0 B13R1.351 C[C@H](N)C(=O)OCC1=CC=CC=C1 CS-W020701 [0,0,0,0,0,0|1,0,0]=1 1 B12R1.27 NNC(=O)CCC1=CC=CC=C1 CS-0046856 [1,0,0,0,0,0|3,0,0]=4 2 B12R1.27 NNC(=O)OCC1=CC=CC=C1 CS-W016057 [1,0,0,0,0,0|2,0,0]=3 3 B12R1.27 O=C(CBr)OCC1=CC=CC=C1 CS-W010391 [1,0,0,0,0,0|1,0,0]=2 4 B12R1.27 O=C(CO)OCC1=CC=CC=C1 CS-W007485 [1,0,0,0,0,0|1,0,0]=2 5 B12R1.252 CC(C)OCCC1=NC=CC=C1 CS-0101421 [1,0,0,0,0,0|3,0,0]=4 6 B14R1.756 COC(=O)C(=O)CCC1=CC=CC=C1 CS-0067775 [0,1,0,0,0,0|2,0,1]=4 7 B14R1.3099 CC(C)(N)C(=O)OCC1=CC=CC=C1 CS-0096008 [0,1,0,0,0,0|0,0,0]=1 8 B14R1.3099 N=C(OCC1=CC=CC=C1)C(Cl)(Cl)Cl CS-M0017 [0,1,0,0,0,0|3,0,0]=4 9 B14R1.818 CC(=O)CC(=O)NCC1=CC=CC=C1 CS-W015848 [0,0,0,0,0,1|2,0,1]=4 10 B14R1.818 O=C(O)CC(=O)OCC1=CC=CC=C1 CS-0091017 [0,0,0,0,0,1|2,0,1]=4 11 B11R1.28 BrCCOCC1=CC=CC=C1 CS-W007388 [2,0,0,0,0,0|1,0,1]=4 12 B11R1.28 NCCOCC1=CC=CC=C1 CS-W018620 [2,0,0,0,0,0|1,0,1]=4 13 B11R1.91 CC(=O)\C=C\C1=CC=CC=C1 CS-W013311 [2,0,0,0,0,0|1,0,1]=4 14 B11R1.91 N=C(O)OCC1=CC=CC=C1 CS-W004984 [2,0,0,0,0,0|1,0,1]=4 15 B13R1.11 COC(=O)C[C@H](N)C1=CC=CC=C1 CS-0031396 [1,1,0,0,0,0|2,0,0]=4 16 B13R1.14 COC(=O)CCC1=CC=C(O)C=C1 CS-W017209 [1,1,0,0,0,0|2,0,0]=4 17 B13R1.15 CCC(=O)NCC1=CC=CC(Br)=C1 CS-0038953 [1,1,0,0,0,0|1,0,0]=3 18 B13R1.42 NCCC(=O)OCC1=CC=CC=C1 CS-W009807 [1,1,0,0,0,0|0,0,0]=2 19 B13R1.135 COC(=O)[C@H](N)CC1=CC=CC=C1 CS-W020565 [1,1,0,0,0,0|2,0,0]=4 20 B13R1.135 COC(=O)[C@H](O)CC1=CC=CC=C1 CS-W019028 [1,1,0,0,0,0|2,0,0]=4 21 B13R1.718 [C@H](O)(CO)COCC1=CC=CC=C1 CS-W017108 [1,1,0,0,0,0|1,0,1]=4 22 B13R1.152 CN(C)C(=O)[C@@H](N)C1=CC=CC=C1 CS-B0866 [0,1,0,0,1,0|1,0,0]=3 23 B13R1.353 CC(C)(C)C(=O)NC1=CC=CC=C1 CS-0036108 [0,1,0,0,1,0|1,0,0]=3 24 B15R1.741 C[C@H](CO)NC(=O)OCC1=CC=CC=C1 CS-W015161 [0,1,0,0,0,1|0,0,0]=2 25 B15R1.3678 [C@@H](N)(C(=O)OCC1=CC=CC=C1)C(C)C CS-W019024 [0,1,0,0,0,1|0,0,0]=2 26 B15R1.5392 C[C@@H](NC(=O)C(C)(C)C)C1=CC=CC=C1 CS-0008768 [0,2,0,0,0,0|1,0,0]=3 27 B13R2.10 O=C1N[C@@H](C2=CC=CC=C2)CO1 CS-0031471 [1,0,0,1,0,0|2,0,0]=4 28 B13R2.2382 C1=CC=C(COC[C@H]2CO2)C=C1 CS-B1359 [1,0,0,1,0,0|1,0,1]=4 29 B13R2.359 CC1=NC2=CC=CC=C2C1(C)C CS-W016176 [0,0,0,1,1,0|2,0,0]=4 30 B13R2.369 CC1OC2=C(C=CC=C2)NC1=O CS-0035849 [0,0,0,1,1,0|2,0,0]=4 31 B15R2.325 NC1CC(=O)N(CC2=CC=CC=C2)C1 CS-0044422 [0,0,0,1,0,1|2,0,0]=4 32 B11R1.40 COC(=O)CC1=CC=CC=C1 CS-W018528 [1,0,0,0,1,0|1,0,0]=3 33 B11R1.40 O=C(CBr)NC1=CC=CC=C1 CS-D0368 [1,0,0,0,1,0|2,0,0]=4 34 B11R1.36 CC(C)[C@H](N)C1=CC=CC=C1 CS-0040300 [0,0,0,0,2,0|1,0,1]=4 35 B11R1.36 CC(C)[C@H](N)C1=CC=CC=C1 CS-0040396 [0,0,0,0,2,0|1,0,1]=4