0 B8R1.8 CNCC1=CN=CN1 PHBB_SC-12198 [0,0,0,0,0,0|4,0,0]=4 1 B8R1.8 ClCCN1C=CC=N1 PHBB_SC-03727 [0,0,0,0,0,0|3,0,0]=3 2 B8R1.8 NCCC1=CC=CO1 PHBB_SC-12255 [0,0,0,0,0,0|0,1,0]=1 3 B8R1.8 NCCC1=CNC=N1 PHBB_NC-00805 [0,0,0,0,0,0|2,0,0]=2 4 B8R1.8 NCCN1C=CC=N1 PHBB_SC-11529 [0,0,0,0,0,0|2,0,0]=2 5 B8R1.8 NCCN1C=CN=C1 PHBB_SC-11528 [0,0,0,0,0,0|3,0,0]=3 6 B8R1.8 O\N=C\C1=CC=CO1 PHBB_SC-04861 [0,0,0,0,0,0|2,1,1]=4 7 B7R1.1 CCC1=NC=CN1 PHBB_SC-05150 [1,0,0,0,0,0|2,0,0]=3 8 B7R1.1 COC1=NC=CS1 PHBB_SC-12117 [1,0,0,0,0,0|2,0,0]=3 9 B7R1.1 NCC1=CC=CO1 PHBB_SC-08340 [1,0,0,0,0,0|0,1,0]=2 10 B7R1.1 O=CC1=CC=CN1 PHBB_SC-03496 [1,0,0,0,0,0|2,0,1]=4 11 B7R1.1 O=CC1=CC=CS1 PHBB_SC-11010 [1,0,0,0,0,0|1,0,1]=3 12 B9R1.7 CC1=CSC(CCN)=N1 PHBB_SC-11768 [0,1,0,0,0,0|1,0,0]=2 13 B9R1.7 CC1=NN(CCCl)C=C1 PHBB_SC-03551 [0,1,0,0,0,0|3,0,0]=4 14 B9R1.7 CC1=NN(CCN)C=C1 PHBB_SC-07677 [0,1,0,0,0,0|2,0,0]=3 15 B9R1.7 CC1=NOC(CCN)=N1 PHBB_SC-06133 [0,1,0,0,0,0|2,1,0]=4 16 B9R1.7 CCCN1C=CC(C)=N1 PHBB_SC-02816 [0,1,0,0,0,0|3,0,0]=4 17 B9R1.7 CCCN1C=CC(N)=N1 PHBB_SC-02553 [0,1,0,0,0,0|3,0,0]=4 18 B9R1.7 CN1C=NC(CCN)=N1 PHBB_SC-11582 [0,1,0,0,0,0|3,0,0]=4 19 B9R1.12 CCNCC1=CC=CO1 PHBB_SC-01161 [0,1,0,0,0,0|1,1,0]=3 20 B9R1.12 ClCCCN1C=CC=C1 PHBB_SC-10528 [0,1,0,0,0,0|3,0,0]=4 21 B9R1.12 N#CCCN1C=CC=N1 PHBB_SC-02651 [0,1,0,0,0,0|2,0,1]=4 22 B9R1.12 NCCCC1=CC=CO1 PHBB_SC-01555 [0,1,0,0,0,0|0,1,0]=2 23 B9R1.12 NCCCN1C=CC=N1 PHBB_SC-07413 [0,1,0,0,0,0|2,0,0]=3 24 B9R1.12 NCCCN1C=CN=C1 PHBB_SC-11013 [0,1,0,0,0,0|3,0,0]=4 25 B9R1.12 S=C=NCC1=CC=CO1 PHBB_SC-01376 [0,1,0,0,0,0|1,1,1]=4 26 B9R1.13 O=C(Cl)CC1=CC=CS1 PHBB_SC-03499 [0,1,0,0,0,0|1,0,1]=3 27 B9R1.33 CC1=CC=NN1CCCl PHBB_SC-03725 [0,1,0,0,0,0|3,0,0]=4 28 B9R1.33 CC1=CC=NN1CCN PHBB_SC-07633 [0,1,0,0,0,0|2,0,0]=3 29 B9R1.33 CC1=NC=CN1CCN PHBB_SC-11527 [0,1,0,0,0,0|3,0,0]=4 30 B9R1.33 CNCC1=CC=CN1C PHBB_SC-06509 [0,1,0,0,0,0|3,0,0]=4 31 B9R2.3 C1=NNC2=C1CCC2 PHBB_SC-05297 [0,0,0,1,0,0|3,0,0]=4 32 B9R1.8 BrCCC1=CC=CC=C1 PHBB_SC-05006 [0,0,0,0,0,1|2,0,0]=3 33 B9R1.8 CCNC1=CC=CC=C1 PHBB_SC-05020 [0,0,0,0,0,1|3,0,0]=4 34 B9R1.8 CNCC1=CC=CC=C1 PHBB_SC-04966 [0,0,0,0,0,1|3,0,0]=4 35 B9R1.8 CNCC1=CC=CC=N1 PHBB_SC-10921 [0,0,0,0,0,1|3,0,0]=4 36 B9R1.8 COCC1=CC=CC=C1 PHBB_SC-05053 [0,0,0,0,0,1|3,0,0]=4 37 B9R1.8 ClCCC1=CC=CC=C1 PHBB_SC-03435 [0,0,0,0,0,1|2,0,0]=3 38 B9R1.8 N#CCC1=NC=CC=C1 PHBB_SC-03787 [0,0,0,0,0,1|1,0,2]=4 39 B9R1.8 NCCC1=CC=NC=C1 PHBB_SC-10402 [0,0,0,0,0,1|1,0,0]=2 40 B9R1.8 NCCC1=CCCCC1 PHBB_SC-06201 [0,0,0,0,0,1|1,0,2]=4 41 B9R1.8 NNCC1=CC=CC=C1 PHBB_SC-04682 [0,0,0,0,0,1|2,0,0]=3 42 B9R1.8 OCCC1=NC=CC=C1 PHBB_SC-11012 [0,0,0,0,0,1|2,0,0]=3 43 B6R1.2 BrC1=NC=CS1 PHBB_SC-03483 [2,0,0,0,0,0|2,0,0]=4 44 B6R1.2 CC1=CC=NN1 PHBB_SC-02795 [2,0,0,0,0,0|2,0,0]=4 45 B6R1.2 CC1=NC=CN1 PHBB_SC-04958 [2,0,0,0,0,0|2,0,0]=4 46 B6R1.2 ClC1=CC=CS1 PHBB_SC-05981 [2,0,0,0,0,0|1,0,0]=3 47 B6R1.2 NC1=CC=NN1 PHBB_SC-05676 [2,0,0,0,0,0|2,0,0]=4 48 B6R1.2 NC1=NC=CN1 PHBB_SC-06368 [2,0,0,0,0,0|2,0,0]=4 49 B6R1.2 NC1=NC=CS1 PHBB_SC-10496 [2,0,0,0,0,0|1,0,0]=3 50 B6R1.2 NC1=NN=CS1 PHBB_SC-04671 [2,0,0,0,0,0|2,0,0]=4 51 B6R1.2 NC1=NNC=C1 PHBB_SC-05975 [2,0,0,0,0,0|2,0,0]=4 52 B8R1.1 CC1=CC=C(CN)O1 PHBB_SC-08469 [1,1,0,0,0,0|0,1,0]=3 53 B8R1.1 CC1=NC(CN)=CS1 PHBB_SC-10504 [1,1,0,0,0,0|2,0,0]=4 54 B8R1.1 CCC1=NC(C)=CN1 PHBB_SC-04067 [1,1,0,0,0,0|2,0,0]=4 55 B8R1.1 O=CC1=CC=C(Br)S1 PHBB_SC-05277 [1,1,0,0,0,0|1,0,1]=4 56 B8R1.7 CC(=O)C1=CC=CN1 PHBB_SC-02946 [1,1,0,0,0,0|1,0,1]=4 57 B8R1.7 CC(C)C1=NC=CN1 PHBB_SC-04042 [1,1,0,0,0,0|2,0,0]=4 58 B8R1.7 O=C(Cl)C1=CC=CS1 PHBB_SC-04856 [1,1,0,0,0,0|1,0,1]=4 59 B8R1.11 CC1=C(C=O)SC=C1 PHBB_SC-01938 [1,1,0,0,0,0|1,0,1]=4 60 B8R1.11 NCC1=CC=CN1C PHBB_SC-09941 [1,1,0,0,0,0|1,0,0]=3 61 B10R1.1 NCCC1=CC=C(F)C=C1 PHBB_SC-04579 [0,1,0,0,0,1|1,0,0]=3 62 B10R1.1 NCCC1=CC=C(O)C=C1 PHBB_NC-02695 [0,1,0,0,0,1|1,0,0]=3 63 B10R1.10 NCCC1=CC(F)=CC=C1 PHBB_SC-05860 [0,1,0,0,0,1|1,0,0]=3 64 B10R1.15 NCC(=O)C1=CC=CC=C1 PHBB_NC-03457 [0,1,0,0,0,1|1,0,1]=4 65 B10R1.17 BrCCCC1=CC=CC=C1 PHBB_SC-08397 [0,1,0,0,0,1|2,0,0]=4 66 B10R1.17 CCCNC1=CC=CC=C1 PHBB_SC-00131 [0,1,0,0,0,1|2,0,0]=4 67 B10R1.17 CCNCC1=CC=CC=C1 PHBB_SC-05041 [0,1,0,0,0,1|2,0,0]=4 68 B10R1.17 CNCCC1=NC=CC=C1 PHBB_SC-02540 [0,1,0,0,0,1|1,0,0]=3 69 B10R1.17 NCCCC1=CC=CC=C1 PHBB_NC-02946 [0,1,0,0,0,1|1,0,0]=3 70 B10R1.17 NCCNC1=NC=CC=N1 PHBB_SC-05257 [0,1,0,0,0,1|1,0,0]=3 71 B10R1.17 NCCNC1=NC=CC=N1 PHBB_SC-10781 [0,1,0,0,0,1|1,0,0]=3 72 B10R1.17 NCCOC1=CC=CC=C1 PHBB_SC-08509 [0,1,0,0,0,1|1,0,0]=3 73 B10R1.17 NCCSC1=CC=CC=C1 PHBB_SC-09180 [0,1,0,0,0,1|1,0,0]=3 74 B10R1.17 OCCNC1=CC=CC=C1 PHBB_SC-05134 [0,1,0,0,0,1|2,0,0]=4 75 B10R1.17 OCCOC1=CC=CC=C1 PHBB_SC-01850 [0,1,0,0,0,1|2,0,0]=4 76 B10R1.18 N=C(N)CC1=CC=CC=C1 PHBB_SC-08622 [0,1,0,0,0,1|1,0,1]=4 77 B10R1.14 O=C(CCl)C1=CC=C(Cl)S1 PHBB_SC-10167 [0,2,0,0,0,0|1,0,1]=4 78 B10R1.54 CC1=CSC(CC(N)=S)=N1 PHBB_SC-03126 [0,2,0,0,0,0|1,0,1]=4 79 B10R1.130 CC1=CC(C)=NN1CCN PHBB_SC-07224 [0,2,0,0,0,0|2,0,0]=4 80 B10R1.130 CC1=CC(C)=NN1CCN PHBB_SC-11559 [0,2,0,0,0,0|2,0,0]=4 81 B10R1.21 CNCCCC1=CC=CO1 PHBB_SC-01163 [0,2,0,0,0,0|0,1,0]=3 82 B10R1.27 CCC(=O)CC1=CC=CO1 PHBB_NC-02316 [0,2,0,0,0,0|1,1,0]=4 83 B10R1.27 NCC(=O)NC1=NC=CS1 PHBB_SC-09159 [0,2,0,0,0,0|1,0,1]=4 84 B10R1.29 CNCCC1=C(C)N=CS1 PHBB_SC-06501 [0,2,0,0,0,0|1,0,0]=3 85 B10R1.66 CC(=O)CCC1=CC=CO1 PHBB_SC-01581 [0,2,0,0,0,0|1,1,0]=4 86 B10R1.66 CC(C)NCC1=CC=CO1 PHBB_SC-07699 [0,2,0,0,0,0|1,1,0]=4 87 B10R1.66 CC(N)CCC1=CC=CO1 PHBB_SC-06890 [0,2,0,0,0,0|0,1,0]=3 88 B10R1.66 O=C(O)CCC1=CC=CO1 PHBB_NC-01695 [0,2,0,0,0,0|1,1,0]=4 89 B10R1.66 O=[N+]([O-])CCC1=CC=CO1 PHBB_SC-01558 [0,2,0,0,0,0|0,1,1]=4 90 B8R1.2 NCC1=CC=CC=N1 PHBB_SC-04231 [0,0,1,1,0,0|1,0,1]=4 91 B8R1.2 NCC1=CN=CC=C1 PHBB_SC-12218 [0,0,1,1,0,0|1,0,1]=4 92 B8R1.4 NC1=CC(S)=CC=C1 PHBB_SC-03503 [0,0,1,1,0,0|0,0,2]=4 93 B10R2.6 C1=CC=C(C2CO2)C=C1 PHBB_NC-02009 [0,0,0,1,0,1|2,0,0]=4 94 B10R2.7 C1=CC=C2NCCC2=C1 PHBB_SC-00310 [0,0,0,1,0,1|1,0,0]=3