0  B19R3.2370  C(Cn1nnc2c1cccc2)c3ccccc3 CSC020637660 [0,0,0,0,0,0|3,0,1]=4
1  B19R3.2370  C(NC1CCc2c1cccc2)c3ccncc3 CSC000623538 [0,0,0,0,0,0|2,0,2]=4
2  B19R3.2370  C(Nc1ccccc1)c2csc3c2cccc3 CSC007826826 [0,0,0,0,0,0|3,0,0]=3
3  B20R3.500  O=C(Nc1ccncc1)c2csc3c2cccc3 CSC046749381 [0,1,0,0,0,0|2,0,1]=4
4  B20R3.500  O=C(Nc1ccncc1)c2n[nH]c3c2cccc3 CSC026877025 [0,1,0,0,0,0|2,0,1]=4
5  B20R3.2931  OC(Cn1cnc2c1cccc2)c3ccccc3 CSC000384444 [0,1,0,0,0,0|2,0,1]=4
6  B20R3.8097  Clc1cncnc1NCc2coc3c2cccc3 CSC077101255 [0,1,0,0,0,0|3,0,0]=4
7  B20R3.8097  Clc1cncnc1NCc2csc3c2cccc3 CSC068043669 [0,1,0,0,0,0|3,0,0]=4
8  B20R3.8097  Fc1cnccc1NCc2n[nH]c3c2cccc3 CSC065693624 [0,1,0,0,0,0|2,0,0]=3
9  B20R3.14372  Cc1cc(ccn1)NCc2coc3c2cccc3 CSC083737579 [0,1,0,0,0,0|2,0,0]=3
10  B18R2.4001  Cc1ccccc1C(=O)NCc2ccncc2 CSC046091271 [0,0,1,0,0,0|3,0,0]=4
11  B18R2.4001  Fc1ccccc1C(=O)NCc2ccncc2 CSC000250472 [0,0,1,0,0,0|3,0,0]=4
12  B20R3.2720  C(Cc1ccccc1)N2CCNc3c2cccc3 CSC042089116 [0,0,0,0,0,1|2,0,1]=4
13  B20R3.2720  C(Nc1cccc2c1cccc2)c3ccccc3 CSC000187055 [0,0,0,0,0,1|3,0,0]=4
14  B20R3.2725  C(Cc1csc2c1cccc2)Nc3ccccn3 CSC073955267 [0,0,0,0,0,1|3,0,0]=4
15  B20R3.30190  C(Nc1ccc2ccccc2c1)c3ccccc3 CSC000224561 [0,0,0,0,0,1|3,0,0]=4
16  B20R3.30190  C(Sc1ccc2ccccc2n1)c3ccccc3 CSC046184439 [0,0,0,0,0,1|3,0,0]=4
17  B17R2.2342  O=C(NCc1ccncc1)c2ccccc2 CSC017233929 [1,0,1,0,0,0|2,0,0]=4
18  B19R2.3421  CNc1ccccc1C(=O)NCc2ccncc2 CSC000874001 [0,1,1,0,0,0|1,0,1]=4
19  B19R2.8900  O=C(CCCc1ccccc1)Nc2ccccc2 CSC032536753 [0,1,1,0,0,0|1,0,1]=4
20  B19R2.8900  O=C(NCCc1ccccc1)Nc2ccccc2 CSC046084794 [0,1,1,0,0,0|2,0,0]=4
21  B19R2.16162  O=C(CCc1ccccc1)NNc2ccccc2 CSC046243588 [0,1,1,0,0,0|2,0,0]=4
22  B19R3.3759  Cc1noc(n1)CCc2c[nH]c3c2cccc3 CSC046226093 [0,1,0,0,1,0|2,0,0]=4
23  B21R3.525  Fc1cnccc1NCc2nccc3c2cccc3 CSC077282671 [0,1,0,0,0,1|2,0,0]=4
24  B21R3.2808  O=C(NCc1ccncc1)c2c[nH]c3c2cccn3 CSC046904252 [0,1,0,0,0,1|1,0,1]=4
25  B21R3.2808  O=C(NCc1ccncc1)c2csc3c2cccc3 CSC046721392 [0,1,0,0,0,1|1,0,1]=4
26  B21R3.8298  Cc1cnccc1NCCn2cnc3c2cccc3 CSC087740713 [0,1,0,0,0,1|1,0,1]=4
27  B21R3.8298  Clc1cnccc1NCCc2c[nH]c3c2cccc3 CSC082790115 [0,1,0,0,0,1|0,0,0]=2
28  B21R3.8418  Cc1ccc2c(c[nH]c2c1)CCNc3ccccn3 CSC062107655 [0,1,0,0,0,1|2,0,0]=4
29  B21R3.21587  Cc1cc(ncn1)CNCc2coc3c2cccc3 CSC092764978 [0,1,0,0,0,1|2,0,0]=4
30  B21R3.21587  Cc1cc(ncn1)CNCc2csc3c2cccc3 CSC092764173 [0,1,0,0,0,1|2,0,0]=4
31  B21R3.21587  Cc1cc(ncn1)CNCc2n[nH]c3c2cccc3 CSC082216761 [0,1,0,0,0,1|2,0,0]=4
32  B21R3.21587  Cc1cc(ncn1)NCCc2csc3c2cccc3 CSC071793068 [0,1,0,0,0,1|2,0,0]=4
33  B21R3.4959510  Cn1cc(c2c1cccc2)C(=O)Nc3ccncc3 CSC046141376 [0,2,0,0,0,0|1,0,1]=4
34  B21R3.7968  Cc1nccc(c1Cl)NCc2n[nH]c3c2cccc3 CSC077282803 [0,2,0,0,0,0|2,0,0]=4
35  B21R3.2307191  Cn1c2ccccc2n(c1=O)CCc3ccccc3 CSC040482815 [0,2,0,0,0,0|2,0,0]=4
36  B21R3.7442827  Cc1oc2ccccc2c1CNc3ccnc(c3)C CSC095775398 [0,2,0,0,0,0|2,0,0]=4
37  B17R2.2382  C(Cc1ccncc1)SCc2ccccc2 CSC041855685 [0,0,1,0,1,0|1,0,1]=4
38  B19R2.5666  Brc1ccccc1C(=O)NCCc2ccncc2 CSC003129259 [0,0,1,0,0,1|2,0,0]=4
39  B19R2.5666  Fc1ccccc1C(=O)NCCc2ccncc2 CSC000805460 [0,0,1,0,0,1|2,0,0]=4
40  B21R3.3124  C(Cc1ccccc1)Nc2ncnc3c2cccc3 CSC046081358 [0,0,0,0,0,2|1,0,1]=4
41  B21R3.3124  C(NCc1cccc2c1cccc2)c3ccccc3 CSC000186978 [0,0,0,0,0,2|2,0,0]=4
42  B21R3.3130  C(Cc1c[nH]c2c1cccc2)NCc3ccncc3 CSC041874683 [0,0,0,0,0,2|0,0,0]=2