0 B12R1.4 O=C(O)CC1=CC=C(C#N)C=C1 BCP15472 [0,0,0,0,0,0|3,0,0]=3 1 B11R1.20 CC(NC1=CC=C(O)C=C1)=O BCP23431 [1,0,0,0,0,0|1,0,0]=2 2 B11R1.20 O=C(O)CC1=NC=C(C)C=C1 BCP18597 [1,0,0,0,0,0|2,0,0]=3 3 B11R1.83 NNCC1=CC=C(OC)C=C1 BCP02652 [1,0,0,0,0,0|2,0,0]=3 4 B11R1.83 NNCC1=CC=C(OC)C=C1 BCP10292 [1,0,0,0,0,0|2,0,0]=3 5 B11R1.83 NOCC1=CC=C(OC)C=C1 BCP19988 [1,0,0,0,0,0|2,0,0]=3 6 B13R1.36 CC(C1=CC=C(CBr)C=C1)C(O)=O BCP12222 [0,1,0,0,0,0|3,0,0]=4 7 B13R1.36 O=C(O)C(N)C1=CC=C(OC)C=C1 BCP23688 [0,1,0,0,0,0|1,0,0]=2 8 B13R1.142 CC(NC1=CC=C(OCC)C=C1)=O BCP09084 [0,1,0,0,0,0|1,0,0]=2 9 B13R1.585 O=C(NC1=CC=C(B(O)O)C=C1)C BCP16827 [0,1,0,0,0,0|3,0,0]=4 10 B13R2.2121 BrC=1SC2=CC(=CC=C2N1)OC BCP19004 [0,0,0,1,0,0|2,1,0]=4 11 B13R2.2121 COC1=CC=2NC(NC2C=C1)=S BCP04509 [0,0,0,1,0,0|2,1,0]=4 12 B11R1.3 CC(C1=CC=C(CBr)C=C1)=O BCP08093 [0,0,0,0,1,0|2,0,0]=3 13 B11R1.3 CC(C1=CC=C(SC)C=C1)=O BCP20233 [0,0,0,0,1,0|0,1,0]=2 14 B11R1.3 CNC1=CC=C([N+]([O-])=O)C=C1 BCP04516 [0,0,0,0,1,0|3,0,0]=4 15 B11R1.3 N[C](C)C1=CC=C(OC)C=C1 BCP12189 [0,0,0,0,1,0|1,0,1]=3 16 B11R1.3 OB(C1=CC=C(OC)C=C1)O BCP03522 [0,0,0,0,1,0|2,0,1]=4 17 B11R1.3 OC(C1=CC=C(C#C)C=C1)=O BCP20454 [0,0,0,0,1,0|2,0,1]=4 18 B13R1.3 O=C(O)CNC1=CC=C(C#N)C=C1 BCP04527 [0,0,0,0,0,1|3,0,0]=4 19 B10R1.18 C1=NC=CC=C1CC(O)=O BCP20278 [2,0,0,0,0,0|2,0,0]=4 20 B10R1.18 CC(=O)Cc1ccncc1 BCP13413 [2,0,0,0,0,0|1,0,0]=3 21 B10R1.18 CC(NC1=CC=CC=C1)=O BCP02363 [2,0,0,0,0,0|1,0,0]=3 22 B10R1.18 NC(CC1=CC=CC=C1)=O BCP10408 [2,0,0,0,0,0|1,0,0]=3 23 B10R1.18 O=C(Cl)OC1=CC=CC=C1 BCP14449 [2,0,0,0,0,0|2,0,0]=4 24 B10R1.18 OC(=O)Cc1ccncc1 BCP05255 [2,0,0,0,0,0|2,0,0]=4 25 B10R1.3 NCC1=CC=C(OC)C=C1 BCP11229 [2,0,0,0,0,0|1,0,0]=3 26 B10R1.3 OCC1=CC=C(C=O)C=C1 BCP07175 [2,0,0,0,0,0|2,0,0]=4 27 B12R1.19 C1=C(C=CC(=C1Cl)O)NC(C)=O BCP20088 [1,1,0,0,0,0|1,0,0]=3 28 B12R1.19 OC1=CC(CC(C)=O)=CC=C1O BCP28119 [1,1,0,0,0,0|0,0,0]=2 29 B12R1.20 O=C(O)C(Br)C1=CC=C(Cl)C=C1 BCP05934 [1,1,0,0,0,0|2,0,0]=4 30 B12R1.49 BrC1=CC=C(CC(OC)=O)C=C1 BCP16335 [1,1,0,0,0,0|1,0,0]=3 31 B12R1.49 O=C(CC)NC1=CC=C(O)C=C1 BCP10463 [1,1,0,0,0,0|1,0,0]=3 32 B12R1.49 O=C(CCl)NC1=CC=C(Cl)C=C1 BCP08999 [1,1,0,0,0,0|2,0,0]=4 33 B12R1.49 O=C(OC)CC1=CC=C(Cl)C=C1 BCP11098 [1,1,0,0,0,0|1,0,0]=3 34 B12R1.5 CCC(C1=CC=C(OC)C=C1)=O BCP14923 [1,1,0,0,0,0|0,0,2]=4 35 B12R1.5 COC1=CC=C([C@@H](O)CCl)C=C1 BCP12169 [1,1,0,0,0,0|1,0,1]=4 36 B12R1.452 FC1=CC(OC)=CC=C1C(O)=O BCP20605 [0,1,0,0,1,0|1,0,0]=3 37 B12R1.452 [O-]C(C1=CC=C(OC)C=C1O)=O BCP08104 [0,1,0,0,1,0|1,0,0]=3 38 B14R1.3 O=C(O)[C@@H](N)CC1=CC=C(OC)C=C1 BCP11543 [0,1,0,0,0,1|1,0,0]=3 39 B14R1.419 CC(C)C1=CC=C(OCC(O)=O)C=C1 BCP14347 [0,1,0,0,0,1|2,0,0]=4 40 B14R1.213 O=C(O)C(C)(C)C=1C=CC(=CC1)CC BCP19020 [0,2,0,0,0,0|2,0,0]=4 41 B14R1.717 CC(NC1=CC=C(C(CCl)=O)C=C1)=O BCP20761 [0,2,0,0,0,0|2,0,0]=4 42 B14R1.717 O=C(O)CC1=CC=C(C(OC)=O)C=C1 BCP01686 [0,2,0,0,0,0|1,0,0]=3 43 B14R1.805 O=C(O)CC1=CC=C(CC(C)C)C=C1 BCP15270 [0,2,0,0,0,0|2,0,0]=4 44 B14R1.805 OC(CC1=CC=C(NC(C)=O)C=C1)=O BCP12510 [0,2,0,0,0,0|2,0,0]=4 45 B14R1.806 O=C(O)CC1=CC=C(S(=O)(C)=O)C=C1 BCP07428 [0,2,0,0,0,0|1,1,0]=4 46 B14R2.1008 O=C(O)CC1=CC=C2OCCC2=C1 BCP11385 [0,1,0,1,0,0|1,0,0]=3 47 B14R2.1006 O=C(O)CC1=CC=C(C2CC2)C=C1 BCP20265 [0,1,0,1,0,0|2,0,0]=4 48 B14R2.601 O=C1CC2=CC([N+]([O-])=O)=CC=C2C1 BCP11556 [0,1,0,1,0,0|2,0,0]=4 49 B10R1.13 O=C(C)C1=CC=C(Cl)N=C1 BCP13928 [1,0,0,0,1,0|2,0,0]=4 50 B10R1.13 OC1=CC=C(C(=S)N)C=C1 BCP12826 [1,0,0,0,1,0|1,1,0]=4 51 B14R1.4 O=C(O)CCCC1=CC=C(OC)C=C1 BCP08922 [0,0,0,0,0,2|1,0,0]=3