0 B16R1.643 CCCCCCCCCCC1=CC=CN=C1 C75781 [0,0,1,0,0,0|2,0,0]=3 1 B16R1.643 CCCCCCCCCCC1=CC=NC=C1 C73493 [0,0,1,0,0,0|2,0,0]=3 2 B16R1.643 CCCCCCCCCSC1=CC=CC=C1 C75647 [0,0,1,0,0,0|2,0,0]=3 3 B15R1.35 NCCCCCCOCC1=CC=CC=C1 C91636 [1,0,1,0,0,0|2,0,0]=4 4 B17R2.3395 O=C1NCCCC[C@@H]1NCC2=CC=CC=C2 A12956 [0,1,0,0,1,0|1,0,1]=4 5 B19R2.210921 O=C(N[C@H]1CCCCNC1)OCC2=CC=CC=C2 66653 [0,1,0,0,0,1|1,0,1]=4 6 B19R2.210921 O=C(N[C@H]1CCCCNC1)OCC2=CC=CC=C2 C11566 [0,1,0,0,0,1|1,0,1]=4 7 B17R3.127936 C1=CC2=C(C=C1)C3(CCC2)CCNCC3 S11477 [0,0,0,1,1,0|2,0,0]=4 8 B17R3.127936 C1=CC2=C(C=C1)C3(CCNCC3)OCC2 81324 [0,0,0,1,1,0|2,0,0]=4 9 B17R3.127936 C1=CC2=C(C=C1)C3(CCNCC3)OCC2 A10723 [0,0,0,1,1,0|2,0,0]=4 10 B17R3.127936 C1=CC2=C(C=C1)C3(CCNCC3)OCC2 C73653 [0,0,0,1,1,0|2,0,0]=4 11 B17R3.8762 C1=CC=C(CN2C3CCC2CNC3)C=C1 90512 [0,0,0,1,1,0|1,0,0]=3 12 B17R3.8762 C1=CC=C(CN2C3CCC2CNC3)C=C1 P13130 [0,0,0,1,1,0|1,0,0]=3 13 B15R2.2195 C1=CC=C(CCN2CCCCC2)C=C1 A11735 [0,0,0,0,2,0|1,0,0]=3 14 B15R2.2195 C1=CC=C(CC[C@H]2CNCCN2)C=C1 I11964 [0,0,0,0,2,0|2,0,0]=4 15 B15R2.2195 C1=CC=C(CNC2CCCCC2)C=C1 N16995 [0,0,0,0,2,0|0,0,0]=2 16 B15R2.2195 C1=CC=C(CNC2CCNCC2)C=C1 P18616 [0,0,0,0,2,0|1,0,0]=3 17 B15R2.2195 C1=CC=C(CN[C@H]2CCCNC2)C=C1 P18674 [0,0,0,0,2,0|1,0,0]=3 18 B15R2.2195 C1=CC=C(CO[C@H]2CCCNC2)C=C1 C77789 [0,0,0,0,2,0|2,0,0]=4 19 B15R2.2195 C1=CC=C(NCC2CCNCC2)C=C1 AC9032 [0,0,0,0,2,0|2,0,0]=4 20 B15R2.2195 C1=CN=C(CNC2CCCCC2)C=C1 D78421 [0,0,0,0,2,0|1,0,0]=3 21 B15R2.2195 C1=CN=C(CNC2CCNCC2)C=C1 AC8467 [0,0,0,0,2,0|2,0,0]=4 22 B15R2.2167 C1=CC=C(CN2CCCNCC2)C=C1 A12528 [0,0,0,0,2,0|2,0,0]=4