0 B11R1.3 CC(C1=CC=C(CBr)C=C1)=O BCP08093 [0,0,0,0,0,0|2,0,1]=3 1 B11R1.3 CC(C1=CC=C(SC)C=C1)=O BCP20233 [0,0,0,0,0,0|3,0,1]=4 2 B11R1.3 N#CC1=CC=C(C=C1)[C](C)N BCP09898 [0,0,0,0,0,0|2,0,2]=4 3 B11R1.3 NC(C1=CC=C(CN)C=C1)=N BCP04219 [0,0,0,0,0,0|3,0,1]=4 4 B11R1.3 N[C](C)C1=CC=C(OC)C=C1 BCP12189 [0,0,0,0,0,0|3,0,1]=4 5 B11R1.3 O=[N+]([O-])C1=CC=C(CO)C=C1 BCP15778 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.3 NCC1=CC=C(OC)C=C1 BCP11229 [1,0,0,0,0,0|2,0,0]=3 7 B10R1.3 OCC1=CC=C(C=O)C=C1 BCP07175 [1,0,0,0,0,0|1,0,1]=3 8 B10R1.3 OCc1ccc(cc1)C#C BCP06953 [1,0,0,0,0,0|0,0,2]=3 9 B10R1.13 C[C@@H](O)C1=CC=C(F)C=C1 BCP07421 [1,0,0,0,0,0|2,0,0]=3 10 B10R1.13 C[C](N)C1=CC=C(F)C=C1 BCP12200 [1,0,0,0,0,0|2,0,1]=4 11 B10R1.13 NC1=NC=C(C=C1)C(C)C BCP00188 [1,0,0,0,0,0|2,0,0]=3 12 B10R1.13 N[C@@H](C)C1=CC=C(Br)C=C1 BCP07969 [1,0,0,0,0,0|2,0,0]=3 13 B10R1.13 N[C](C)C1=CC=C(Br)C=C1 BCP09414 [1,0,0,0,0,0|2,0,1]=4 14 B10R1.13 N[C](C)C1=CC=C(Cl)C=C1 BCP09416 [1,0,0,0,0,0|2,0,1]=4 15 B10R1.13 N[C](C)C=1C=CC(=CC1)F BCP12199 [1,0,0,0,0,0|2,0,1]=4 16 B10R1.13 OC1=CC=C(B(O)O)C=C1 BCP03521 [1,0,0,0,0,0|3,0,0]=4 17 B10R1.13 OC1=CC=C(C(=S)N)C=C1 BCP12826 [1,0,0,0,0,0|2,0,1]=4 18 B12R1.5 COC1=CC=C([C@@H](O)CCl)C=C1 BCP12169 [0,1,0,0,0,0|3,0,0]=4 19 B12R1.5 NCc1ccc(cc1)C(=O)OC BCP15634 [0,1,0,0,0,0|2,0,1]=4 20 B12R1.5 O=C(OC)C1=CC=C(CCl)C=C1 BCP11096 [0,1,0,0,0,0|2,0,1]=4 21 B12R1.6 FC(F)(F)C1=NC=C(CO)C=C1 BCP12642 [0,1,0,0,0,0|3,0,0]=4 22 B12R1.113 CC(C1=CC=C(CCBr)C=C1)=O BCP17023 [0,1,0,0,0,0|2,0,1]=4 23 B12R1.113 O=[N+]([O-])C1=CC=C(CCO)C=C1 BCP04523 [0,1,0,0,0,0|3,0,0]=4 24 B12R1.256 C[C@@H](N)C1=CC=C([N+]([O-])=O)C=C1 BCP09415 [0,1,0,0,0,0|2,0,1]=4 25 B12R1.256 N[C@@H](C)C1=CC=C(C=C1)N(C)C BCP14799 [0,1,0,0,0,0|2,0,0]=3 26 B9R1.1 OCC1=CC=C(C)N=C1 BCP15437 [2,0,0,0,0,0|1,0,0]=3 27 B9R1.1 OCC1=CC=C(S)C=C1 BCP18396 [2,0,0,0,0,0|1,0,0]=3 28 B9R1.6 N[C](C)C1=CC=CC=C1 BCP13697 [2,0,0,0,0,0|1,0,1]=4 29 B11R1.83 NNCC1=CC=C(OC)C=C1 BCP02652 [1,1,0,0,0,0|2,0,0]=4 30 B11R1.83 NNCC1=CC=C(OC)C=C1 BCP10292 [1,1,0,0,0,0|2,0,0]=4 31 B11R1.83 NOCC1=CC=C(OC)C=C1 BCP19988 [1,1,0,0,0,0|1,0,0]=3 32 B11R1.83 OCCc1ccc(cn1)CC BCP12396 [1,1,0,0,0,0|1,0,0]=3 33 B11R1.279 COC1=C(Cl)C=C(CN)C=C1 BCP11293 [1,1,0,0,0,0|2,0,0]=4 34 B11R1.166 FC1=C([C@@H](C)N)C=CC(F)=C1 BCP07396 [1,1,0,0,0,0|2,0,0]=4 35 B13R1.120 CC(C)C1=C(C=C(C=C1)C(=O)O)Br BCP29543 [0,2,0,0,0,0|0,0,1]=3 36 B11R2.190 C=CC1=CC=C2CCC2=C1 BCP20396 [1,0,0,1,0,0|1,0,1]=4 37 B11R2.34 FC1=CC=C([C@@H]2OC2)C=C1 BCP13087 [1,0,0,1,0,0|2,0,0]=4 38 B9R1.21 OCC1=CC=C(CO)O1 BCP14976 [1,0,0,0,1,0|2,0,0]=4 39 B11R1.20 CC(NC1=CC=C(O)C=C1)=O BCP23431 [1,0,0,0,0,1|1,0,1]=4