0 B12R1.16 CCOC(=O)C1=CC=C(Cl)C=C1 PHBB_SC-05019 [0,0,0,0,0,0|1,0,0]=1 1 B12R1.16 CCOC(=O)C1=CC=C(N)C=C1 PHBB_SC-00122 [0,0,0,0,0,0|0,0,0]=0 2 B12R1.16 CCOC(=O)C1=CC=C(O)C=C1 PHBB_SC-05126 [0,0,0,0,0,0|1,0,0]=1 3 B11R1.1 CCCCC1=CC=C(N)C=C1 PHBB_SC-05042 [1,0,0,0,0,0|1,0,1]=3 4 B11R1.1 CCCOC1=CC=C(O)C=C1 PHBB_SC-04680 [1,0,0,0,0,0|3,0,0]=4 5 B11R1.1 NC1=CC=C(OCCO)C=C1 PHBB_SC-05653 [1,0,0,0,0,0|3,0,0]=4 6 B11R1.16 CCCC(=O)C1=CC=CC=C1 PHBB_SC-08436 [1,0,0,0,0,0|1,0,0]=2 7 B11R1.16 CCOC(=O)C1=CC=CC=C1 PHBB_SC-05056 [1,0,0,0,0,0|0,0,0]=1 8 B11R1.16 CCOC(=O)C1=CC=NC=C1 PHBB_SC-04699 [1,0,0,0,0,0|1,0,0]=2 9 B11R1.16 N#CCC(=O)C1=CC=CC=C1 PHBB_SC-08028 [1,0,0,0,0,0|2,0,1]=4 10 B11R1.22 CCC(=O)C1=CC=C(C)C=C1 PHBB_SC-04986 [1,0,0,0,0,0|1,0,0]=2 11 B11R1.22 CCC(=O)C1=CC=C(O)C=C1 PHBB_SC-04969 [1,0,0,0,0,0|1,0,0]=2 12 B11R1.22 CNC(=O)C1=CC=C(N)C=C1 PHBB_SC-05325 [1,0,0,0,0,0|1,0,0]=2 13 B11R1.22 COC(=O)C1=CC=C(O)C=C1 PHBB_NC-03306 [1,0,0,0,0,0|1,0,0]=2 14 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 PHBB_SC-11162 [1,0,0,0,0,0|2,0,0]=3 15 B11R1.22 NNC(=O)C1=CC=C(Br)C=C1 PHBB_SC-06624 [1,0,0,0,0,0|3,0,0]=4 16 B11R1.22 NNC(=O)C1=CC=C(O)C=C1 PHBB_SC-04458 [1,0,0,0,0,0|3,0,0]=4 17 B11R1.22 O=C(CCl)C1=CC=C(F)C=C1 PHBB_SC-08439 [1,0,0,0,0,0|2,0,0]=3 18 B13R1.17 CCCOC(=O)C1=CC=C(O)C=C1 PHBB_SC-08442 [0,1,0,0,0,0|1,0,0]=2 19 B13R1.17 NC1=CC=C(C(=O)NCCO)C=C1 PHBB_SC-05726 [0,1,0,0,0,0|1,0,0]=2 20 B13R1.17 O=C(CCCCl)C1=CC=C(Cl)C=C1 PHBB_SC-08532 [0,1,0,0,0,0|2,0,0]=3 21 B13R1.17 O=C(CCCCl)C1=CC=C(F)C=C1 PHBB_SC-05138 [0,1,0,0,0,0|2,0,0]=3 22 B13R1.132 CC(C)NC(=O)C1=CC=C(N)C=C1 PHBB_SC-08561 [0,1,0,0,0,0|1,0,0]=2 23 B13R1.132 CC(C)OC(=O)C1=CC=C(N)C=C1 PHBB_SC-06916 [0,1,0,0,0,0|0,0,0]=1 24 B13R1.1511 CCOC(=O)C1=C(N)NC(=O)N=C1 PHBB_SC-10687 [0,1,0,0,0,0|3,0,0]=4 25 B13R2.12 NC1=CC=C(N2CCCC2)C=C1 PHBB_SC-09302 [0,0,0,1,0,0|3,0,0]=4 26 B13R2.5179 CC1=CC=C2C(=O)CCCC2=N1 PHBB_SC-10317 [0,0,0,1,0,0|3,0,0]=4 27 B13R2.5187 NC1=CC2=C(C=C1)C(=O)NC2=O PHBB_SC-00176 [0,0,0,1,0,0|2,0,1]=4 28 B13R2.5187 O=C1OC(=O)C2=C1C=CC(Cl)=C2 PHBB_SC-08357 [0,0,0,1,0,0|2,0,1]=4 29 B11R1.15 CCOC(=O)C1=CC(C)=NN1 PHBB_SC-02572 [0,0,0,0,1,0|3,0,0]=4 30 B11R1.15 CCOC(=O)C1=CC(C)=NO1 PHBB_SC-09465 [0,0,0,0,1,0|3,0,0]=4 31 B11R1.15 CCOC(=O)C1=NOC(C)=C1 PHBB_SC-09403 [0,0,0,0,1,0|3,0,0]=4 32 B13R1.19 COCC(=O)NC1=CC=C(N)C=C1 PHBB_SC-10072 [0,0,0,0,0,1|2,0,0]=3 33 B13R1.19 NCCC(=O)NC1=CC=C(Br)C=C1 PHBB_SC-05824 [0,0,0,0,0,1|3,0,0]=4 34 B13R1.19 NCCC(=O)NC1=CC=C(Cl)C=C1 PHBB_SC-05780 [0,0,0,0,0,1|3,0,0]=4 35 B10R1.17 CCCNC1=CC=CC=C1 PHBB_SC-00131 [2,0,0,0,0,0|2,0,0]=4 36 B10R1.17 CCNCC1=CC=CC=C1 PHBB_SC-05041 [2,0,0,0,0,0|1,0,1]=4 37 B10R1.17 ClC\C=C\C1=CC=CC=C1 PHBB_SC-04918 [2,0,0,0,0,0|2,0,0]=4 38 B10R1.17 OC\C=C\C1=CC=CC=C1 PHBB_NC-01992 [2,0,0,0,0,0|2,0,0]=4 39 B10R1.15 CCC(=O)C1=CC=CC=C1 PHBB_SC-08413 [2,0,0,0,0,0|0,0,0]=2 40 B10R1.15 COC(=O)C1=CC=CC=C1 PHBB_SC-05154 [2,0,0,0,0,0|0,0,0]=2 41 B10R1.15 COC(=O)C1=CN=CC=C1 PHBB_SC-04459 [2,0,0,0,0,0|1,0,0]=3 42 B10R1.15 NCC(=O)C1=CC=CC=C1 PHBB_NC-03457 [2,0,0,0,0,0|1,0,0]=3 43 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 PHBB_SC-04795 [2,0,0,0,0,0|1,0,0]=3 44 B10R1.13 CC(=O)C1=CC=C(C)C=C1 PHBB_SC-04777 [2,0,0,0,0,0|1,0,0]=3 45 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 PHBB_SC-04839 [2,0,0,0,0,0|1,0,0]=3 46 B10R1.13 CC(=O)C1=CC=C(I)C=C1 PHBB_SC-05920 [2,0,0,0,0,0|1,0,0]=3 47 B10R1.13 CC(=O)C1=CC=C(N)C=C1 PHBB_SC-10498 [2,0,0,0,0,0|0,0,0]=2 48 B10R1.13 CC(=O)C1=CC=C(O)C=C1 PHBB_SC-04830 [2,0,0,0,0,0|1,0,0]=3 49 B10R1.13 CC(C)C1=CC=C(N)C=C1 PHBB_SC-11814 [2,0,0,0,0,0|1,0,1]=4 50 B10R1.13 CC1=CC=C(C(=O)Cl)C=C1 PHBB_SC-08420 [2,0,0,0,0,0|2,0,0]=4 51 B10R1.13 N=C(N)C1=CC=C(N)C=C1 PHBB_SC-05554 [2,0,0,0,0,0|2,0,0]=4 52 B10R1.13 NC(=O)C1=CC=C(N)C=C1 PHBB_SC-03765 [2,0,0,0,0,0|1,0,0]=3 53 B10R1.13 NC1=CC=C(C(=O)O)C=N1 PHBB_SC-07843 [2,0,0,0,0,0|1,0,0]=3 54 B10R1.13 O=C(Cl)C1=CC=C(Cl)C=C1 PHBB_SC-04840 [2,0,0,0,0,0|2,0,0]=4 55 B10R1.13 O=C(O)C1=CC=C(F)C=C1 PHBB_SC-04695 [2,0,0,0,0,0|1,0,0]=3 56 B10R1.13 O=C(O)C1=CC=C(O)C=C1 PHBB_NC-02033 [2,0,0,0,0,0|1,0,0]=3 57 B10R1.13 O=C(O)C1=CN=C(Cl)C=C1 PHBB_SC-03319 [2,0,0,0,0,0|2,0,0]=4 58 B10R1.13 O=C1C=CC(C(=O)O)=CN1 PHBB_NC-02879 [2,0,0,0,0,0|2,0,0]=4 59 B10R1.13 O=C1C=CC(C(=O)O)=CO1 PHBB_NC-01962 [2,0,0,0,0,0|2,0,0]=4 60 B12R1.1 CCCCOC1=CC=C(N)C=C1 PHBB_SC-08371 [1,1,0,0,0,0|1,0,1]=4 61 B12R1.1 NCCOCC1=CC=C(Br)C=C1 PHBB_SC-12264 [1,1,0,0,0,0|1,0,1]=4 62 B12R1.21 CC(C)COC1=CC=C(N)C=C1 PHBB_SC-09971 [1,1,0,0,0,0|2,0,0]=4 63 B12R1.30 CCCCC(=O)C1=CC=CC=C1 PHBB_SC-05040 [1,1,0,0,0,0|1,0,0]=3 64 B12R1.30 NCCNC(=O)C1=CC=NC=C1 PHBB_SC-03280 [1,1,0,0,0,0|2,0,0]=4 65 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 PHBB_SC-01239 [1,1,0,0,0,0|1,0,1]=4 66 B12R1.308 CCOC(=O)C1=CC=CC=C1N PHBB_SC-05196 [1,1,0,0,0,0|0,0,0]=2 67 B12R1.5 COC(=O)C1=CC=C(C=O)C=C1 PHBB_SC-04667 [1,1,0,0,0,0|1,0,0]=3 68 B12R1.5 COC1=CC=C(C(=O)CBr)C=C1 PHBB_SC-01091 [1,1,0,0,0,0|2,0,0]=4 69 B12R1.5 COC1=CC=C(C(=O)CN)C=C1 PHBB_NC-03464 [1,1,0,0,0,0|2,0,0]=4 70 B12R1.12 CCN(CC)C1=CC=C(N)C=C1 PHBB_SC-05033 [1,1,0,0,0,0|2,0,0]=4 71 B12R1.367 CNC(=O)C1=CC(N)=C(F)C=C1 PHBB_SC-10607 [1,1,0,0,0,0|2,0,0]=4 72 B12R1.367 COC(=O)C1=CC(Cl)=C(Cl)N=C1 PHBB_SC-05268 [1,1,0,0,0,0|2,0,0]=4 73 B12R1.367 COC(=O)C1=CC(N)=C(F)C=C1 PHBB_SC-09966 [1,1,0,0,0,0|1,0,0]=3 74 B12R1.367 COC(=O)C1=CC(N)=C(N)C=C1 PHBB_SC-03482 [1,1,0,0,0,0|0,0,0]=2 75 B12R1.367 O=C(CCl)C1=CC(O)=C(O)C=C1 PHBB_SC-01825 [1,1,0,0,0,0|2,0,0]=4 76 B12R1.1703 CNC(=O)C1=C(Cl)C=C(N)C=C1 PHBB_SC-05388 [1,1,0,0,0,0|1,0,0]=3 77 B12R1.1703 O=C(CCl)C1=C(Cl)C=C(Cl)C=C1 PHBB_SC-07951 [1,1,0,0,0,0|2,0,0]=4 78 B12R1.1703 O=C(CCl)C1=CC=C(O)C=C1O PHBB_SC-04285 [1,1,0,0,0,0|2,0,0]=4 79 B12R1.313 CCOC(=O)C1=C(C)SC(N)=N1 PHBB_SC-04592 [0,1,0,0,1,0|2,0,0]=4 80 B12R1.313 CCOC(=O)N1OC(N)=CC1=O PHBB_SC-11820 [0,1,0,0,1,0|2,0,0]=4 81 B14R1.698 CN(C)CC(=O)NC1=CC=C(N)C=C1 PHBB_SC-05316 [0,1,0,0,0,1|2,0,0]=4 82 B14R1.967 COCC(=O)NC1=CC=C(N)C(Cl)=C1 PHBB_SC-11389 [0,1,0,0,0,1|2,0,0]=4 83 B14R1.6823 COCC(=O)NC1=C(Cl)C=C(N)C=C1 PHBB_SC-09023 [0,1,0,0,0,1|2,0,0]=4 84 B14R1.678 CC(C)COC(=O)C1=CC=C(N)C=C1 PHBB_SC-05471 [0,2,0,0,0,0|0,0,0]=2 85 B14R1.678 NC1=CC=C(C(=O)NCC(=O)O)C=C1 PHBB_NC-00326 [0,2,0,0,0,0|1,0,1]=4 86 B14R1.941 NC1=CC(C(=O)NCCO)=CC=C1Cl PHBB_SC-05543 [0,2,0,0,0,0|2,0,0]=4 87 B14R1.2523 NC1=CC(Cl)=C(C(=O)NCCO)C=C1 PHBB_SC-05955 [0,2,0,0,0,0|1,0,0]=3 88 B14R1.6048 CC(C)NC(=O)C1=C(Cl)C=C(N)C=C1 PHBB_SC-08815 [0,2,0,0,0,0|1,0,0]=3 89 B14R1.6048 CC(C)OC(=O)C1=C(Cl)C=C(N)C=C1 PHBB_SC-09970 [0,2,0,0,0,0|0,0,0]=2 90 B14R1.18811 CCOC(=O)C1=C(C)OC(=O)C=C1C PHBB_NC-00458 [0,2,0,0,0,0|2,0,0]=4 91 B12R2.2 C1=CC=C(C2=NCCN2)C=C1 PHBB_SC-03985 [1,0,0,1,0,0|2,0,0]=4 92 B12R2.1081 O=C1CCCC2=C1C=CC=C2 PHBB_SC-00363 [1,0,0,1,0,0|1,0,0]=3 93 B12R2.1081 O=C1CCOC2=C1C=CC=C2 PHBB_NC-02285 [1,0,0,1,0,0|2,0,0]=4 94 B12R2.2075 O=C(C1=CC=CC=C1)C2CC2 PHBB_SC-07923 [1,0,0,1,0,0|1,0,0]=3 95 B12R2.612 NC1=CC2=C(C=C1)C(=O)OC2 PHBB_SC-10574 [1,0,0,1,0,0|0,0,0]=2 96 B12R2.612 O=C1COC2=CC(O)=CC=C12 PHBB_NC-01859 [1,0,0,1,0,0|2,0,0]=4 97 B14R2.926 NC1=CC=C(N2CCCC2=O)C=C1 PHBB_SC-06329 [0,0,0,1,0,1|1,0,0]=3 98 B14R2.20 CC1=NN=C(C2=CC=C(N)C=C2)O1 PHBB_SC-05641 [0,1,0,1,0,0|1,0,1]=4 99 B14R2.933 NC1=CC=C(C(=O)NC2CC2)C=C1 PHBB_SC-08827 [0,1,0,1,0,0|1,0,0]=3 100 B14R2.1801 COC1=CC2=C(C=C1)C(=O)CCC2 PHBB_NC-02283 [0,1,0,1,0,0|2,0,0]=4 101 B10R1.11 CCOC(=O)C1=CC=NN1 PHBB_SC-02571 [1,0,0,0,1,0|2,0,0]=4 102 B12R1.32 CCOC(=O)NC1=CC=CC=C1 PHBB_SC-04821 [1,0,0,0,0,1|0,0,0]=2 103 B12R1.32 NCCC(=O)NC1=CC=CC=C1 PHBB_SC-08941 [1,0,0,0,0,1|2,0,0]=4