0 B12R2.44 COC1=CC2=C(C=C1)OC=C2 ACI-05786 [0,0,0,0,0,0|3,0,1]=4 1 B12R2.44 NNC1=CC2=C(C=C1)OCO2 ACI-04727 [0,0,0,0,0,0|2,0,0]=2 2 B12R2.44 O=CC1=CC2=NON=C2C=C1 RH-08H-002 [0,0,0,0,0,0|3,0,0]=3 3 B12R2.44 O=CC1=CC=C2OC=CC2=C1 ACI-05337 [0,0,0,0,0,0|1,0,1]=2 4 B12R2.44 O=CC1=CC=C2OCCC2=C1 ACI-01523 [0,0,0,0,0,0|1,0,0]=1 5 B12R2.44 O=CC1=CC=C2SC=CC2=C1 JM-04I-002 [0,0,0,0,0,0|1,1,1]=3 6 B11R2.36 NC1=CC2=C(C=C1)OC=C2 ACI-05788 [1,0,0,0,0,0|2,0,1]=4 7 B11R2.36 OC1=CC2=C(C=C1)OC=C2 ACI-05787 [1,0,0,0,0,0|1,0,2]=4 8 B13R2.430 CC(=O)C1=CC2=C(C=C1)NC=N2 ACI-02678 [0,1,0,0,0,0|2,0,1]=4 9 B13R2.430 NC(=O)C1=CC2=C(C=C1)OCO2 ACI-05425 [0,1,0,0,0,0|0,0,0]=1 10 B13R2.430 NC(=O)C1=CC2=NON=C2C=C1 ACI-05365 [0,1,0,0,0,0|3,0,0]=4 11 B13R2.430 NC(=O)C1=CC=C2OCCC2=C1 ACI-05408 [0,1,0,0,0,0|1,0,0]=2 12 B13R2.430 NC(=O)C1=CC=C2SN=NC2=C1 ACI-05382 [0,1,0,0,0,0|2,1,0]=4 13 B13R2.430 O=C(Cl)C1=CC2=C(C=C1)OCO2 ACI-02355 [0,1,0,0,0,0|0,0,0]=1 14 B13R2.430 O=C(Cl)C1=CC2=NON=C2C=C1 ACI-00363 [0,1,0,0,0,0|3,0,0]=4 15 B13R2.430 O=C(Cl)C1=CC=C2OCCC2=C1 SB-05G-003 [0,1,0,0,0,0|1,0,0]=2 16 B13R2.430 O=C(O)C1=CC2=C(C=C1)N=CS2 ACI-00355 [0,1,0,0,0,0|1,1,1]=4 17 B13R2.430 O=C(O)C1=CC2=C(C=C1)SC=C2 ACI-00138 [0,1,0,0,0,0|1,1,1]=4 18 B13R2.430 O=C(O)C1=CC=C2OC=CC2=C1 ACI-05338 [0,1,0,0,0,0|1,0,1]=3 19 B13R2.449 O=C=NC1=CC2=C(C=C1)OCO2 SB-09E-002 [0,1,0,0,0,0|0,0,1]=2 20 B13R2.2130 CN1C=CC2=C1C=CC(C=O)=C2 ACI-02305 [0,1,0,0,0,0|2,0,1]=4 21 B11R1.279 COC1=CC=C(OC)C(Cl)=C1 ACI-04697 [0,0,1,0,0,0|3,0,0]=4 22 B13R2.57 N#CC1=CC=C2OCCOC2=C1 JM-11A-001 [0,0,0,0,0,1|1,0,1]=3 23 B13R2.57 O=CC1=CC2=CC=CN=C2C=C1 ACI-05343 [0,0,0,0,0,1|2,0,1]=4 24 B13R2.57 OCC1=CC=C2OCCNC2=C1 ACI-03871 [0,0,0,0,0,1|1,0,2]=4 25 B10R1.3 C#CC1=CC=C(CO)C=C1 ACI-05708 [1,0,1,0,0,0|1,0,1]=4 26 B10R1.3 O=CC1=CC=C(CBr)C=C1 ACI-02372 [1,0,1,0,0,0|1,0,0]=3 27 B10R1.3 OCC1=CC=C(CCl)C=C1 ACI-03865 [1,0,1,0,0,0|1,0,1]=4 28 B10R1.172 C=CC1=NC=CC(OC)=C1 ACI-05094 [1,0,1,0,0,0|2,0,0]=4 29 B10R1.172 O=CC1=CC=CC(CBr)=C1 ACI-03882 [1,0,1,0,0,0|1,0,0]=3 30 B10R1.30 COC1=CC(N)=CC=C1F ACI-05283 [1,0,1,0,0,0|2,0,0]=4 31 B12R1.113 NC(=O)C1=CC=C(CCCl)C=C1 ACI-04715 [0,1,1,0,0,0|2,0,0]=4 32 B12R1.48 COC1=CC=C(C(=O)Cl)C=C1Br ACI-01757 [0,1,1,0,0,0|1,0,0]=3 33 B12R1.48 COC1=CC=C(C(N)=O)C=C1Br ACI-05402 [0,1,1,0,0,0|1,0,0]=3 34 B12R1.450 COC1=CC(O)=C(OC)C=C1Cl ACI-04696 [0,1,1,0,0,0|2,0,0]=4 35 B12R1.653 COC1=C(Cl)C(F)=C(C=O)C=C1 ACI-05534 [0,1,1,0,0,0|1,0,0]=3 36 B12R1.653 COC1=C(F)C(F)=C(C=O)C=C1 ACI-05527 [0,1,1,0,0,0|1,0,0]=3 37 B12R1.56 COC1=CC([N+](=O)[O-])=CC=C1I ACI-04693 [0,1,1,0,0,0|2,0,0]=4 38 B12R2.246 BrC1=CC(Br)=C2OCCC2=C1 RH-07B-005 [1,1,0,0,0,0|2,0,0]=4 39 B14R2.781 NC(=O)C1=CC=C2OCCOC2=C1 ACI-05419 [0,1,0,0,0,1|0,0,0]=2 40 B14R2.781 O=C(O)C1=CC=C2NCCOC2=C1 ACI-05639 [0,1,0,0,0,1|1,0,0]=3 41 B14R2.1801 CN1CCOC2=CC(C=O)=CC=C21 ACI-05341 [0,1,0,0,0,1|1,0,0]=3 42 B14R2.601 CC1=NC2=C(C=CC(C(=O)Cl)=C2)O1 ACI-02540 [0,2,0,0,0,0|1,0,1]=4 43 B14R2.601 CC1=NC2=C(C=CC(C(=O)O)=C2)O1 ACI-02538 [0,2,0,0,0,0|1,0,1]=4 44 B14R2.601 CC1=NC2=CC(C(N)=O)=CC=C2O1 ACI-05434 [0,2,0,0,0,0|1,0,1]=4 45 B14R2.601 CC1=NC2=CC=C(C(=O)Cl)C=C2O1 ACI-02542 [0,2,0,0,0,0|1,0,1]=4 46 B14R2.601 CC1=NC2=CC=C(C(=O)O)C=C2O1 ACI-02541 [0,2,0,0,0,0|1,0,1]=4 47 B14R2.601 CC1=NC2=CC=C(C(N)=O)C=C2O1 ACI-05435 [0,2,0,0,0,0|1,0,1]=4 48 B14R2.966 N\C(=N/O)C1=CC2=C(C=C1)OCO2 JM-02A-006 [0,2,0,0,0,0|0,0,1]=3 49 B14R2.5719 CN1CCC2=CC(C(=O)O)=CC=C21 JM-06K-099 [0,2,0,0,0,0|2,0,0]=4 50 B14R2.24358 CC1=COC2=CC=C(C(=O)O)C=C12 ACI-05330 [0,2,0,0,0,0|1,0,1]=4 51 B14R2.3304 N#CC1=CC2=CC(C=O)=CC=C2O1 ACI-04993 [0,2,0,0,0,0|1,0,1]=4 52 B12R2.24 OC1=CC=C2OCCNC2=C1 JM-08B-001 [1,0,0,0,0,1|1,0,1]=4