0 B7R0.4 C=CCSCC(=O)O BB12-3265 [0,0,0,0,0,0|1,0,3]=4 1 B7R0.4 CCCSCC(=O)O BB12-3263 [0,0,0,0,0,0|1,0,3]=4 2 B7R0.4 CCSCCC(=O)O BB12-3270 [0,0,0,0,0,0|1,0,3]=4 3 B6R0.4 CCSCC(=O)O BB12-3264 [1,0,0,0,0,0|1,0,2]=4 4 B6R0.4 CNCCC(=O)O BB12-1452 [1,0,0,0,0,0|1,0,2]=4 5 B8R1.1 CC1=CC=C(C#N)O1 BB12-3501 [0,0,0,1,0,0|2,0,1]=4 6 B8R1.1 OCC1=CC=C(Br)O1 BB90-0114 [0,0,0,1,0,0|2,0,1]=4 7 B8R1.4 CC1=CC=NC(O)=N1 BB12-3694 [0,0,0,1,0,0|2,0,0]=3 8 B8R1.4 CC1=CC=NC(S)=N1 BB12-1615 [0,0,0,1,0,0|2,1,0]=4 9 B8R1.4 NC1=NC(Br)=CC=C1 BB20-4632 [0,0,0,1,0,0|3,0,0]=4 10 B8R1.4 O=C1C=NC=C(Cl)N1 BB12-1098 [0,0,0,1,0,0|3,0,0]=4 11 B8R1.7 O=C(O)C1=CN=NN1 BB90-0079 [0,0,0,1,0,0|3,0,0]=4 12 B8R1.7 O=C(O)C1=CNN=C1 BB01-4399 [0,0,0,1,0,0|2,0,1]=4 13 B8R1.7 O=C(O)C1=NOC=C1 BB20-4533 [0,0,0,1,0,0|2,0,0]=3 14 B8R1.7 OB(O)C1=CC=CO1 BB56-0777 [0,0,0,1,0,0|2,0,1]=4 15 B7R1.4 CC1=C(Br)SC=C1 BB56-2325 [1,0,0,1,0,0|2,0,0]=4 16 B9R1.13 CC(=O)CC1=CC=CS1 BB12-3710 [0,1,0,1,0,0|2,0,0]=4 17 B9R1.34 CC1=NC(C)=NC(O)=C1 BB12-0059 [0,1,0,1,0,0|2,0,0]=4 18 B9R1.41 CC1=C(C(=O)O)N=CN1 BB12-2055 [0,1,0,1,0,0|1,0,0]=3 19 B9R1.41 CC1=C(C(=O)O)N=CS1 BB26-0189 [0,1,0,1,0,0|1,0,0]=3 20 B9R1.41 CC1=C(C(=O)O)NN=N1 BB11-0155 [0,1,0,1,0,0|2,0,0]=4 21 B9R1.41 CC1=C(C(=O)O)SC=N1 BB12-3519 [0,1,0,1,0,0|1,0,0]=3 22 B9R1.41 NC1=C(C(=O)O)NN=C1 BB55-4193 [0,1,0,1,0,0|2,0,0]=4 23 B9R1.41 NC1=C(C(=O)O)SC=C1 BB53-1404 [0,1,0,1,0,0|1,0,0]=3 24 B9R1.41 O=C(O)C1=C(Br)C=NN1 BB55-3823 [0,1,0,1,0,0|2,0,0]=4 25 B9R1.41 O=C(O)C1=C(Cl)C=NN1 BB56-2893 [0,1,0,1,0,0|2,0,0]=4 26 B9R1.2 CC1=CC(NN)=CC=C1 BB56-2532 [0,1,0,1,0,0|2,0,0]=4 27 B9R1.2 CCC1=CC=NC(O)=N1 BB12-3719 [0,1,0,1,0,0|1,0,1]=4 28 B9R1.2 CNC1=CC(F)=CC=C1 BB01-7291 [0,1,0,1,0,0|2,0,0]=4 29 B9R1.2 N#CC1=CC(O)=CC=C1 BB20-4617 [0,1,0,1,0,0|1,0,1]=4 30 B9R1.2 NCC1=CC=CC(Cl)=C1 BB01-4636 [0,1,0,1,0,0|2,0,0]=4 31 B9R1.3 CC1=C(N)C(N)=CC=C1 BB12-3003 [0,1,0,1,0,0|2,0,0]=4 32 B9R1.3 NC1=C(O)C(Cl)=CC=C1 BB12-1563 [0,1,0,1,0,0|2,0,0]=4 33 B9R1.11 COC(=O)C1=CNC=N1 BB20-4625 [0,1,0,1,0,0|2,0,0]=4 34 B9R1.11 NNC(=O)C1=CC=CO1 BB01-6372 [0,1,0,1,0,0|2,0,0]=4 35 B9R1.23 O=CC1=CC(Br)=C(Br)O1 BB17-1111 [0,1,0,1,0,0|2,0,0]=4 36 B9R1.35 CC1=CC=C(C(=N)N)O1 BB12-3708 [0,1,0,1,0,0|2,0,0]=4 37 B9R1.35 CC1=CNC(C(=O)O)=N1 BB12-3671 [0,1,0,1,0,0|1,0,0]=3 38 B9R1.35 CC1=NC(C(=O)O)=CS1 BB01-2835 [0,1,0,1,0,0|1,0,0]=3 39 B9R1.35 NC1=CC(C(=O)O)=NN1 BB55-3807 [0,1,0,1,0,0|2,0,0]=4 40 B9R1.35 O=C1NC=C(C(=O)O)N1 BB26-0164 [0,1,0,1,0,0|2,0,0]=4 41 B9R1.69 CC1=CC(=O)C(O)=CN1 BB26-0805 [0,1,0,1,0,0|2,0,0]=4 42 B9R1.69 CC1=CC(=O)C(O)=CO1 BB26-0385 [0,1,0,1,0,0|2,0,0]=4 43 B9R1.69 CC1=CC=C(N)C(N)=C1 BB56-0557 [0,1,0,1,0,0|2,0,0]=4 44 B9R1.69 CC1=CC=C(N)C(S)=C1 BB17-0861 [0,1,0,1,0,0|1,1,0]=4 45 B9R1.69 NC1=CC=C(F)C=C1O BB12-2894 [0,1,0,1,0,0|2,0,0]=4 46 B9R1.69 OC1=CC=C(F)C(Cl)=C1 BB12-4695 [0,1,0,1,0,0|2,0,0]=4