0  B18R3.12875  C1=CC2=C(C=C1)SC(=N2)OC3CCCCC3 R345369 [0,0,0,0,0,0|2,1,0]=3
1  B19R3.182  CC1=C(SC2=CC=CC=C12)CN3CCNCC3 PH016394 [0,1,0,0,0,0|3,0,0]=4
2  B19R3.1799922  O=C(C1=CC2=C(S1)C=CC=C2)N3CCOCC3 T158941 [0,1,0,0,0,0|2,0,0]=3
3  B17R2.143  O=C(CC1=CC=CC=C1)CN2CCOCC2 PH013332 [0,0,1,0,0,0|2,1,0]=4
4  B17R2.2569  CCCCCCOC1=NC2=C(S1)C=CC=C2 R394173 [0,0,1,0,0,0|2,1,0]=4
5  B17R3.8708  C1=CC2=C(C=C1)OC(=N2)N3CCNCC3 MNO000204 [0,0,0,0,1,0|1,1,0]=3
6  B17R3.8708  C1=CC2=C(C=C1)SC(=N2)N3CCCCC3 S840734 [0,0,0,0,1,0|1,0,0]=2
7  B17R3.8708  C1=CC2=C(C=C1)SC(=N2)N3CCOCC3 R305944 [0,0,0,0,1,0|0,0,0]=1
8  B17R3.8708  C1=CC=C2NC(=NC2=C1)C3CCNCC3 CBR01874 [0,0,0,0,1,0|3,0,0]=4
9  B17R3.8708  C1=CC=C2OC(=NC2=C1)C3CCNCC3 CDS013554 [0,0,0,0,1,0|2,1,0]=4
10  B17R3.8708  C1=CC=C2SC(=NC2=C1)N3CCNCC3 CBR00089 [0,0,0,0,1,0|1,0,0]=2
11  B19R3.19215  C1=CC=C2N=C(C=NC2=C1)CN3CCNCC3 PH019352 [0,0,0,0,0,1|3,0,0]=4
12  B19R3.19215  C1=CC=C2N=CC(=CC2=C1)CN3CCNCC3 PH017855 [0,0,0,0,0,1|3,0,0]=4
13  B16R2.2875  CCCCCSC1=NC2=C(O1)C=CC=C2 PH008624 [1,0,1,0,0,0|1,1,0]=4
14  B18R3.30705  CC1CCN(CC1)C2=NC3=CC=CC=C3N2 T320676 [0,1,0,0,1,0|2,0,0]=4
15  B18R3.31677  NC1CCCN(C1)C2=NC3=CC=CC=C3S2 CDS022379 [0,1,0,0,1,0|1,0,0]=3
16  B20R3.13449  O=C1NC(=NC2=C1C=CC=C2)CN3CCOCC3 OTV000600 [0,1,0,0,0,1|2,0,0]=4
17  B20R3.16119  O=C(CC1=CC2=C(S1)C=CC=C2)N3CCOCC3 T158925 [0,1,0,0,0,1|2,0,0]=4
18  B20R3.8734  O=C(C1=C(C2=C(S1)C=CC=C2)Cl)N3CCOCC3 T158372 [0,2,0,0,0,0|2,0,0]=4
19  B20R3.8734  O=C(C1=C(C2=C(S1)C=CC=C2)O)N3CCOCC3 T158283 [0,2,0,0,0,0|2,0,0]=4
20  B18R3.2123  C1=CC2=C(C=C1)N=C(C=C2)N3CCOCC3 S834041 [0,0,1,1,0,0|2,0,0]=4
21  B16R2.88  N/C(=N\C1=CC=CC=C1)/N2CCOCC2 L255408 [0,0,1,0,1,0|1,0,0]=3
22  B16R2.88  O=C(CN1CCOCC1)C2=CC=CC=C2 PH011810 [0,0,1,0,1,0|1,1,0]=4
23  B16R2.88  O=C(CN1CCOCC1)C2=CC=CC=C2 T311340 [0,0,1,0,1,0|1,1,0]=4
24  B16R2.88  O=C(NC1=CC=CC=C1)N2CCOCC2 S591513 [0,0,1,0,1,0|0,1,1]=4
25  B16R2.88  S=C(NC1=CC=CC=C1)N2CCOCC2 TMT00088 [0,0,1,0,1,0|0,0,2]=4
26  B16R2.71  OC1=C(C=CC=C1)/C=N/N2CCOCC2 R746649 [0,0,1,0,1,0|1,1,0]=4