0 B16R2.15551 CC1=CC2=C(C=C1)NC=C2CCC(=O)O Z1276694079 [0,0,0,0,0,0|4,0,0]=4 1 B16R2.15551 CN(C)CCC1=CNC2=C1C=C(C=C2)Br Z4439411857 [0,0,0,0,0,0|1,0,0]=1 2 B16R2.15551 CN(C)CCC1=CNC2=C1C=C(C=C2)N Z4606621023 [0,0,0,0,0,0|1,0,0]=1 3 B16R2.15551 CN(C)CCN1C=CC2=C1C=C(C=C2)N Z414315248 [0,0,0,0,0,0|3,0,0]=3 4 B16R2.15551 O=C(O)CCC1=CNC2=C1C=C(C=C2)Br Z1509618627 [0,0,0,0,0,0|4,0,0]=4 5 B15R2.6 CC(=O)CCC1=CNC2=C1C=CC=C2 Z276142282 [1,0,0,0,0,0|2,0,0]=3 6 B15R2.6 CC(C)CCN1C=NC2=C1C=CC=C2 Z56826120 [1,0,0,0,0,0|2,0,1]=4 7 B15R2.6 CN(C)CCC1=CNC2=C1N=CC=C2 Z5537309001 [1,0,0,0,0,0|1,0,0]=2 8 B15R2.6 NC(=O)CCC1=CNC2=C1C=CC=C2 Z33546345 [1,0,0,0,0,0|3,0,0]=4 9 B15R2.6 O=C(O)CCC1=CNC2=C1C=CC=C2 Z104482518 [1,0,0,0,0,0|3,0,0]=4 10 B17R2.25461 N[C@@H](CC1=CNC2=C1C=C(C=C2)O)C(=O)O Z2044741046 [0,1,0,0,0,0|3,0,0]=4 11 B17R2.39006 CN(C)CCC1=CNC2=C1C=C(C(=C2)Br)Br Z3664736236 [0,1,0,0,0,0|1,0,0]=2 12 B17R2.150937 CN(C)CCN1C(=O)OC2=C1C=C(C=C2)N Z424795726 [0,1,0,0,0,0|3,0,0]=4 13 B15R2.9410 CC(N)CC1=CNC2=C1C=C(C=C2)F Z1198156503 [0,0,0,0,1,0|3,0,0]=4 14 B15R2.9410 CC(N)CC1=CNC2=C1C=C(C=C2)O Z1255489555 [0,0,0,0,1,0|2,0,0]=3 15 B15R2.9410 CC(N)CC1=CSC2=C1C=C(C=C2)O Z4560488456 [0,0,0,0,1,0|3,0,0]=4 16 B15R2.9410 CN(C)CC1=CNC2=C1C=C(C=C2)Br Z1269196757 [0,0,0,0,1,0|1,0,0]=2 17 B17R2.25462 CC(=O)NCCC1=CNC2=C1C=C(C=C2)F Z1220452176 [0,0,0,0,0,1|3,0,0]=4 18 B14R1.6072 CC1=CC(=C(C=C1)N)OCCN(C)C Z295457994 [1,0,1,0,0,0|2,0,0]=4 19 B14R2.3 CCNCC1=CNC2=C1C=CC=C2 Z1787158574 [2,0,0,0,0,0|2,0,0]=4 20 B14R2.3 NCCCC1=CNC2=C1C=CC=C2 Z275361382 [2,0,0,0,0,0|2,0,0]=4 21 B14R2.6419 CC1=CC2=C(C=C1)NC=C2CCN Z2106599153 [2,0,0,0,0,0|1,0,0]=3 22 B14R2.6419 CC1=NC2=C(C=C1)NC=C2CCN Z2798529206 [2,0,0,0,0,0|2,0,0]=4 23 B14R2.6419 N#CCC1=CNC2=C1C=C(C=C2)O Z1198149461 [2,0,0,0,0,0|0,0,2]=4 24 B14R2.6419 NCCC1=CNC2=C1C=C(C=C2)Br Z2760930339 [2,0,0,0,0,0|1,0,0]=3 25 B14R2.6419 NCCC1=CNC2=C1C=C(C=C2)Cl Z1266933935 [2,0,0,0,0,0|1,0,0]=3 26 B14R2.6419 NCCC1=CNC2=C1C=C(C=C2)F Z1741960310 [2,0,0,0,0,0|1,0,0]=3 27 B14R2.6419 NCCC1=CNC2=C1C=C(C=C2)O Z1741979085 [2,0,0,0,0,0|0,0,0]=2 28 B14R2.6419 NCCC1=CNC2=C1C=C(C=N2)F Z3386766102 [2,0,0,0,0,0|2,0,0]=4 29 B14R2.6419 NCCC1=CSC2=C1C=C(C=C2)Br Z1269157473 [2,0,0,0,0,0|2,0,0]=4 30 B16R1.1067 CN(C)CCNC(=O)NC1=CC=C(C=C1)Cl Z44596500 [0,1,1,0,0,0|2,0,0]=4 31 B16R2.12 CN(C)C(=O)CC1=CNC2=C1C=CC=C2 Z32014417 [1,1,0,0,0,0|0,0,1]=3 32 B16R2.14 CNC(=O)CCC1=CNC2=C1C=CC=C2 Z32016249 [1,1,0,0,0,0|2,0,0]=4 33 B16R2.14 COC(=O)CCC1=CNC2=C1C=CC=C2 Z13758675 [1,1,0,0,0,0|2,0,0]=4 34 B16R2.2976 CN(C)CCN1C=CC2=C1C=CC(=C2)N Z385461758 [1,1,0,0,0,0|2,0,0]=4 35 B16R2.4003 CC(C)CCN1C(=O)NC2=C1C=CC=C2 Z57114987 [1,1,0,0,0,0|2,0,0]=4 36 B16R2.15533 CC(C)(N)CC1=CNC2=C1C=C(C=C2)Br Z3461683569 [0,1,0,0,1,0|2,0,0]=4 37 B18R2.120971 COC1=CC2=C(C=C1)NC=C2CCNC(=O)C Z1191880499 [0,1,0,0,0,1|2,0,0]=4 38 B18R2.120970 COC1=CC2=C(C=C1)NC=C2CC(=O)N(C)C Z408405930 [0,2,0,0,0,0|0,0,1]=3 39 B18R2.274086 CC1=C(C2=C(N1)C=CC(=C2)Br)CC(=O)N(C)C Z383001838 [0,2,0,0,0,0|1,0,1]=4 40 B18R2.274086 CC1=C(C2=C(N1)C=CC(=C2)F)CC(=O)N(C)C Z339691808 [0,2,0,0,0,0|1,0,1]=4 41 B16R3.2583 BrC1=CC2=C(C=C1)NC3=C2CCCC3 Z1259160646 [1,0,0,1,0,0|2,0,0]=4 42 B16R3.2583 BrC1=CC2=C(C=C1)NC3=C2CCNC3 Z1269184800 [1,0,0,1,0,0|1,0,0]=3 43 B16R3.2583 NC1=CC2=C(C=C1)NC3=C2CCCC3 Z2206140950 [1,0,0,1,0,0|2,0,0]=4 44 B16R3.2583 OC1=CC2=C(C=C1)OC3=C2CCCC3 Z55993029 [1,0,0,1,0,0|2,0,0]=4 45 B14R2.2 CC(=O)CC1=CNC2=C1C=CC=C2 Z277541166 [1,0,0,0,1,0|2,0,0]=4 46 B14R2.2 CN(C)CC1=CNC2=C1C=CC=C2 Z56917380 [1,0,0,0,1,0|0,0,0]=2 47 B16R2.36 CC(=O)NCCC1=CNC2=C1C=CC=C2 Z26395416 [1,0,0,0,0,1|2,0,0]=4 48 B16R2.36 CC(C)CNCC1=CSC2=C1C=CC=C2 Z211320908 [1,0,0,0,0,1|2,0,0]=4