0 B12R2.252 NC(=O)C1=CC2=C(C=CS2)N1 ACI-05355 [0,0,0,0,0,0|2,0,0]=2 1 B12R2.252 O=C(O)C1=CC2=C(C=CO2)N1 ACI-NI-00500 [0,0,0,0,0,0|1,1,0]=2 2 B12R2.252 O=C(O)C1=CC2=C(C=CS2)S1 ACI-01264 [0,0,0,0,0,0|2,0,0]=2 3 B11R2.15 O=CC1=CC2=C(C=CS2)S1 ACI-02013 [1,0,0,0,0,0|2,0,0]=3 4 B11R2.15 OCC1=CC2=C(C=CS2)S1 ACI-02014 [1,0,0,0,0,0|2,0,1]=4 5 B13R2.531 COC(=O)C1=CC2=C(C=CO2)N1 ACI-NI-00499 [0,1,0,0,0,0|1,1,0]=3 6 B13R2.531 COC(=O)C1=CC2=C(N1)OC=C2 ACI-NI-00497 [0,1,0,0,0,0|2,0,0]=3 7 B13R2.531 COC(=O)C1=CC2=C(N1)SC=C2 JM-08G-002 [0,1,0,0,0,0|2,0,0]=3 8 B13R2.531 NNC(=O)C1=CC2=C(C=CS2)N1 RH-04C-001 [0,1,0,0,0,0|2,0,0]=3 9 B13R2.2334 CN1C(C(=O)O)=CC2=C1C=CO2 JM-10L-003 [0,1,0,0,0,0|1,1,0]=3 10 B13R2.430 CC(=O)C1=CC2=C(C=C1)NC=N2 ACI-02678 [0,0,0,0,0,1|3,0,0]=4 11 B13R2.430 NC(=O)C1=CC=C2SN=NC2=C1 ACI-05382 [0,0,0,0,0,1|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|1,0,0]=2 13 B13R2.430 O=C(O)C1=CC2=C(C=C1)SC=C2 ACI-00138 [0,0,0,0,0,1|2,0,0]=3 14 B13R2.430 O=C(O)C1=CC2=C(C=N1)SC=C2 ACI-05332 [0,0,0,0,0,1|2,0,0]=3 15 B13R2.430 O=C(O)C1=CC=C2OC=CC2=C1 ACI-05338 [0,0,0,0,0,1|2,1,0]=4 16 B13R2.430 O=[N+]([O-])C1=CC2=C(C=C1)SC=N2 ACI-00633 [0,0,0,0,0,1|2,0,1]=4 17 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)S1 ACI-00957 [0,0,0,0,0,1|3,0,0]=4 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=CN=CC2=N1 ACI-02236 [0,0,0,0,0,1|2,0,1]=4 21 B14R2.601 CC1=NC2=C(C=CC(C(=O)O)=C2)O1 ACI-02538 [0,1,0,0,0,1|1,1,0]=4 22 B14R2.601 CC1=NC2=CC=C(C(=O)O)C=C2O1 ACI-02541 [0,1,0,0,0,1|1,1,0]=4 23 B14R2.601 NC1=NC2=C(C=C(C(=O)Cl)C=C2)S1 ACI-00491 [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-00487 [0,1,0,0,0,1|1,0,0]=3 25 B14R2.601 NC1=NC2=C(C=C(C(=O)O)C=C2)S1 ACI-NI-00302 [0,1,0,0,0,1|1,0,0]=3 26 B14R2.966 COC(=O)C1=CC2=C(C=C1)NC=N2 SB-09E-001 [0,1,0,0,0,1|2,0,0]=4 27 B14R2.966 COC(=O)C1=CC2=C(C=CS2)C=N1 JL-14L-002 [0,1,0,0,0,1|1,0,1]=4 28 B14R2.966 COC(=O)C1=CC2=C(C=N1)SC=C2 ACI-05331 [0,1,0,0,0,1|2,0,0]=4 29 B14R2.450 CN1C(C(=O)O)=CC2=C1C=CC=C2 FD-09F-001 [0,1,0,0,0,1|2,0,0]=4 30 B14R2.450 O=C(O)C1=C(O)C2=CC=CN=C2S1 ACI-05942 [0,1,0,0,0,1|2,0,0]=4 31 B14R2.972 COC(=O)C1=CC2=C(N=CC=C2)S1 ACI-02073 [0,1,0,0,0,1|2,0,0]=4 32 B14R2.972 COC(=O)C1=CC2=CC=CC=C2N1 ACI-02184 [0,1,0,0,0,1|2,0,0]=4 33 B14R2.4529 CC1=CC=C2C=C(C(=O)O)NC2=C1 ACI-NI-00494 [0,1,0,0,0,1|2,0,0]=4 34 B14R2.7969 CC1=C2C=C(C(=O)O)NC2=CC=C1 ACI-NI-00496 [0,1,0,0,0,1|2,0,0]=4 35 B14R2.839 CCOC(=O)C1=CC2=C(C=CS2)S1 ACI-01263 [0,2,0,0,0,0|2,0,0]=4 36 B14R2.970 COC(=O)C1=CC2=C(C=CO2)N1C JM-11A-002 [0,2,0,0,0,0|1,1,0]=4 37 B12R2.32 O=CC1=CC2=C(C=CC=C2)N1 ACI-02595 [1,0,0,0,0,1|2,0,0]=4 38 B12R2.32 O=CC1=CC2=C(N=CC=C2)S1 ACI-02151 [1,0,0,0,0,1|2,0,0]=4 39 B12R2.44 O=CC1=CC=C2SC=CC2=C1 JM-04I-002 [1,0,0,0,0,1|2,0,0]=4 40 B14R2.781 O=C(O)C1=CC=C2N=CC=NC2=C1 WS-04C-005 [0,0,0,0,0,2|2,0,0]=4