0 B14R2.19 ClC1=NNC(CC2=CC=CC=C2)=N1 4018523 [0,0,0,0,0,0|3,0,1]=4 1 B14R2.19 NC1=CN(CC2=CC=CC=C2)N=C1 4029886 [0,0,0,0,0,0|4,0,0]=4 2 B14R2.19 NC1=NC(CC2=CC=CC=C2)=NN1 4015723 [0,0,0,0,0,0|2,0,1]=3 3 B14R2.19 NC1=NC=C(CC2=CC=CC=C2)S1 4006047 [0,0,0,0,0,0|2,0,2]=4 4 B14R2.19 NC1=NN(CC2=CC=CC=C2)C=C1 4031721 [0,0,0,0,0,0|2,0,1]=3 5 B14R2.19 NC1=NN=C(CC2=CC=CC=C2)S1 5314675 [0,0,0,0,0,0|3,0,1]=4 6 B14R2.19 O=C1CC(CC2=CC=CC=C2)CN1 4026758 [0,0,0,0,0,0|3,0,0]=3 7 B13R2.64 C1=CC=C(CC2CCNC2)C=C1 4042868 [1,0,0,0,0,0|2,0,1]=4 8 B15R2.15 NCC1=CSC(CC2=CC=CC=C2)=N1 4003975 [0,1,0,0,0,0|2,0,1]=4 9 B15R2.15 NCC1=NC(CC2=CC=CC=C2)=NO1 4002480 [0,1,0,0,0,0|1,0,1]=3 10 B15R2.15 NCC1=NOC(CC2=CC=CC=C2)=N1 4028414 [0,1,0,0,0,0|2,0,1]=4 11 B15R2.297 O=C1CC(C(=O)C2=CC=CC=C2)CO1 9071210 [0,1,0,0,0,0|2,0,1]=4 12 B15R2.325 CC1=CC(N)=NN1CC2=CC=CC=C2 4031251 [0,1,0,0,0,0|2,0,1]=4 13 B13R1.337 NC(=O)CCNCC1=CC=CC=C1 5301711 [0,0,1,0,0,0|3,0,0]=4 14 B13R1.348 CN(CC(=O)O)CC1=CC=CC=C1 4110663 [0,0,1,0,0,0|3,0,0]=4 15 B13R2.10 NC1=NC(C2=CC=CC=C2)=NN1 4002340 [0,0,0,0,1,0|2,0,1]=4 16 B13R2.10 NC1=NOC(C2=CC=CC=C2)=N1 5217756 [0,0,0,0,1,0|2,0,1]=4 17 B15R2.31 O=C1CNC[C@H](CC2=CC=CC=C2)N1 4069109 [0,0,0,0,0,1|2,0,1]=4 18 B15R2.283 NC1=NC(CCC2=CC=CC=C2)=NN1 4015724 [0,0,0,0,0,1|2,0,1]=4 19 B15R2.283 NC1=NNC(NCC2=CC=CC=C2)=N1 4022738 [0,0,0,0,0,1|2,0,1]=4 20 B12R1.118 CCC(CN)CC1=CC=CC=C1 4033135 [1,0,1,0,0,0|1,0,1]=4 21 B12R1.118 CCC(CN)CC1=CC=CC=C1 4110768 [1,0,1,0,0,0|1,0,1]=4 22 B12R1.252 N=C(N)CCCC1=CC=CC=C1 4059893 [1,0,1,0,0,0|2,0,0]=4 23 B14R2.8 NCC1=NC(C2=CC=CC=C2)=NO1 4090207 [0,1,0,0,1,0|1,0,1]=4 24 B14R2.8 NCC1=NC(C2=CC=CC=C2)=NO1 4102650 [0,1,0,0,1,0|1,0,1]=4 25 B16R2.92 NCCC1=NC(CC2=CC=CC=C2)=NO1 4002485 [0,2,0,0,0,0|1,0,1]=4 26 B12R1.43 CC(OC1=CC=CC=C1)C(=O)O 3001886 [0,0,1,0,1,0|2,0,0]=4 27 B12R1.43 CN(CC1=CC=CC=C1)C(=N)N 4015994 [0,0,1,0,1,0|2,0,0]=4 28 B12R1.43 CN(CC1=CC=CC=C1)C(=N)N 4090580 [0,0,1,0,1,0|2,0,0]=4 29 B12R1.43 CN(CC1=CC=CC=C1)C(N)=S 4009975 [0,0,1,0,1,0|1,1,0]=4 30 B12R1.107 CC(NC(=N)N)C1=CC=CC=C1 4002596 [0,0,1,0,1,0|1,0,1]=4 31 B12R1.107 CC(NC(=N)N)C1=CC=CC=C1 4090863 [0,0,1,0,1,0|1,0,1]=4 32 B12R2.22 O=C1CC(C2=CC=CC=C2)C1 4002962 [0,0,0,0,2,0|2,0,0]=4 33 B12R2.22 O=C1CC(C2=CC=CC=C2)N1 4030655 [0,0,0,0,2,0|1,0,1]=4 34 B14R1.422 NC(=O)CCNCCC1=CC=CC=C1 4091220 [0,0,1,0,0,1|2,0,0]=4 35 B14R1.422 NC(=O)CCNCCC1=CC=CC=C1 5301488 [0,0,1,0,0,1|2,0,0]=4