0 B7R1.4 CC1=C(I)C=NO1 CC26311 [0,0,0,0,0,0|3,0,0]=3 1 B7R1.4 CN1N=CC=C1I CC62311 [0,0,0,0,0,0|4,0,0]=4 2 B7R1.4 CN1N=CC=C1N GK03066 [0,0,0,0,0,0|4,0,0]=4 3 B7R1.4 ClC1=C(Br)C=CS1 AC25875 [0,0,0,0,0,0|4,0,0]=4 4 B6R1.2 BrC1=CC=CO1 CC02010 [1,0,0,0,0,0|3,0,0]=4 5 B6R1.2 IC1=NNC=C1 NP44481 [1,0,0,0,0,0|3,0,0]=4 6 B8R1.11 CC1=C(C=O)C=CO1 CC55404 [0,1,0,0,0,0|2,0,1]=4 7 B8R1.11 CC1=C(CN)OC=C1 CC55513 [0,1,0,0,0,0|2,0,0]=3 8 B8R1.11 CC1=C(CO)C=CO1 CD10514 [0,1,0,0,0,0|2,0,0]=3 9 B8R1.11 CN1C=CC=C1CN CC02713 [0,1,0,0,0,0|2,0,0]=3 10 B8R1.11 CN1C=CN=C1CO CC20809 [0,1,0,0,0,0|3,0,0]=4 11 B8R1.11 CN1C=NC=C1C=O CC23604 [0,1,0,0,0,0|2,0,1]=4 12 B8R1.11 CN1C=NC=C1CN CC23613 [0,1,0,0,0,0|2,0,0]=3 13 B8R1.11 CN1N=CC=C1CO CC62309 [0,1,0,0,0,0|3,0,0]=4 14 B8R1.11 NCC1=C(Br)SC=C1 SPB08448 [0,1,0,0,0,0|3,0,0]=4 15 B8R1.11 OCC1=CSC=C1Br CC54209 [0,1,0,0,0,0|1,0,0]=2 16 B8R1.50 CC1=C(Br)C(N)=NO1 BTB05698 [0,1,0,0,0,0|3,0,0]=4 17 B8R1.50 CC1=NC=C(Br)N1C CC25110 [0,1,0,0,0,0|3,0,0]=4 18 B8R1.50 CC1=NNC(N)=C1Br KM01090 [0,1,0,0,0,0|3,0,0]=4 19 B8R1.50 CC1=NOC(C)=C1Br CC00610 [0,1,0,0,0,0|2,1,0]=4 20 B8R1.50 CC1=NOC(N)=C1C SB00914 [0,1,0,0,0,0|1,1,0]=3 21 B8R1.4 BrC1=CC=CC(Br)=N1 SB01233 [0,0,0,0,0,1|3,0,0]=4 22 B8R1.4 CC1=CN=CC(Cl)=N1 MO07699 [0,0,0,0,0,1|2,0,0]=3 23 B8R1.4 ClC1=CC=CC(I)=C1 TL00516 [0,0,0,0,0,1|3,0,0]=4 24 B8R1.4 OC1=CC(Cl)=CN=C1 SB00891 [0,0,0,0,0,1|3,0,0]=4 25 B8R1.5 CC1=C(Br)C=CC=N1 NP43686 [0,0,0,0,0,1|2,0,0]=3 26 B8R1.5 CC1=C(N)C=CC=N1 NP43763 [0,0,0,0,0,1|2,0,0]=3 27 B8R1.5 CC1=CC=CNC1=O CD09405 [0,0,0,0,0,1|2,0,0]=3 28 B8R1.5 FC1=NC=CC=C1I MO00359 [0,0,0,0,0,1|3,0,0]=4 29 B5R0.3 C\C(C=O)=C/N RH01431 [1,0,1,0,0,0|1,1,0]=4 30 B7R1.1 NCC1=CN=CS1 MO08602 [1,1,0,0,0,0|2,0,0]=4 31 B7R1.1 NCC1=CSC=C1 CC13113 [1,1,0,0,0,0|0,0,0]=2 32 B7R1.2 BrC1=CSC(Br)=C1 CC28510 [1,1,0,0,0,0|1,0,0]=3 33 B7R1.2 CC1=CC(C)=NO1 TL00573 [1,1,0,0,0,0|1,1,0]=4 34 B7R1.2 CC1=COC(N)=N1 KM08202 [1,1,0,0,0,0|1,1,0]=4 35 B9R1.2 CC1=CC=CC(CS)=C1 TL00469 [0,1,0,0,0,1|1,0,0]=3 36 B9R1.2 CC1=NC(CO)=CC=C1 RJC03579 [0,1,0,0,0,1|1,0,0]=3 37 B9R1.2 CCC1=CC=CC(Br)=C1 TL00571 [0,1,0,0,0,1|2,0,0]=4 38 B9R1.2 CNC1=CC(Cl)=CC=C1 TL00250 [0,1,0,0,0,1|2,0,0]=4 39 B9R1.2 COC1=CC=CC(N)=N1 MO08464 [0,1,0,0,0,1|2,0,0]=4 40 B9R1.2 ClCC1=CC(Br)=CN=C1 CC67174 [0,1,0,0,0,1|2,0,0]=4 41 B9R1.2 OCC1=CC(Cl)=CC=C1 SB01130 [0,1,0,0,0,1|2,0,0]=4 42 B9R1.3 CC1=CC=CC(C)=C1F CD05584 [0,1,0,0,0,1|1,0,0]=3 43 B9R1.3 CC1=CC=CC(N)=C1N BTB07447 [0,1,0,0,0,1|2,0,0]=4 44 B9R1.34 CC1=CC(C)=CC(F)=C1 HAN00040 [0,1,0,0,0,1|1,0,0]=3 45 B9R1.34 CC1=CC(Cl)=CC(C)=N1 MAY00207 [0,1,0,0,0,1|1,0,0]=3 46 B9R1.69 CC1=C(N)N=CC(Br)=C1 XBX00112 [0,1,0,0,0,1|2,0,0]=4 47 B9R1.69 CC1=CC(Br)=C(Cl)N=C1 MO07184 [0,1,0,0,0,1|2,0,0]=4 48 B9R1.69 CC1=CC(Br)=C(N)N=C1 XBX00111 [0,1,0,0,0,1|2,0,0]=4 49 B9R1.69 CC1=CC=C(O)C(C)=N1 RH01494 [0,1,0,0,0,1|1,0,0]=3 50 B9R1.69 CC1=CN=C(Cl)C(C)=N1 MO08011 [0,1,0,0,0,1|1,0,0]=3 51 B9R1.69 CC1=CN=C(N)C(C)=N1 BTB07911 [0,1,0,0,0,1|1,0,0]=3 52 B9R1.69 CC1=NC(N)=CC=C1Br XBX00110 [0,1,0,0,0,1|2,0,0]=4 53 B9R1.15 COC1=CC=CN=C1Br NP43815 [0,1,0,0,0,1|2,0,0]=4 54 B9R1.15 COC1=CC=CN=C1N NP45374 [0,1,0,0,0,1|2,0,0]=4 55 B9R1.15 COC1=NC=CC=C1N SPB07839 [0,1,0,0,0,1|2,0,0]=4 56 B9R1.14 COC1=C(CN)SC=C1 CC68613 [0,2,0,0,0,0|2,0,0]=4 57 B9R1.27 CC1=COC(C)=C1C=O CC65804 [0,2,0,0,0,0|0,1,1]=4 58 B9R1.33 CNCC1=C(C)C=CO1 CC55546 [0,2,0,0,0,0|2,0,0]=4 59 B9R1.33 CNCC1=C(C)OC=C1 CC55446 [0,2,0,0,0,0|2,0,0]=4 60 B9R1.33 CNCC1=CN=CN1C CC23646 [0,2,0,0,0,0|2,0,0]=4 61 B9R1.33 CNCC1=CSC=C1Br CC54296 [0,2,0,0,0,0|1,0,0]=3 62 B9R1.33 O=C=NC1=CSC=C1Br CC54206 [0,2,0,0,0,0|1,0,1]=4 63 B9R1.132 CC1=CC=C(CN)N1C SP01447 [0,2,0,0,0,0|2,0,0]=4 64 B9R1.23 CC1=C(C)OC(C=O)=C1 BTB08889 [0,2,0,0,0,0|2,0,0]=4