0 B12R1.286 COC1=CC(CC#N)=CC=C1Br CS-0202569 [0,0,0,0,0,0|2,0,1]=3 1 B12R1.286 COC1=CC(CNN)=CC=C1C CS-0286970 [0,0,0,0,0,0|3,0,0]=3 2 B11R1.189 COC1=CC=CC(CCN)=N1 CS-W000067 [1,0,0,0,0,0|2,0,1]=4 3 B11R1.189 COC1=CC=CC(CCO)=N1 CS-0265278 [1,0,0,0,0,0|2,0,1]=4 4 B11R1.192 CNCC1=CC=C(O)C(O)=C1 CS-0059168 [1,0,0,0,0,0|1,0,1]=3 5 B11R1.280 COC1=C(C)C=NC(C=O)=C1 CS-0244993 [1,0,0,0,0,0|3,0,0]=4 6 B11R1.280 COC1=CC(C#N)=CC=C1I CS-0377852 [1,0,0,0,0,0|2,0,1]=4 7 B11R1.280 COC1=CC(C=O)=CC=C1N CS-0374694 [1,0,0,0,0,0|2,0,0]=3 8 B11R1.280 COC1=CC=C(N)C(OC)=C1 CS-0033846 [1,0,0,0,0,0|2,0,1]=4 9 B11R1.280 COC1=NC(C=O)=CC=C1C CS-0888264 [1,0,0,0,0,0|3,0,0]=4 10 B13R1.49 COC1=C(F)C=CC([C@@H](N)CO)=C1 CS-0438933 [0,1,0,0,0,0|2,0,1]=4 11 B13R2.449 ClCCC1=CC=C2OCCC2=C1 CS-M1816 [0,0,0,1,0,0|2,0,1]=4 12 B13R2.599 COC1=C(O)C=C2C=NNC2=C1 CS-0367348 [0,0,0,1,0,0|2,0,0]=3 13 B13R2.599 COC1=CC2=NC=CN2C=C1Br CS-0068933 [0,0,0,1,0,0|3,0,0]=4 14 B10R1.172 COC1=CC(CN)=NC=C1 CS-0483209 [2,0,0,0,0,0|2,0,0]=4 15 B10R1.172 COC1=CC=NC(CCl)=C1 CS-0029801 [2,0,0,0,0,0|2,0,0]=4 16 B10R1.172 CSC1=CC=CC(CO)=C1 CS-0225753 [2,0,0,0,0,0|1,1,0]=4 17 B10R1.176 CC1=CC(C=O)=CC=C1I CS-0883888 [2,0,0,0,0,0|2,0,0]=4 18 B10R1.176 CC1=CC(CO)=CC=C1Cl CS-0194584 [2,0,0,0,0,0|2,0,0]=4 19 B10R1.176 CC1=CC(CO)=CC=C1I CS-0378772 [2,0,0,0,0,0|2,0,0]=4 20 B10R1.176 COC1=CC=C(O)C(C)=C1 CS-W006115 [2,0,0,0,0,0|1,0,1]=4 21 B10R1.176 NCC1=CC=C(O)C(Cl)=C1 CS-0610660 [2,0,0,0,0,0|2,0,0]=4 22 B10R1.176 OCC1=CC=C(I)C(O)=C1 CS-W018963 [2,0,0,0,0,0|2,0,0]=4 23 B10R1.30 CCC1=NC(C)=CC=C1O CS-0182823 [2,0,0,0,0,0|2,0,0]=4 24 B10R1.30 COC1=C(C)C=CC(I)=C1 CS-0153556 [2,0,0,0,0,0|2,0,0]=4 25 B10R1.30 COC1=C(Cl)C=CC(N)=C1 CS-W016214 [2,0,0,0,0,0|2,0,0]=4 26 B10R1.30 COC1=CC(F)=CC=C1I CS-0130922 [2,0,0,0,0,0|2,0,0]=4 27 B10R1.30 COC1=CC(S)=CC=C1F CS-0568056 [2,0,0,0,0,0|2,0,0]=4 28 B12R1.41 COC1=CC(N)=CC(CCO)=C1 CS-M0774 [1,1,0,0,0,0|1,0,1]=4 29 B12R1.435 COC1=CC([C@H](N)CO)=CC=C1 CS-0162073 [1,1,0,0,0,0|1,0,1]=4 30 B12R1.367 C=CC(N)C1=CC(C)=C(C)C=C1 CS-0612157 [1,1,0,0,0,0|1,0,0]=3 31 B12R1.367 C=CC(N)C1=CC=C(Cl)C(Cl)=C1 CS-0612160 [1,1,0,0,0,0|2,0,0]=4 32 B12R1.367 OCC(O)C1=CC(O)=C(O)C=C1 CS-W010782 [1,1,0,0,0,0|1,0,1]=4 33 B12R1.385 OC\C=C\C1=CC=C(O)C(O)=C1 CS-0460124 [1,1,0,0,0,0|0,0,2]=4 34 B12R1.56 COC1=C(F)C=CC([C@H](C)N)=C1 CS-0000362 [1,1,0,0,0,0|1,0,1]=4 35 B12R1.56 COC1=CC(C(F)F)=CC=C1Br CS-0525382 [1,1,0,0,0,0|2,0,0]=4 36 B12R1.654 COC1=C(O)C(C=O)=CC=C1O CS-0059753 [1,1,0,0,0,0|1,0,0]=3 37 B14R1.42 COC1=C(Br)C=CC(CCC(=O)O)=C1 CS-0749854 [0,2,0,0,0,0|1,0,1]=4 38 B14R1.42 COC1=CC(CCC(=O)O)=CC=C1Cl CS-0908619 [0,2,0,0,0,0|1,0,1]=4 39 B12R2.44 COC1=CC2=C(C=C1)NCC2 CS-0019194 [1,0,0,1,0,0|1,0,1]=4 40 B12R2.315 COC1=CC=CC2=C1C=NS2 CS-0646163 [1,0,0,1,0,0|2,0,0]=4 41 B14R2.82 COC1=CC2=C(C=C1OC)CNC2 CS-0101431 [0,1,0,1,0,0|1,0,1]=4 42 B14R2.1128 COC1=CC2=C(C=CN=C2)C=C1F CS-0645653 [0,1,0,1,0,0|1,0,1]=4 43 B14R3.3046 C1=CC2=C(OCO2)C3=C1CNC3 CS-0187245 [0,0,0,2,0,0|1,0,1]=4