0 B14R2.3 C#CCN[C@@H]1CCC2=CC=CC=C21 DY425840 [0,0,0,0,0,0|0,0,0]=0 1 B13R2.1 NCCN1CCC2=CC=CC=C21 DY601705 [1,0,0,0,0,0|2,0,1]=4 2 B13R1.28 CCCCCCCC1=CC=CC=C1 DY790293 [0,0,1,0,0,0|1,0,2]=4 3 B15R3.3 C1=CC2=C(C=C1)C3NCCCC3N2 DY526725 [0,0,0,1,0,0|1,0,2]=4 4 B12R1.3 CCN[C@H](CO)C1=CC=CC=C1 DY624223 [1,0,1,0,0,0|1,0,1]=4 5 B12R1.30 CC(NCCN)C1=CC=CC=C1 DY583707 [1,0,1,0,0,0|1,0,1]=4 6 B12R1.8 C#CCNCCC1=CC=CC=C1 DY561693 [1,0,1,0,0,0|0,0,0]=2 7 B12R1.8 CCNCCCC1=CC=CC=C1 DY610544 [1,0,1,0,0,0|0,0,1]=3 8 B12R1.121 CCNCC1=C(OC)C=CC=C1 DY604484 [1,0,1,0,0,0|1,0,1]=4 9 B12R1.121 CCNCC1=C(OC)C=CC=C1 DY609427 [1,0,1,0,0,0|1,0,1]=4 10 B12R2.1 N#CC1CCC2=CC=CC=C21 NO13197 [2,0,0,0,0,0|1,0,0]=3 11 B14R1.904 CCCNCC1=C(OCC)C=CC=C1 DY610607 [0,1,1,0,0,0|0,0,2]=4 12 B14R1.904 CCOC1=C(CNCCO)C=CC=C1 DY614653 [0,1,1,0,0,0|1,0,1]=4 13 B16R2.163604 CCCN[C@@H]1CCC2=C(C=CC=C2O)C1 DY501879 [0,1,0,0,0,1|0,0,2]=4 14 B14R2.1253 C1=CC=C(C2CCCCCN2)C=C1 DY743191 [0,0,1,1,0,0|0,0,2]=4 15 B14R2.1253 C1=CC=C(C2CCOCCN2)C=C1 DY770151 [0,0,1,1,0,0|1,0,1]=4 16 B14R2.6 C1=CC=C(CC2CNCCO2)C=C1 DY431313 [0,0,1,1,0,0|1,0,1]=4 17 B14R2.6 C1=CC=C(CC2CNCCO2)C=C1 DY431427 [0,0,1,1,0,0|1,0,1]=4 18 B14R2.6 C1=CC=C(C[C@@H]2CNCCO2)C=C1 DY20837 [0,0,1,1,0,0|1,0,1]=4 19 B14R2.6 C1=CC=C(C[C@H]2CNCCO2)C=C1 DY20836 [0,0,1,1,0,0|1,0,1]=4 20 B14R2.7150 C#CCN1CCCC2=CC=CC=C21 DY577557 [0,0,1,1,0,0|0,0,0]=2 21 B14R2.7150 NCCN1CCCC2=CC=CC=C21 DY551859 [0,0,1,1,0,0|1,0,1]=4 22 B14R2.112 OCCN1CCC2=CC=CC=C2C1 DY577023 [0,0,1,1,0,0|1,0,1]=4 23 B14R3.2531 C1=CC2=C(C=C1)C3CNCC2C3 DY542949 [1,0,0,1,0,0|1,0,1]=4