=C1)O)O)(NN)C(=O)O Z2301684895 [0,0,0,0,0,0|0,0,0]=0 1 B15R1.11316 CC1=C(C=CC(=C1)CC(C)(C)C(=O)O)Br Z2165882431 [1,0,0,0,0,0|3,0,0]=4 2 B15R1.11316 C[C@@](N)(CC1=CC(=C(C=C1)O)O)C(=O)O Z1508927176 [1,0,0,0,0,0|0,0,0]=1 3 B15R1.11316 C[C@](N)(CC1=CC(=C(C=C1)O)O)C(=O)O Z1508915075 [1,0,0,0,0,0|0,0,0]=1 4 B17R1.500650 C[C@@](CC1=C(C=C(C(=C1)O)O)Br)(NN)C(=O)O Z2009870471 [0,1,0,0,0,0|0,0,0]=1 5 B14R1.536 CC1=CC=C(C=C1)CC(CN)C(=O)O Z1478043848 [2,0,0,0,0,0|2,0,0]=4 6 B14R1.536 NCC(CC1=CC=C(C=C1)Cl)C(=O)O Z1222331429 [2,0,0,0,0,0|2,0,0]=4 7 B14R1.542 CC1=CC(=CC=C1)CC(CN)C(=O)O Z1473553886 [2,0,0,0,0,0|2,0,0]=4 8 B14R1.542 NCC(CC1=CC(=CC=C1)Cl)C(=O)O Z1222278653 [2,0,0,0,0,0|2,0,0]=4 9 B14R1.542 NCC(CC1=CC(=CC=C1)O)C(=O)O Z2690874822 [2,0,0,0,0,0|1,0,0]=3 10 B14R1.686 CC(CC1=CC(=C(C=C1)F)Br)C(=O)O Z756390562 [2,0,0,0,0,0|2,0,0]=4 11 B14R1.686 CC(CC1=CC(=C(C=C1)F)F)C(=O)O Z1341747667 [2,0,0,0,0,0|2,0,0]=4 12 B14R1.686 CC(CC1=CC(=C(C=C1)O)O)C(=O)O Z1198162859 [2,0,0,0,0,0|0,0,0]=2 13 B14R1.686 CC1=C(C=C(C=C1)CC(N)C(=O)O)C Z2238618571 [2,0,0,0,0,0|2,0,0]=4 14 B14R1.686 NC(CC1=CC(=C(C=C1)Cl)Cl)C(=O)O Z317025744 [2,0,0,0,0,0|2,0,0]=4 15 B14R1.686 NC(CC1=CC(=C(C=C1)F)Cl)C(=O)O Z5185412106 [2,0,0,0,0,0|2,0,0]=4 16 B14R1.686 N[C@@H](CC1=CC(=C(C=C1)O)Br)C(=O)O Z1269188313 [2,0,0,0,0,0|1,0,0]=3 17 B14R1.686 N[C@@H](CC1=CC(=C(C=C1)O)I)C(=O)O Z1269198907 [2,0,0,0,0,0|1,0,0]=3 18 B14R1.686 N[C@@H](CC1=CC(=C(C=C1)O)O)C(=O)O Z756440064 [2,0,0,0,0,0|0,0,0]=2 19 B14R1.686 N[C@H](CC1=CC(=C(C=C1)F)Cl)C(=O)O Z5212272143 [2,0,0,0,0,0|2,0,0]=4 20 B14R1.686 N[C@H](CC1=CC(=C(C=C1)O)O)C(=O)O Z1255419382 [2,0,0,0,0,0|0,0,0]=2 21 B14R1.4404 CC(C)(CC1=CC(=CC=C1)Cl)C(=O)O Z995179628 [2,0,0,0,0,0|2,0,0]=4 22 B14R1.7626 CC(C)(CC1=CC=C(C=C1)Br)C(=O)O Z995179700 [2,0,0,0,0,0|2,0,0]=4 23 B14R1.7626 CC(C)(CC1=CC=C(C=C1)Cl)C(=O)O Z995179626 [2,0,0,0,0,0|2,0,0]=4 24 B14R1.7626 CC(C)(CC1=CC=C(C=C1)O)C(=O)O Z1376887330 [2,0,0,0,0,0|1,0,0]=3 25 B14R1.7626 CC(N)(CC1=CC=C(C=C1)Br)C(=O)O Z2786605576 [2,0,0,0,0,0|1,0,0]=3 26 B14R1.7626 CC(N)(CC1=CC=C(C=C1)F)C(=O)O Z2734797269 [2,0,0,0,0,0|1,0,0]=3 27 B14R1.7626 C[C@](N)(CC1=CC=C(C=C1)O)C(=O)O Z1255434943 [2,0,0,0,0,0|0,0,0]=2 28 B14R1.8844 CC(CN)(CC1=CC=CC=C1)C(=O)O Z1255428184 [2,0,0,0,0,0|1,0,0]=3 29 B14R1.8844 CC(CN)(CC1=CC=NC=C1)C(=O)O Z1493030567 [2,0,0,0,0,0|2,0,0]=4 30 B16R1.4290 COC1=C(C=C(C=C1)CC(CN)C(=O)O)F Z2739890402 [1,1,0,0,0,0|2,0,0]=4 31 B18R1.368760 CCC(C)(CC1=CC(=C(C=C1)OC)OC)C(=O)O Z1321947530 [0,2,0,0,0,0|2,0,0]=4 32 B18R1.368760 COC1=C(C=C(C=C1)CC(C)(CN)C(=O)O)OC Z4496117333 [0,2,0,0,0,0|1,0,0]=3 33 B14R1.699 CC(N)(C(=O)O)C1=CC(=C(C=C1)Cl)Cl Z317024936 [1,0,0,0,1,0|2,0,0]=4 34 B14R1.3637 CNC(C)(C(=O)O)C1=CC=C(C=C1)F Z446011030 [1,0,0,0,1,0|2,0,0]=4