0 B8R1.18 CC1=NC(C)=C(Br)S1 CC05810 [0,0,0,0,0,0|1,1,0]=2 1 B8R1.18 CC1=NN(C)C(N)=C1 KM00001 [0,0,0,0,0,0|3,0,0]=3 2 B8R1.18 CN1C=C(Br)C(N)=N1 GK00323 [0,0,0,0,0,0|4,0,0]=4 3 B8R1.18 ClC1=C(Cl)NC(Br)=N1 KM01467 [0,0,0,0,0,0|4,0,0]=4 4 B7R1.2 CC1=CC(C)=NO1 TL00573 [1,0,0,0,0,0|2,0,0]=3 5 B7R1.2 CC1=COC(N)=N1 KM08202 [1,0,0,0,0,0|1,0,0]=2 6 B7R1.2 CC1=NC(I)=CN1 MO00831 [1,0,0,0,0,0|2,0,0]=3 7 B7R1.2 CN1C=CC(Cl)=N1 MO08357 [1,0,0,0,0,0|3,0,0]=4 8 B7R1.2 CN1C=CC(I)=N1 CC48311 [1,0,0,0,0,0|3,0,0]=4 9 B7R1.2 CN1C=CC(N)=N1 GK00321 [1,0,0,0,0,0|3,0,0]=4 10 B7R1.4 CC1=C(I)C=NO1 CC26311 [1,0,0,0,0,0|3,0,0]=4 11 B7R1.4 CN1N=CC=C1I CC62311 [1,0,0,0,0,0|3,0,0]=4 12 B7R1.4 CN1N=CC=C1N GK03066 [1,0,0,0,0,0|3,0,0]=4 13 B9R1.22 CC1=CC(C)=C(C=O)N1 CC18004 [0,1,0,0,0,0|1,0,2]=4 14 B9R1.22 CC1=NN(C)C(C=O)=C1 CC12504 [0,1,0,0,0,0|2,0,1]=4 15 B9R1.22 CC1=NN(C)C(CCl)=C1 CC12524 [0,1,0,0,0,0|2,0,0]=3 16 B9R1.22 CC1=NN(C)C(CO)=C1 CC12509 [0,1,0,0,0,0|2,0,0]=3 17 B9R1.22 CN1C=C(Br)C(CCl)=N1 CC63924 [0,1,0,0,0,0|3,0,0]=4 18 B9R1.22 CN1C=C(Br)C(CO)=N1 CC63909 [0,1,0,0,0,0|3,0,0]=4 19 B9R1.23 CC1=C(C)OC(C=O)=C1 BTB08889 [0,1,0,0,0,0|1,0,1]=3 20 B9R1.23 CC1=CC(CO)=NN1C CC12609 [0,1,0,0,0,0|2,0,0]=3 21 B9R1.34 CC1=CC(C)=CC(F)=C1 HAN00040 [0,0,0,0,0,1|3,0,0]=4 22 B9R1.34 CC1=CC(Cl)=CC(C)=N1 MAY00207 [0,0,0,0,0,1|2,0,0]=3 23 B9R1.34 CC1=NC(C)=NC(N)=N1 RF02292 [0,0,0,0,0,1|2,0,0]=3 24 B9R1.69 CC1=C(N)N=CC(Br)=C1 XBX00112 [0,0,0,0,0,1|3,0,0]=4 25 B9R1.69 CC1=CC(Br)=C(Cl)N=C1 MO07184 [0,0,0,0,0,1|3,0,0]=4 26 B9R1.69 CC1=CC(Br)=C(N)N=C1 XBX00111 [0,0,0,0,0,1|3,0,0]=4 27 B9R1.69 CC1=CC=C(O)C(C)=N1 RH01494 [0,0,0,0,0,1|2,0,0]=3 28 B9R1.69 CC1=CN=C(Cl)C(C)=N1 MO08011 [0,0,0,0,0,1|2,0,0]=3 29 B9R1.69 CC1=CN=C(N)C(C)=N1 BTB07911 [0,0,0,0,0,1|2,0,0]=3 30 B9R1.69 CC1=NC(N)=CC=C1Br XBX00110 [0,0,0,0,0,1|3,0,0]=4 31 B6R1.2 BrC1=CC=CO1 CC02010 [2,0,0,0,0,0|2,0,0]=4 32 B6R1.2 ClC1=NC=CS1 MO07794 [2,0,0,0,0,0|1,1,0]=4 33 B8R1.1 CC1=CC(CBr)=NO1 CC10408 [1,1,0,0,0,0|2,0,0]=4 34 B8R1.1 CC1=CC(CCl)=NO1 SPB01262 [1,1,0,0,0,0|2,0,0]=4 35 B8R1.1 CC1=CC(CN)=NO1 CC10413 [1,1,0,0,0,0|2,0,0]=4 36 B8R1.1 CC1=CC(CO)=NO1 CC10409 [1,1,0,0,0,0|2,0,0]=4 37 B8R1.1 CC1=CC=C(CN)S1 CC65063 [1,1,0,0,0,0|1,1,0]=4 38 B8R1.1 CC1=CSC(C=O)=N1 NP42935 [1,1,0,0,0,0|0,1,1]=4 39 B8R1.1 CC1=CSC(CN)=C1 CC30613 [1,1,0,0,0,0|1,1,0]=4 40 B8R1.1 CC1=NC(C=O)=CN1 SB01361 [1,1,0,0,0,0|1,0,1]=4 41 B8R1.1 CC1=NC(C=O)=CO1 CC57904 [1,1,0,0,0,0|0,0,1]=3 42 B8R1.1 CC1=NC(C=O)=CS1 CC05704 [1,1,0,0,0,0|0,1,1]=4 43 B8R1.1 CC1=NC(CCl)=CS1 CD09497 [1,1,0,0,0,0|0,1,0]=3 44 B8R1.1 CC1=NC(CN)=CS1 CC05713 [1,1,0,0,0,0|0,1,0]=3 45 B8R1.1 CC1=NC(CO)=CS1 CC05709 [1,1,0,0,0,0|0,1,0]=3 46 B8R1.1 CC1=NOC(CN)=C1 CC27013 [1,1,0,0,0,0|2,0,0]=4 47 B8R1.1 CC1=NOC(CO)=C1 CC27009 [1,1,0,0,0,0|2,0,0]=4 48 B8R1.1 CN1C=CC(CO)=N1 CC48309 [1,1,0,0,0,0|2,0,0]=4 49 B8R1.1 CN1C=NC(CN)=C1 CC03613 [1,1,0,0,0,0|2,0,0]=4 50 B8R1.50 CC1=NC=C(Br)N1C CC25110 [1,1,0,0,0,0|2,0,0]=4 51 B8R1.50 CC1=NN=C(C)N1N CD08995 [1,1,0,0,0,0|2,0,0]=4 52 B8R1.50 CC1=NOC(C)=C1Br CC00610 [1,1,0,0,0,0|2,0,0]=4 53 B8R1.11 CC1=C(C=O)C=CO1 CC55404 [1,1,0,0,0,0|1,0,1]=4 54 B8R1.11 CC1=C(C=O)NC=N1 SB01366 [1,1,0,0,0,0|1,0,1]=4 55 B8R1.11 CC1=C(C=O)SC=N1 NP42997 [1,1,0,0,0,0|0,1,1]=4 56 B8R1.11 CC1=C(CN)OC=C1 CC55513 [1,1,0,0,0,0|1,0,0]=3 57 B8R1.11 CC1=C(CO)C=CO1 CD10514 [1,1,0,0,0,0|1,0,0]=3 58 B8R1.11 CN1C=CN=C1CO CC20809 [1,1,0,0,0,0|2,0,0]=4 59 B8R1.11 CN1N=CC=C1CO CC62309 [1,1,0,0,0,0|2,0,0]=4 60 B10R1.8 CC1=NC(C)=NC(NN)=C1 BTB10371 [0,1,0,0,0,1|2,0,0]=4 61 B10R1.35 CCC1=NC(C)=C(C=O)N1 SB01365 [0,2,0,0,0,0|1,0,1]=4 62 B10R1.59 CC(=O)C1=C(C)C=C(C)N1 SEW06333 [0,2,0,0,0,0|1,0,1]=4 63 B10R1.59 CC1=CC(C(=O)Cl)=C(C)O1 CC01102 [0,2,0,0,0,0|1,0,1]=4 64 B10R1.59 CC1=NC(C(=O)Cl)=C(C)O1 CC26802 [0,2,0,0,0,0|0,0,1]=3 65 B10R1.59 CC1=NC(C(=O)O)=C(C)O1 CC26801 [0,2,0,0,0,0|0,0,1]=3 66 B10R1.59 CC1=NC(C)=C(C(=O)O)S1 CC05801 [0,2,0,0,0,0|0,1,1]=4 67 B10R1.130 CNCC1=CC(C)=NN1C CC12546 [0,2,0,0,0,0|2,0,0]=4 68 B10R1.256 CC1=NN(C)C(C)=C1C=O CC14704 [0,2,0,0,0,0|2,0,0]=4 69 B10R1.58 CC1=C(C)OC(C(=O)O)=C1 BTB08890 [0,2,0,0,0,0|1,0,1]=4 70 B8R1.3 CC1=CN=C(N)C=N1 MO08458 [1,0,0,0,0,1|2,0,0]=4 71 B8R1.3 CC1=CN=C(O)C=C1 AC35768 [1,0,0,0,0,1|2,0,0]=4 72 B8R1.3 CC1=NNC(=O)C=C1 BTB06840 [1,0,0,0,0,1|2,0,0]=4