0 B15R2.43 CNCC1=C(C=CC=C1)N2C=CC=C2 Z803068168 [0,0,0,0,0,0|2,0,0]=2 1 B15R2.43 CNCC1=C(C=CC=C1)N2C=NC=N2 Z409391480 [0,0,0,0,0,0|3,0,0]=3 2 B14R2.98 COC1=C(C=CC=C1)N2C=CC=N2 Z1080446128 [1,0,0,0,0,0|3,0,0]=4 3 B14R2.98 NCC1=C(C=CC=C1)C2=CC=CO2 Z4461364327 [1,0,0,0,0,0|0,1,0]=2 4 B14R2.98 NCC1=C(C=CC=C1)C2=NC=CN2 Z2289755684 [1,0,0,0,0,0|2,0,0]=3 5 B14R2.98 NCC1=C(C=NC=C1)C2=NNC=C2 Z4002317543 [1,0,0,0,0,0|3,0,0]=4 6 B14R2.98 NCC1=C(N=CC=C1)N2C=CC=N2 Z803145300 [1,0,0,0,0,0|3,0,0]=4 7 B16R2.111 CCNCC1=C(C=CC=C1)N2C=NC=N2 Z409391434 [0,1,0,0,0,0|3,0,0]=4 8 B16R3.5924 C1=CSC(=C1)C2=C3C=CNC3=CC=C2 Z2681260822 [0,0,0,1,0,0|2,0,1]=4 9 B16R3.5924 C1=CSC(=C1)C2=C3N=COC3=CC=C2 Z3484479227 [0,0,0,1,0,0|3,0,0]=4 10 B16R2.98 CNCC1=C(C=CC=C1)C2=CC=CC=C2 Z729206350 [0,0,0,0,0,1|1,0,0]=2 11 B13R2.18 BrC1=C(C=CC=C1)C2=NC=CS2 Z5057501978 [2,0,0,0,0,0|2,0,0]=4 12 B13R2.18 NC1=C(C=CC=C1)C2=CC=NN2 Z336080866 [2,0,0,0,0,0|2,0,0]=4 13 B13R2.18 NC1=C(C=CC=C1)C2=NC=CN2 Z815309798 [2,0,0,0,0,0|2,0,0]=4 14 B13R2.18 NC1=C(C=CC=C1)C2=NC=CO2 Z815304276 [2,0,0,0,0,0|1,1,0]=4 15 B13R2.18 NC1=C(C=CC=C1)C2=NC=CS2 Z877535298 [2,0,0,0,0,0|1,0,0]=3 16 B13R2.18 NC1=C(C=CC=C1)N2C=CC=N2 Z239137406 [2,0,0,0,0,0|2,0,0]=4 17 B13R2.18 NC1=C(N=CC=C1)C2=CC=CO2 Z1198170029 [2,0,0,0,0,0|1,1,0]=4 18 B13R2.18 OC1=C(C=CC=C1)C2=NC=CS2 Z815284836 [2,0,0,0,0,0|2,0,0]=4 19 B15R2.1221 CC(N)C1=C(C=CC=C1)N2C=CC=N2 Z332383418 [1,1,0,0,0,0|2,0,0]=4 20 B15R2.1221 O=[N+]([O-])C1=C(C=CC=C1)C2=CC=CS2 Z169852168 [1,1,0,0,0,0|1,0,1]=4 21 B15R2.2189 CC1=NN(C=C1)C2=C(C=CC=C2)CN Z991547102 [1,1,0,0,0,0|2,0,0]=4 22 B15R2.2189 CCC1=C(C=CC=C1)C2=NN=C(S2)C Z2998223571 [1,1,0,0,0,0|2,0,0]=4 23 B15R2.2189 COC1=C(C=CC=C1)C2=NC(=CS2)C Z48866583 [1,1,0,0,0,0|2,0,0]=4 24 B15R2.2229 CCNCC1=CNN=C1C2=CC=CS2 Z1139774705 [0,1,0,0,1,0|2,0,0]=4 25 B17R2.231 CNC(=O)C1=C(C=CC=C1)C2=CC=CC=C2 Z68248966 [0,1,0,0,0,1|1,0,1]=4 26 B17R2.5744 OCCCOC1=C(C=CC=C1)C2=NC=CS2 Z1783471515 [0,2,0,0,0,0|2,0,0]=4 27 B15R3.1739 C1=CC2=C(C=C1)C3=NNC=C3CC2 Z3227034312 [1,0,0,1,0,0|2,0,0]=4 28 B17R3.1963 C1=CC2=C(C=C1)C3=C(C=CC=C3)CNC2 Z1262327463 [0,0,0,1,0,1|1,0,0]=3 29 B17R3.182920 CNC1C2=C(C=CC=C2)C3=C1C=CC=C3 Z44508054 [0,0,0,1,0,1|1,0,0]=3 30 B17R3.2679 C1=CSC(=C1)C2CNCC3=C2C=CC=C3 Z2681258122 [0,0,0,1,0,1|0,0,0]=2 31 B15R2.21 CNC1=C(C=CC=C1)C2=CC=CC=C2 Z1259341038 [1,0,0,0,0,1|1,0,0]=3 32 B15R2.21 NCC1=C(C=CC=C1)C2=CC=CC=C2 Z3234887271 [1,0,0,0,0,1|1,0,0]=3 33 B15R2.21 NCC1=C(N=CC=C1)C2=CC=CC=C2 Z2313088996 [1,0,0,0,0,1|2,0,0]=4