0 B14R2.101 C1=CC=C(C=C1)CCN2C=CN=C2 PI-44178 [0,0,0,0,0,0|2,0,1]=3 1 B14R2.101 c1ccc(cc1)CSc2nnn[nH]2 PI-31109 [0,0,0,0,0,0|3,0,1]=4 2 B15R2.64 C1=CC=C(C=C1)C[C@@H](C2=NC=CS2)N PI-48764 [0,1,0,0,0,0|2,0,0]=3 3 B15R2.100 C1=CC(=CC=C1SCC2=NNN=N2)Cl PI-20224 [0,1,0,0,0,0|3,0,0]=4 4 B15R2.100 CC1=CC=C(C=C1)NCC2=CC=CO2 PI-17887 [0,1,0,0,0,0|3,0,0]=4 5 B13R2.64 C(N1C=CN=C1)C2=CC=CC=C2 PI-24409 [0,0,0,0,1,0|2,0,1]=4 6 B13R2.64 C1=CC=C(C=C1)CC2=NNN=N2 PI-32965 [0,0,0,0,1,0|2,0,0]=3 7 B13R2.64 C1=CC=C(C=C1)CN2C=CC=N2 PI-35474 [0,0,0,0,1,0|2,0,0]=3 8 B13R2.64 C1=CC=C(C=C1)OC2=CSC=C2 PI-29804 [0,0,0,0,1,0|3,0,0]=4 9 B15R2.2195 C1=CC=C(C=C1)CCC2=CC=CC=C2 PI-29039 [0,0,0,0,0,1|2,0,0]=3 10 B15R2.2195 C1=CC=C(C=C1)CNC2=CC=CC=N2 PI-31488 [0,0,0,0,0,1|2,0,0]=3 11 B15R2.2195 C1=CC=C(C=C1)COC2=CC=CC=C2 PI-20328 [0,0,0,0,0,1|3,0,0]=4 12 B15R2.2195 C1=CC=C(C=C1)COC2=CC=NC=C2 PI-43980 [0,0,0,0,0,1|2,0,1]=4 13 B15R2.2195 C1=CC=C(C=C1)CSC2=CC=CC=C2 PI-11012 [0,0,0,0,0,1|3,0,0]=4 14 B15R2.2195 C1=CN=CC=C1CCC2=CC=NC=C2 PI-25601 [0,0,0,0,0,1|2,0,1]=4 15 B15R2.2196 C1=CC=C(C=C1)CNCC2=CC=CO2 PI-28535 [0,0,0,0,0,1|2,0,0]=3 16 B15R2.2196 C1=COC(=C1)CNCC2=CC=NC=C2 PI-19599 [0,0,0,0,0,1|3,0,0]=4 17 B12R1.27 C1=CC=C(C=C1)CCC(=O)NN PI-50331 [1,0,1,0,0,0|1,0,1]=4 18 B12R1.27 C=CC(=O)OCc1ccccc1 PI-40377 [1,0,1,0,0,0|2,0,0]=4 19 B14R2.19 C1=CC=C(C=C1)CN2C=C(C=N2)I PI-12768 [0,1,0,0,1,0|2,0,0]=4 20 B14R2.72 C1=CC(=CC=C1CN2C=NC=N2)N PI-10031 [0,1,0,0,1,0|1,0,1]=4 21 B16R2.71 Nc1ncccc1OCc2ccccc2 PI-11014 [0,1,0,0,0,1|2,0,0]=4 22 B16R2.88 C1=CC=C(C=C1)CC(C2=CC=CC=C2)N PI-30389 [0,1,0,0,0,1|2,0,0]=4 23 B16R2.132 C1=CC=C(C=C1)COC2=NN=C(C=C2)Cl PI-47346 [0,1,0,0,0,1|2,0,0]=4 24 B16R2.252 C1=CC=C(C=C1)COC2=CC(=O)NC=C2 PI-44997 [0,1,0,0,0,1|2,0,0]=4 25 B16R2.135 CC1=CC=C(C=C1)CNCC2=CC=CO2 PI-19619 [0,1,0,0,0,1|2,0,0]=4 26 B16R2.2959 CC1=CC=CC=C1CNCC2=CC=CO2 PI-19334 [0,1,0,0,0,1|2,0,0]=4 27 B16R3.9 c1ccc2c(c1)CCc3ccccc23 PI-18901 [0,0,0,1,0,1|2,0,0]=4 28 B12R2.2 C1(=CC=CC=C1)C2=NC=CS2 PI-40540 [0,0,0,0,2,0|2,0,0]=4 29 B12R2.2 C1(C2=CC=CC=C2)=NNC=C1 PI-37171 [0,0,0,0,2,0|2,0,0]=4 30 B12R2.2 C1=CC=C(C=C1)C2=CC=CS2 PI-11147 [0,0,0,0,2,0|2,0,0]=4 31 B12R2.2 C1=CC=C(C=C1)C2=CN=CN2 PI-46515 [0,0,0,0,2,0|0,0,2]=4 32 B12R2.2 C1=CC=C(C=C1)C2=CSC=C2 PI-29382 [0,0,0,0,2,0|2,0,0]=4 33 B12R2.2 C1=CC=C(C=C1)C2=NNN=N2 PI-16175 [0,0,0,0,2,0|2,0,0]=4 34 B12R2.2 C1=CC=C(C=C1)N2C=CC=N2 PI-13606 [0,0,0,0,2,0|2,0,0]=4 35 B12R2.2 c1ccc(cc1)c2ncc[nH]2 PI-31813 [0,0,0,0,2,0|2,0,0]=4 36 B12R2.2 n1ccc(cc1)c2c[nH]cn2 PI-36102 [0,0,0,0,2,0|1,0,0]=3 37 B16R2.2256 C(NCc1ccccc1)c2ccccc2 PI-32640 [0,0,0,0,0,2|2,0,0]=4 38 B16R2.2256 C1=CC=C(C=C1)CNCC2=CC=CC=N2 PI-11656 [0,0,0,0,0,2|1,0,0]=3 39 B16R2.2256 c1ccc(cc1)CCOc2ccccc2 PI-38238 [0,0,0,0,0,2|2,0,0]=4