0 B12R2.252 NC(=O)C1=CC2=C(C=CS2)N1 ACI-05355 [0,0,0,0,0,0|1,0,0]=1 1 B12R2.252 O=C(O)C1=CC2=C(C=CO2)N1 ACI-NI-00500 [0,0,0,0,0,0|0,1,0]=1 2 B12R2.252 O=C(O)C1=CC2=C(C=CS2)S1 ACI-01264 [0,0,0,0,0,0|1,0,0]=1 3 B11R2.15 O=CC1=CC2=C(C=CS2)S1 ACI-02013 [1,0,0,0,0,0|1,0,0]=2 4 B11R2.15 O=CC1=CN2C=CSC2=N1 SB-11C-001 [1,0,0,0,0,0|3,0,0]=4 5 B11R2.15 OCC1=CC2=C(C=CS2)S1 ACI-02014 [1,0,0,0,0,0|1,0,1]=3 6 B13R2.531 COC(=O)C1=CC2=C(C=CO2)N1 ACI-NI-00499 [0,1,0,0,0,0|0,1,0]=2 7 B13R2.531 COC(=O)C1=CC2=C(N1)OC=C2 ACI-NI-00497 [0,1,0,0,0,0|2,0,0]=3 8 B13R2.531 COC(=O)C1=CC2=C(N1)SC=C2 JM-08G-002 [0,1,0,0,0,0|2,0,0]=3 9 B13R2.531 NNC(=O)C1=CC2=C(C=CS2)N1 RH-04C-001 [0,1,0,0,0,0|1,0,0]=2 10 B13R2.2334 CN1C(C(=O)O)=CC2=C1C=CO2 JM-10L-003 [0,1,0,0,0,0|0,1,0]=2 11 B11R1.48 CC1=C(C=O)SC(C(=O)O)=C1 ACI-06397 [0,0,1,0,0,0|3,0,0]=4 12 B13R2.430 O=C(O)C1=CC2=C(C=C1)N=CS2 ACI-00355 [0,0,0,0,0,1|2,0,0]=3 13 B13R2.430 O=C(O)C1=CC2=C(C=C1)SC=C2 ACI-00138 [0,0,0,0,0,1|1,0,0]=2 14 B13R2.430 O=C(O)C1=CC2=C(C=N1)SC=C2 ACI-05332 [0,0,0,0,0,1|1,0,0]=2 15 B13R2.430 O=C(O)C1=CC=C2OC=CC2=C1 ACI-05338 [0,0,0,0,0,1|1,1,0]=3 16 B13R2.435 CC(=O)C1=CC2=C(C=CC=C2)S1 ACI-01505 [0,0,0,0,0,1|3,0,0]=4 17 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)S1 ACI-00957 [0,0,0,0,0,1|2,0,0]=3 18 B13R2.435 O=C(O)C1=CC2=C(N=CC=C2)S1 ACI-02074 [0,0,0,0,0,1|2,0,0]=3 19 B13R2.435 O=C(O)C1=CC2=NC=CN=C2S1 SB-04C-010 [0,0,0,0,0,1|2,0,0]=3 20 B13R2.435 O=C(O)C1=CN2C=CC=CC2=N1 ACI-04808 [0,0,0,0,0,1|2,0,1]=4 21 B13R2.435 O=C(O)C1=CN2C=CN=CC2=N1 ACI-02236 [0,0,0,0,0,1|2,0,1]=4 22 B10R1.66 CC(=O)\C=C\C1=CSC=C1 RH-05D-001 [1,0,1,0,0,0|2,0,0]=4 23 B14R2.601 NC1=NC2=C(C=C(C(=O)O)C=C2)S1 ACI-00487 [0,1,0,0,0,1|2,0,0]=4 24 B14R2.601 NC1=NC2=C(C=C(C(=O)O)C=C2)S1 ACI-NI-00302 [0,1,0,0,0,1|2,0,0]=4 25 B14R2.966 COC(=O)C1=CC2=C(C=CS2)C=N1 JL-14L-002 [0,1,0,0,0,1|0,0,1]=3 26 B14R2.966 COC(=O)C1=CC2=C(C=N1)SC=C2 ACI-05331 [0,1,0,0,0,1|1,0,0]=3 27 B14R2.5719 CN1C=CC2=C1C=CC(C(=O)O)=C2 ACI-02304 [0,1,0,0,0,1|2,0,0]=4 28 B14R2.24358 CC1=COC2=CC=C(C(=O)O)C=C12 ACI-05330 [0,1,0,0,0,1|1,1,0]=4 29 B14R2.450 CN1C(C(=O)O)=CC2=C1C=CC=C2 FD-09F-001 [0,1,0,0,0,1|1,0,0]=3 30 B14R2.450 O=C(O)C1=C(Cl)C2=C(C=CC=C2)S1 ACI-02696 [0,1,0,0,0,1|2,0,0]=4 31 B14R2.450 O=C(O)C1=C(O)C2=CC=CC=C2S1 ACI-04216 [0,1,0,0,0,1|2,0,0]=4 32 B14R2.450 O=C(O)C1=C(O)C2=CC=CN=C2S1 ACI-05942 [0,1,0,0,0,1|2,0,0]=4 33 B14R2.972 COC(=O)C1=CC2=C(N=CC=C2)S1 ACI-02073 [0,1,0,0,0,1|2,0,0]=4 34 B14R2.972 COC(=O)C1=CC2=CC=CC=C2N1 ACI-02184 [0,1,0,0,0,1|1,0,0]=3 35 B14R2.4529 CC1=CC2=C(C=C1)SC(C(=O)O)=C2 ACI-02071 [0,1,0,0,0,1|2,0,0]=4 36 B14R2.4529 CC1=CC=C2C=C(C(=O)O)NC2=C1 ACI-NI-00494 [0,1,0,0,0,1|1,0,0]=3 37 B14R2.4529 CC1=CC=C2OC(C(=O)O)=CC2=C1 ACI-04989 [0,1,0,0,0,1|2,0,0]=4 38 B14R2.4529 O=C(O)C1=CC2=C(C=C(Br)C=C2)S1 ACI-01066 [0,1,0,0,0,1|2,0,0]=4 39 B14R2.4529 O=C(O)C1=CC2=C(C=C(F)C=C2)S1 ACI-02070 [0,1,0,0,0,1|2,0,0]=4 40 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Br)=C2)S1 ACI-01070 [0,1,0,0,0,1|2,0,0]=4 41 B14R2.4529 O=C(O)C1=CC2=C(C=CC(F)=C2)S1 ACI-02094 [0,1,0,0,0,1|2,0,0]=4 42 B14R2.4529 O=C(O)C1=CC2=CC(Cl)=CC=C2S1 ACI-05318 [0,1,0,0,0,1|2,0,0]=4 43 B14R2.4529 OC(=O)C1=CC2=CC=C(Cl)C=C2S1 ACI-05316 [0,1,0,0,0,1|2,0,0]=4 44 B14R2.7969 CC1=C2C=C(C(=O)O)NC2=CC=C1 ACI-NI-00496 [0,1,0,0,0,1|1,0,0]=3 45 B14R2.7969 O=C(O)C1=CC2=C(C=CC=C2Cl)S1 ACI-01078 [0,1,0,0,0,1|2,0,0]=4 46 B14R2.7969 O=C(O)C1=CC2=C(F)C=CC=C2S1 RH-06B-002 [0,1,0,0,0,1|2,0,0]=4 47 B14R2.7969 O=C(O)C1=CC2=C(S1)C(Br)=CC=C2 ACI-02088 [0,1,0,0,0,1|2,0,0]=4 48 B14R2.7969 O=C(O)C1=CC2=C(S1)C(Cl)=CC=C2 ACI-02092 [0,1,0,0,0,1|2,0,0]=4 49 B14R2.7969 O=C(O)C1=CC2=C(S1)C(F)=CC=C2 ACI-02093 [0,1,0,0,0,1|2,0,0]=4 50 B14R2.839 CCOC(=O)C1=CC2=C(C=CS2)S1 ACI-01263 [0,2,0,0,0,0|1,0,0]=3 51 B14R2.970 COC(=O)C1=CC2=C(C=CO2)N1C JM-11A-002 [0,2,0,0,0,0|0,1,0]=3 52 B12R1.43 O=C(O)\C(O)=C\C1=CC=CC=C1 ACI-03857 [0,0,1,0,0,1|2,0,0]=4 53 B12R1.125 CC1=CC=CC=C1\C=C\C(=O)O ACI-05912 [0,0,1,0,0,1|2,0,0]=4 54 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1F ACI-05913 [0,0,1,0,0,1|2,0,0]=4 55 B12R1.226 CC1=CC(\C=C\C(=O)O)=CC=C1 ACI-05911 [0,0,1,0,0,1|2,0,0]=4 56 B12R1.226 O=C(O)\C=C\C1=CC=CC(Cl)=C1 ACI-05908 [0,0,1,0,0,1|2,0,0]=4 57 B12R1.226 O=C(O)\C=C\C1=CC=CC(F)=C1 ACI-05914 [0,0,1,0,0,1|2,0,0]=4 58 B12R2.32 O=CC1=CC2=C(C=CC=C2)N1 ACI-02595 [1,0,0,0,0,1|1,0,0]=3 59 B12R2.32 O=CC1=CC2=C(C=CC=C2)O1 ACI-00894 [1,0,0,0,0,1|2,0,0]=4 60 B12R2.32 O=CC1=CC2=C(C=CC=C2)S1 ACI-00958 [1,0,0,0,0,1|2,0,0]=4 61 B12R2.32 O=CC1=CC2=C(N=CC=C2)S1 ACI-02151 [1,0,0,0,0,1|2,0,0]=4 62 B12R2.32 OCC1=CC2=C(C=CC=C2)N1 ACI-02594 [1,0,0,0,0,1|1,0,1]=4 63 B12R2.44 O=CC1=CC=C2OC=CC2=C1 ACI-05337 [1,0,0,0,0,1|1,1,0]=4 64 B12R2.44 O=CC1=CC=C2SC=CC2=C1 JM-04I-002 [1,0,0,0,0,1|1,0,0]=3 65 B12R2.44 OCC1=CC=C2SC=CC2=C1 ACI-04962 [1,0,0,0,0,1|1,0,1]=4 66 B14R2.781 O=C(O)C1=CC2=CC=CC=C2OC1 JM-05I-005 [0,0,0,0,0,2|2,0,0]=4 67 B14R2.781 O=C(O)C1=CC=C2N=CC=NC2=C1 WS-04C-005 [0,0,0,0,0,2|2,0,0]=4 68 B14R2.781 O=C(O)C1=NC2=C(C=CC=C2)N=C1 WS-04K-006 [0,0,0,0,0,2|1,0,1]=4