0 B14R1.818 N[C@H](CCc1ccccc1)CC(=O)O 30055 [0,0,1,0,0,0|3,0,0]=4 1 B14R2.19 NC1=NN(CC2=CC=CC=C2)C=C1 32089 [0,0,0,0,1,0|2,0,1]=4 2 B14R2.19 O=C1N[C@@H](CC2=CC=CC=C2)CO1 6915 [0,0,0,0,1,0|1,0,1]=3 3 B14R2.19 O=C1N[C@H](CC2=CC=CC=C2)CO1 6916 [0,0,0,0,1,0|1,0,1]=3 4 B14R2.19 S=C1N[C@H](CC2=CC=CC=C2)CS1 35899 [0,0,0,0,1,0|1,1,1]=4 5 B14R2.436 NC1CC(OCC2=CC=CC=C2)C1 17643 [0,0,0,0,1,0|2,0,1]=4 6 B14R2.436 O=C1CC(OCC2=CC=CC=C2)C1 25395 [0,0,0,0,1,0|3,0,0]=4 7 B15R2.98 NC1=CC=C(C[C@H]2COC(=O)N2)C=C1 7548 [0,1,0,0,1,0|1,0,1]=4 8 B15R3.4209 C1=CC=C(C2CC3C=CC2C3)C=C1 21612 [1,0,0,1,0,0|2,0,0]=4 9 B13R1.351 C[C@@H](OCC1=CC=CC=C1)C(=O)O 36485 [0,0,1,0,1,0|2,0,0]=4 10 B13R1.351 NC(CCC1=CC=CC=C1)C(=O)O 11932 [0,0,1,0,1,0|2,0,0]=4 11 B13R1.351 N[C@H](CCC1=CC=CC=C1)C(=O)O 11884 [0,0,1,0,1,0|2,0,0]=4 12 B13R1.351 N[C@H](CCc1ccccc1)C(=O)O 30241 [0,0,1,0,1,0|2,0,0]=4 13 B13R1.351 O=C(O)[C@H](O)CCc1ccccc1 5687 [0,0,1,0,1,0|2,0,0]=4 14 B13R2.10 NC1=NC(C2=CC=CC=C2)=CO1 27480 [0,0,0,0,2,0|0,0,2]=4 15 B13R2.10 NC1=NN(C2=CC=CC=C2)CC1 22707 [0,0,0,0,2,0|2,0,0]=4 16 B13R2.10 O=C1N[C@@H](c2ccccc2)CO1 6076 [0,0,0,0,2,0|1,0,1]=4 17 B13R2.10 O=C1N[C@H](c2ccccc2)CO1 6077 [0,0,0,0,2,0|1,0,1]=4