0 B11R1.91 CC(=O)CCC1=CC=CC=C1 SPC-k266 [1,0,0,0,0,0|0,0,0]=1 1 B11R1.91 O=C(O)CCC1=CN=NC=C1 SPC-t412 [1,0,0,0,0,0|3,0,0]=4 2 B11R1.91 O=C(O)CCC1=NN=CC=C1 SPC-v656 [1,0,0,0,0,0|3,0,0]=4 3 B13R1.133 O=[N+]([O-])[C@@H](F)CC1=CC=C(Cl)C=C1 SPC-d112 [0,1,0,0,0,0|3,0,0]=4 4 B13R2.155 CN1CCC2=C(C=C(N)C=C2)C1 SPC-h707 [0,0,0,1,0,0|3,0,0]=4 5 B13R2.155 O=C1C=CC2=C(C=C(O)C=C2)N1 SPC-g452 [0,0,0,1,0,0|1,0,2]=4 6 B11R1.20 O=C(O)CC1=NC=C(Br)C=C1 SPC-j674 [0,0,0,0,1,0|3,0,0]=4 7 B11R1.20 O=C(O)CC1=NC=C(F)C=C1 SPC-m376 [0,0,0,0,1,0|3,0,0]=4 8 B10R1.1 FC1=CC=C(CCBr)C=C1 SPC-g391 [2,0,0,0,0,0|2,0,0]=4 9 B10R1.1 NCCC1=CC=C(N)C=C1 SPC-r402 [2,0,0,0,0,0|2,0,0]=4 10 B12R1.43 O=[N+]([O-])[C@@H](F)CC1=CC=CC=C1 SPC-d111 [1,1,0,0,0,0|2,0,0]=4 11 B12R1.19 O=C(O)CC1=CC(Cl)=C(F)C=C1 SPC-g090 [0,1,0,0,1,0|2,0,0]=4 12 B14R1.3 COC1=CC=C(C[C@H](F)[N+](=O)[O-])C=C1 SPC-d113 [0,2,0,0,0,0|2,0,0]=4 13 B14R1.7626 C[C@](N)(CC1=CC=C(O)C=C1)C(=O)O SPC-r015 [0,2,0,0,0,0|1,0,0]=3 14 B12R2.24 BrC1=CC2=C(C=C1)CCNC2 SPC-m132 [1,0,0,1,0,0|2,0,0]=4 15 B12R2.24 OC1=CC2=C(C=C1)CNCC2 SPC-n927 [1,0,0,1,0,0|1,0,1]=4 16 B12R2.132 NC1=CC2=C(C=C1)CNC2=O SPC-h313 [1,0,0,1,0,0|2,0,0]=4 17 B12R2.132 N[C@@H]1CCC2=C1C=C(O)C=C2 SPC-n746 [1,0,0,1,0,0|1,0,1]=4 18 B12R2.132 O=C1CCC2=C1C=C(Br)C=C2 SPC-g292 [1,0,0,1,0,0|1,0,0]=3 19 B12R2.132 O=C1CCC2=C1C=C(Cl)C=C2 SPC-g641 [1,0,0,1,0,0|1,0,0]=3 20 B12R2.132 O=C1NCC2=C1C=C(Br)C=C2 SPC-p765 [1,0,0,1,0,0|2,0,0]=4 21 B12R2.132 O=C1NCC2=C1C=C(F)C=C2 SPC-s397 [1,0,0,1,0,0|2,0,0]=4 22 B12R2.132 O=C1OCC2=C1C=C(I)C=C2 SPC-p810 [1,0,0,1,0,0|2,0,0]=4 23 B12R2.2302 BrC1=CC=C(C2COC2)C=C1 SPC-a275 [1,0,0,1,0,0|2,0,0]=4 24 B12R2.2302 FC1=CC=C(C2COC2)C=C1 SPC-a274 [1,0,0,1,0,0|2,0,0]=4 25 B12R2.2302 NC1=CC=C(C2COC2)C=C1 SPC-a276 [1,0,0,1,0,0|2,0,0]=4 26 B12R2.22 NC1CC(C2=CC=CC=C2)C1 SPC-p419 [1,0,0,1,0,0|1,0,1]=4 27 B12R2.22 N[C@H]1C[C@H](C2=CC=CC=C2)C1 SPC-i812 [1,0,0,1,0,0|1,0,1]=4 28 B12R2.22 O=C1CC(C2=CC=CC=C2)C1 SPC-s949 [1,0,0,1,0,0|0,0,0]=2 29 B12R2.606 NC1=CC2=C(C=C1)CC(=O)N2 SPC-u070 [0,0,0,1,1,0|2,0,0]=4 30 B12R2.606 NC1=CC2=C(C=C1)NC(=O)C2 SPC-h316 [0,0,0,1,1,0|2,0,0]=4 31 B12R2.606 O=C1CC2=C(C=C(Br)C=C2)N1 SPC-g349 [0,0,0,1,1,0|2,0,0]=4 32 B12R2.606 O=C1CC2=C(C=C(Cl)C=C2)N1 SPC-p794 [0,0,0,1,1,0|2,0,0]=4 33 B12R2.606 O=C1CC2=C(C=CC(Br)=C2)N1 SPC-g276 [0,0,0,1,1,0|2,0,0]=4 34 B14R2.380 NC1=CC2=C(C=C1)CCCC(=O)N2 SPC-k872 [0,0,0,1,0,1|2,0,0]=4 35 B14R3.19160 OC1=CC=C(C23CC(C2)C3)C=C1 SPC-a416 [0,0,0,2,0,0|1,0,1]=4 36 B10R1.13 NC(=O)C1=NC=C(O)C=C1 SPC-u527 [0,0,0,0,2,0|2,0,0]=4 37 B10R1.13 O=C(O)C1=NC=C(O)C=C1 SPC-g279 [0,0,0,0,2,0|2,0,0]=4