0 B11R2.1 BrC1=CSC2=C1CNCC2 P15368 [1,0,0,0,0,0|2,1,0]=4 1 B11R2.1 BrC1=NNC2=C1CCCC2 P11498 [1,0,0,0,0,0|3,0,0]=4 2 B11R2.1 CC1=NNC2=C1CNCC2 83193 [1,0,0,0,0,0|3,0,0]=4 3 B11R2.1 CC1=NNC2=C1CNCC2 P11081 [1,0,0,0,0,0|3,0,0]=4 4 B11R2.1 CN1C=NC2=C1CCNC2 S11242 [1,0,0,0,0,0|3,0,0]=4 5 B11R2.1 CN1C=NC2=C1CCNC2 W17908 [1,0,0,0,0,0|3,0,0]=4 6 B11R2.1 ClC1=NNC2=C1CCCC2 C13846 [1,0,0,0,0,0|3,0,0]=4 7 B11R2.1 NC1=C2CCCCC2=NO1 A11999 [1,0,0,0,0,0|3,0,0]=4 8 B11R2.1 NC1=NNC2=C1CCCC2 32637 [1,0,0,0,0,0|3,0,0]=4 9 B11R2.1 NC1=NOC2=C1CCCC2 AT25039 [1,0,0,0,0,0|2,0,0]=3 10 B11R2.1 OC1=NOC2=C1CCNC2 P17040 [1,0,0,0,0,0|3,0,0]=4 11 B11R2.36 CN1CCC2=C(C1)NC=N2 C77154 [1,0,0,0,0,0|3,0,0]=4 12 B11R2.36 CN1CCN2C=CN=C2C1 W10692 [1,0,0,0,0,0|3,0,0]=4 13 B11R2.36 C[C@H]1CN2N=CC=C2CN1 C90721 [1,0,0,0,0,0|3,0,0]=4 14 B11R2.36 O[C@H]1CCN2C=CN=C2C1 D80225 [1,0,0,0,0,0|3,0,0]=4 15 B13R2.3736 CC1(C)CCC2=C(C1)NN=C2I 84160 [0,1,0,0,0,0|3,0,0]=4 16 B11R1.465 CNCCC1=C(C)NN=C1C D86528 [0,0,1,0,0,0|3,0,0]=4 17 B13R2.3683 CC1=CC2=C(C=C1)CC(=O)CC2 Y11712 [0,0,0,0,0,1|2,0,1]=4 18 B13R2.3683 CN1CCC2=C(C=CC(F)=C2)C1 D80158 [0,0,0,0,0,1|3,0,0]=4 19 B13R2.3683 CN1CCC2=C(C=CC(N)=C2)C1 Y11307 [0,0,0,0,0,1|3,0,0]=4 20 B13R2.3683 CN1CCC2=C(C=CC(O)=C2)C1 F14525 [0,0,0,0,0,1|3,0,0]=4 21 B13R2.3683 C[C@H]1CC2=C(C=C(Br)C=C2)CN1 F52643 [0,0,0,0,0,1|3,0,0]=4 22 B13R2.3683 C[C@H]1CCC2=C(C=CC(N)=C2)N1 W10064 [0,0,0,0,0,1|3,0,0]=4 23 B13R2.3683 N[C@H]1CCC2=C(C=CC(Br)=C2)C1 20174 [0,0,0,0,0,1|3,0,0]=4 24 B13R2.3683 N[C@H]1CCC2=C(C=CC(Br)=C2)C1 S11530 [0,0,0,0,0,1|3,0,0]=4 25 B13R2.3683 N[C@H]1CCC2=C(C=CC(Cl)=C2)C1 20172 [0,0,0,0,0,1|3,0,0]=4 26 B13R2.3683 N[C@H]1CCC2=C(C=CC(F)=C2)C1 Y11723 [0,0,0,0,0,1|3,0,0]=4 27 B13R2.3683 N[C@H]1CCC2=C(C=CC(F)=C2)C1 Y11805 [0,0,0,0,0,1|3,0,0]=4 28 B13R2.3683 O[C@H]1CCC2=C(C=CC(F)=C2)C1 Y11724 [0,0,0,0,0,1|3,0,0]=4 29 B13R2.5179 CN1CCC2=C(O)C=CC=C2C1 F14432 [0,0,0,0,0,1|3,0,0]=4 30 B13R2.5179 N[C@H]1CCC2=C(O)C=CC=C2C1 D85475 [0,0,0,0,0,1|3,0,0]=4 31 B10R1.13 C[C@@H]1CC=C(C(=O)O)CC1 D79048 [1,0,1,0,0,0|1,0,0]=3 32 B10R1.54 CC1=NOC(C[C@H](C)N)=C1 72329 [1,0,1,0,0,0|2,0,0]=4 33 B10R1.29 CCCCN1C=CN=C1C F14619 [1,0,1,0,0,0|2,0,0]=4 34 B10R1.187 CC1=NOC(C)=C1CCO A12871 [1,0,1,0,0,0|2,0,0]=4 35 B10R2.7 C1=CC2=C(CCCC2)N1 P10023 [2,0,0,0,0,0|1,0,0]=3 36 B10R2.7 C1=CC2=C(CCCC2)S1 AC8430 [2,0,0,0,0,0|0,1,0]=3 37 B10R2.7 C1=CC2=C(CCNC2)N1 32435 [2,0,0,0,0,0|2,0,0]=4 38 B10R2.7 C1=CC2=C(CCNC2)O1 31880 [2,0,0,0,0,0|1,0,0]=3 39 B10R2.7 C1=CC2=C(CNCC2)S1 SC1001 [2,0,0,0,0,0|1,1,0]=4 40 B10R2.7 C1=NN2CCCCC2=C1 P18739 [2,0,0,0,0,0|2,0,0]=4 41 B12R2.1 ClCC1=NNC2=C1CCCC2 AC1689 [1,1,0,0,0,0|2,0,0]=4 42 B12R2.1 OCC1=C2CCCCC2=NO1 72897 [1,1,0,0,0,0|2,0,0]=4 43 B12R2.1 OCC1=NOC2=C1CCCC2 71778 [1,1,0,0,0,0|1,0,0]=3 44 B12R2.196 CC1=NOC2=C1CCCC2=O W12309 [1,1,0,0,0,0|1,0,1]=4 45 B12R2.120 CC1(C)CCC2=C(C1)NN=C2 84457 [1,1,0,0,0,0|2,0,0]=4 46 B12R2.606 C[C@H]1CCC2=C(C1)SC(N)=N2 L10125 [1,1,0,0,0,0|1,1,0]=4 47 B14R2.2332 COC1=CC2=C(C=C1)CN(C)CC2 F14520 [0,1,0,0,0,1|2,0,0]=4 48 B14R2.2332 COC1=CC2=C(C=C1)C[C@@H](N)CC2 C91698 [0,1,0,0,0,1|2,0,0]=4 49 B14R2.1073 COC1=C2CC[C@H](N)CC2=CC=C1 C10755 [0,1,0,0,0,1|2,0,0]=4 50 B14R2.1073 COC1=C2CC[C@H](N)CC2=CC=C1 C11867 [0,1,0,0,0,1|2,0,0]=4 51 B14R2.1073 COC1=C2CC[C@H](N)CC2=CC=C1 O11459 [0,1,0,0,0,1|2,0,0]=4 52 B14R2.24368 CC1=CNC2=C1C(=O)CC(C)(C)C2 C75631 [0,2,0,0,0,0|1,0,1]=4 53 B12R1.125 CC1=C(CNC(C)C)C=CC=C1 C78577 [0,0,1,0,0,1|2,0,0]=4