0 B15R3.3 C1=CC2=C(C=C1)C3=C(CNCC3)O2 27677 [0,0,0,0,0,0|3,0,0]=3 1 B15R3.3 C1=CC2=C(C=C1)C3=NC=CN=C3N2 F14437 [0,0,0,0,0,0|3,0,1]=4 2 B15R3.3 C1=CC2=C(C=C1)C3CNCCC3N2 D72749 [0,0,0,0,0,0|0,0,2]=2 3 B16R3.2583 ClC1=CC2=C(C=C1)OC3=C2CNCC3 C15432 [0,1,0,0,0,0|1,0,0]=2 4 B16R3.2637 CN1CCC2=C(C1)NC3=C2C=CC=C3 97533 [0,1,0,0,0,0|2,0,0]=3 5 B16R3.2637 ClC1=CC2=C(C=C1)C3=C(CCNC3)N2 F13938 [0,1,0,0,0,0|0,0,0]=1 6 B16R3.20606 O=C1C2=C(C=CC=C2)[C@@H]3CNCCN13 D72638 [0,1,0,0,0,0|2,0,1]=4 7 B16R3.27838 FC1=C2C(=CC=C1)NC3=C2CCNC3 D87018 [0,1,0,0,0,0|2,0,0]=3 8 B16R3.27838 O=C1NCCC2=C1C3=C(C=CC=C3)N2 D73222 [0,1,0,0,0,0|0,0,1]=2 9 B16R3.27838 O=C1NCCN2N=C3C=CC=CC3=C12 D73575 [0,1,0,0,0,0|1,0,2]=4 10 B14R2.3 CNCCC1=CNC2=CC=CN=C12 D74876 [0,0,1,0,0,0|3,0,0]=4 11 B14R2.6 C1=CC=C(OC2=CCNCC2)C=C1 AT22697 [0,0,1,0,0,0|1,0,0]=2 12 B14R2.24 O=C1CCNC[C@@H]1C2=CC=CC=C2 65831 [0,0,1,0,0,0|1,0,1]=3 13 B14R3.49 C1=CC2=C3CCCN=C3NC2=C1 D78614 [0,0,0,0,1,0|2,0,0]=3 14 B13R2.1 C#CCC1=CNC2=C1C=CC=C2 D75619 [1,0,1,0,0,0|0,0,2]=4 15 B13R2.3 C1=CC=C([C@@H]2CNCCN2)C=C1 P10438 [1,0,1,0,0,0|1,0,1]=4 16 B13R2.3 C1=CC=C([C@@H]2CNCCN2)C=C1 P10439 [1,0,1,0,0,0|1,0,1]=4 17 B15R2.65 CC1=C2NC=C(CCCN)C2=CC=C1 AC9328 [0,1,1,0,0,0|2,0,0]=4 18 B15R2.65 NCCCC1=CNC2=C(F)C=CC=C12 AC9798 [0,1,1,0,0,0|2,0,0]=4 19 B15R2.73 CCOC(=N)C1=CNC2=C1C=CC=C2 D87920 [0,1,1,0,0,0|1,0,1]=4 20 B15R2.1385 NCCCC1=CNC2=C1C=CC(Cl)=C2 AC8702 [0,1,1,0,0,0|2,0,0]=4 21 B15R2.1385 NCCCC1=CNC2=C1C=CC(F)=C2 AC8226 [0,1,1,0,0,0|2,0,0]=4 22 B15R2.17667 NCCCC1=CNC2=CC=CC(Br)=C12 AC9245 [0,1,1,0,0,0|2,0,0]=4 23 B15R2.17667 NCCCC1=CNC2=CC=CC(Cl)=C12 F30741 [0,1,1,0,0,0|2,0,0]=4 24 B15R2.17667 NCCCC1=CNC2=CC=CC(Cl)=C12 F52020 [0,1,1,0,0,0|2,0,0]=4 25 B15R2.17719 NCCCC1=CNC2=C1C=C(Br)C=C2 AC8703 [0,1,1,0,0,0|2,0,0]=4 26 B17R3.31626 O=C1NCCC2=C1C3=C(C=CC(F)=C3)N2 D73223 [0,2,0,0,0,0|0,0,1]=3 27 B17R3.31627 CN1CCC2=C(C1)C3=C(C=CC(Cl)=C3)N2 D73209 [0,2,0,0,0,0|0,0,0]=2 28 B17R3.31627 CN1CCC2=C(C1)C3=C(C=CC(F)=C3)N2 D73217 [0,2,0,0,0,0|0,0,0]=2 29 B17R3.31713 [2H]C1=CC2=C(C=C1)N(C)C3=C2CCCC3 AC2849 [0,2,0,0,0,0|1,0,0]=3 30 B17R3.51119 O=C1NCCC2=C1C3=CC=CC(F)=C3N2 D73199 [0,2,0,0,0,0|0,0,1]=3 31 B15R3.1738 C1=CC2=C(C=C1)[C@]3(CCNC3)CN2 AT21735 [0,0,1,1,0,0|0,0,2]=4 32 B15R3.24790 C1=CC2=C(C=C1)SC(C3CNC3)=N2 50243 [0,0,1,1,0,0|1,0,1]=4 33 B15R3.655 O=C1NC2=C(C=CC=C2)C13CNC3 D73396 [0,0,1,1,0,0|1,0,1]=4 34 B13R2.18 NC1=C(C2CCCC2)C=CC=C1 79075 [0,0,1,0,1,0|0,0,2]=4 35 B13R2.18 NC1=C([C@@H]2CCCN2)C=CC=C1 AC3119 [0,0,1,0,1,0|0,0,2]=4 36 B13R2.67 C1=CC2=C(C=C1)NCCCCC2 D76700 [0,0,1,0,1,0|0,0,2]=4 37 B15R2.2220 O=C1C(CCO)=NNC2=C1C=CC=C2 AT18215 [0,0,1,0,0,1|2,0,0]=4 38 B17R3.9117 C1=CC2=C(C=C1)N3CCNCCOC3=N2 W12288 [0,0,0,0,0,2|1,0,1]=4