0  B17R2.99815  NCc1cccc(c1)c2cc(N)nc(n2)N 1P028HTN [0,0,0,0,0,0|1,0,3]=4
1  B16R2.22  COc1cccc(c1)c2cc[nH]c(=O)c2 1P00HM9Y [1,0,0,0,0,0|3,0,0]=4
2  B16R2.22  COc1cccc(c1)c2ccnc(n2)N 1P00HDJ0 [1,0,0,0,0,0|2,0,1]=4
3  B16R2.22  N#Cc1cccc(c1)c2cccc(c2)O 1P003JZQ [1,0,0,0,0,0|2,0,1]=4
4  B16R2.22  N#Cc1cccc(c1)c2ccnc(n2)N 1P00IELU [1,0,0,0,0,0|0,0,1]=2
5  B16R2.22  N#Cc1ccnc(c1)c2nccc(c2)C 1P024HU5 [1,0,0,0,0,0|3,0,0]=4
6  B16R2.80704  Clc1cccc(c1)c2cc(N)nc(n2)N 1P01BFAB [1,0,0,0,0,0|2,0,1]=4
7  B16R2.2418  N#Cc1cccc(c1)n2nc(cc2C)N 1P01A62N [0,0,0,0,1,0|3,0,0]=4
8  B16R2.2418  N#Cc1cccc(c1)n2nc(cc2C)N 1P01AFZO [0,0,0,0,1,0|3,0,0]=4
9  B15R2.17  N#Cc1cccc(c1)c2ccccc2 1P002QIW [2,0,0,0,0,0|2,0,0]=4
10  B15R2.17  N#Cc1cccc(c1)c2ccncc2 1P00DAVY [2,0,0,0,0,0|1,0,1]=4
11  B15R2.17  N#Cc1cccc(n1)c2ccccn2 1P00DAKD [2,0,0,0,0,0|2,0,0]=4
12  B15R2.30  Brc1cccc(c1)c2cc[nH]c(=S)n2 1P00IF2Q [2,0,0,0,0,0|2,0,0]=4
13  B15R2.30  Brc1cccc(c1)c2ccnc(n2)N 1P00BY05 [2,0,0,0,0,0|1,0,1]=4
14  B15R2.30  Clc1cccc(c1)c2ccnc(n2)N 1P00GYVP [2,0,0,0,0,0|1,0,1]=4
15  B15R2.30  Nc1cccc(c1)c2cc[nH]c(=O)n2 1P01FKOS [2,0,0,0,0,0|1,0,1]=4
16  B15R2.27  Cc1nc(N)nc(c1)c2ccccc2 1P001PZA [2,0,0,0,0,0|1,0,1]=4
17  B15R2.27  Clc1nc(N)nc(c1)c2ccccc2 1P00C0YQ [2,0,0,0,0,0|1,0,1]=4
18  B15R2.27  Nc1cc(=O)[nH]c(n1)c2ccccc2 1P018X8U [2,0,0,0,0,0|2,0,0]=4
19  B15R2.27  O=c1[nH]c(=O)[nH]c(c1)c2ccccc2 1P007NVZ [2,0,0,0,0,0|1,0,1]=4
20  B15R2.27  O=c1cc(nc([nH]1)Cl)c2ccccc2 1P00H462 [2,0,0,0,0,0|1,0,0]=3
21  B15R2.27  Oc1nc(N)nc(c1)c2ccccc2 1P00EBQ6 [2,0,0,0,0,0|0,0,2]=4
22  B17R2.2514  N#Cc1cc(F)cc(c1)c2cccc(n2)Br 1P01C1NC [1,1,0,0,0,0|2,0,0]=4
23  B17R2.2514  N#Cc1cc(F)cc(c1)c2cccc(n2)N 1P01AMCU [1,1,0,0,0,0|1,0,0]=3
24  B15R2.18  N#Cc1cccc(c1)c2csc(n2)C 1P008IDN [1,0,0,0,1,0|2,0,0]=4
25  B15R2.18  N#Cc1cccc(c1)c2csc(n2)Cl 1P01UO87 [1,0,0,0,1,0|2,0,0]=4
26  B15R2.18  N#Cc1cccc(c1)c2csc(n2)N 1P00BEXW [1,0,0,0,1,0|1,0,0]=3
27  B15R2.18  N#Cc1cccc(c1)c2n[nH]c(c2)N 1P01KKO9 [1,0,0,0,1,0|1,0,0]=3
28  B15R2.18  N#Cc1cccc(c1)c2n[nH]c(n2)N 1P019QAA [1,0,0,0,1,0|1,0,0]=3
29  B17R2.1818  N#Cc1cccc(c1)Nc2cccc(c2)N 1P01AI51 [1,0,0,0,0,1|2,0,0]=4