0 B14R2.256 CC1=C(C2=CC(N)=NN2)C=CC=C1 12119 [0,0,0,0,0,0|3,0,1]=4 1 B14R2.256 NC1=CC(C2=C(Cl)C=CC=C2)=NO1 15542 [0,0,0,0,0,0|3,0,1]=4 2 B13R2.10 NC1=CC(C2=CC=CC=C2)=NO1 15538 [1,0,0,0,0,0|2,0,1]=4 3 B13R2.10 NC1=NC(C2=CC=CC=C2)=CO1 27480 [1,0,0,0,0,0|0,0,2]=3 4 B13R2.10 NC1=NN(C2=CC=CC=C2)C=C1 22709 [1,0,0,0,0,0|2,0,1]=4 5 B13R2.10 NC1=NN(C2=CC=CC=C2)CC1 22707 [1,0,0,0,0,0|2,0,0]=3 6 B13R2.10 O=C1N[C@@H](c2ccccc2)CO1 6076 [1,0,0,0,0,0|1,0,1]=3 7 B13R2.10 O=C1N[C@H](c2ccccc2)CO1 6077 [1,0,0,0,0,0|1,0,1]=3 8 B13R2.18 Cc1ccccc1-n2cccn2 23688 [1,0,0,0,0,0|2,0,1]=4 9 B13R1.201 CC1=C([C@H](N)CC(=O)O)C=CC=C1 30197 [0,0,1,0,0,0|3,0,0]=4 10 B13R1.528 COC(=O)CCC1=C(Br)C=CC=C1 28882 [0,0,1,0,0,0|3,0,0]=4 11 B12R1.125 CC1=C(CCC(=O)O)C=CC=C1 31589 [1,0,1,0,0,0|2,0,0]=4 12 B12R1.27 COC(=O)CCC1=CC=CC=C1 18417 [1,0,1,0,0,0|2,0,0]=4 13 B12R1.124 CC(C(=O)O)C1=C(Cl)C=CC=C1 23462 [0,0,1,0,1,0|2,0,0]=4 14 B12R1.371 COC(=O)CC1=C(Br)C=CC=C1 25827 [0,0,1,0,1,0|2,0,0]=4 15 B14R2.68 O=C1CN[C@@H](C2=CC=CC=C2)CO1 18052 [1,0,0,0,0,1|1,0,1]=4 16 B14R2.68 O=C1CN[C@@H](C2=CC=CC=C2)CO1 24857 [1,0,0,0,0,1|1,0,1]=4