0 B21R3.226 Brc1cccc(c1)c2nc(no2)Cc3cccnc3 270196a_100011194494_100000210664 [1,0,0,0,0,0|1,0,1]=3 1 B21R3.226 Brc1cccc(c1)c2nc(no2)Cc3cnccn3 270196a_200011824423_100000210664 [1,0,0,0,0,0|2,0,1]=4 2 B21R3.226 Brc1cccc(c1)c2nc(no2)Sc3ccccc3 270196a_100011225313_100000210664 [1,0,0,0,0,0|3,0,0]=4 3 B21R3.226 Brc1cccc(c1)c2nc(no2)[Se]c3ccccc3 270196a_100015229233_100000210664 [1,0,0,0,0,0|3,0,0]=4 4 B21R3.226 Brc1cccc(c1)c2noc(n2)Cc3cccnc3 270196a_100000189340_100000737805 [1,0,0,0,0,0|2,0,1]=4 5 B21R3.226 Cc1cccc(c1)c2nc(no2)Cc3cccnc3 270196a_100011194494_100000189346 [1,0,0,0,0,0|2,0,1]=4 6 B21R3.226 Clc1cccc(c1)c2nc(no2)Cc3cccnc3 270196a_100011194494_100000210390 [1,0,0,0,0,0|1,1,1]=4 7 B21R3.226 Fc1cccc(c1)c2nc(no2)Cc3cccnc3 270196a_100011194494_100000210950 [1,0,0,0,0,0|1,1,1]=4 8 B21R3.226 Ic1cccc(c1)c2nc(no2)Cc3cccnc3 270196a_100011194494_100000184098 [1,0,0,0,0,0|1,1,1]=4 9 B21R3.226 Oc1cccc(c1)c2nc(no2)Cc3cccnc3 270196a_100011194494_100000183914 [1,0,0,0,0,0|2,0,1]=4 10 B20R2.4658 O=C(C=Cc1cccnc1)CCc2cccc(c2)Br 1458a_100000735890_100011740638 [1,0,1,0,0,0|1,0,1]=4 11 B20R2.4658 O=C(C=Cc1cccnc1)NCc2cccc(c2)Br 11a_100000174977_100000735890 [1,0,1,0,0,0|1,0,1]=4 12 B20R2.4658 O=C(C=Cc1cccnc1)NCc2cccc(c2)Br 240690a_100000174977_100000735890 [1,0,1,0,0,0|1,0,1]=4 13 B20R2.4658 O=C(C=Cc1cccnc1)NNc2cccc(c2)Br 22a_100000217339_100000735890 [1,0,1,0,0,0|2,0,0]=4 14 B20R2.21596 O=C(C=Cc1cccnc1)CC(=O)c2ccccc2 1458a_100000735890_100000211460 [1,0,1,0,0,0|2,0,0]=4 15 B20R3.2719 c1ccc(cc1)Sc2coc(n2)c3ccccc3 62a_100000719477_100010163736 [2,0,0,0,0,0|2,0,0]=4 16 B20R3.2719 c1ccc(cc1)Sc2coc(n2)c3ccccc3 62a_100010163736_100000041952 [2,0,0,0,0,0|2,0,0]=4 17 B20R3.2719 c1ccc(cc1)c2nc(c[nH]2)Sc3cccnc3 62a_100000210063_200010210587 [2,0,0,0,0,0|2,0,0]=4 18 B20R3.2719 c1ccc(cc1)c2nc(c[nH]2)Sc3cccnc3 62a_200010210587_100000210063 [2,0,0,0,0,0|2,0,0]=4 19 B20R3.2719 c1ccc(cc1)c2nc(co2)Sc3cccnc3 62a_100000210063_100010163736 [2,0,0,0,0,0|1,0,0]=3 20 B20R3.2719 c1ccc(cc1)c2nc(co2)Sc3cccnc3 62a_100010163736_100000210063 [2,0,0,0,0,0|1,0,0]=3 21 B20R3.2719 c1ccc(cc1)c2nc(co2)Sc3cccnn3 62a_100010163736_100016991348 [2,0,0,0,0,0|2,0,0]=4 22 B20R3.2719 c1ccc(cc1)c2nc(co2)Sc3cccnn3 62a_100016991348_100010163736 [2,0,0,0,0,0|2,0,0]=4 23 B20R3.2719 c1ccc(cc1)c2nc(co2)Sc3ccnnc3 62a_100000732662_100010163736 [2,0,0,0,0,0|2,0,0]=4 24 B20R3.2719 c1ccc(cc1)c2nc(co2)Sc3ccnnc3 62a_100010163736_100000732662 [2,0,0,0,0,0|2,0,0]=4 25 B20R3.2719 c1ccc(cc1)c2nc(co2)Sc3cnccn3 62a_100000211759_100010163736 [2,0,0,0,0,0|2,0,0]=4 26 B20R3.2719 c1ccc(cc1)c2nc(co2)Sc3cnccn3 62a_100010163736_100000211759 [2,0,0,0,0,0|2,0,0]=4 27 B20R3.2719 c1ccc(cc1)c2nc(co2)Sc3cncnc3 62a_100010163736_100011206942 [2,0,0,0,0,0|2,0,0]=4 28 B20R3.2719 c1ccc(cc1)c2nc(co2)Sc3cncnc3 62a_100011206942_100010163736 [2,0,0,0,0,0|2,0,0]=4 29 B20R3.2719 c1ccc(cc1)c2nc(no2)Cc3cccnc3 270196a_100011194494_100000185807 [2,0,0,0,0,0|1,0,1]=4 30 B20R3.2719 c1ccc(cc1)c2nc(no2)Sc3cccnc3 62a_100000210063_200000701163 [2,0,0,0,0,0|2,0,0]=4 31 B20R3.2719 c1ccc(cc1)c2nc(no2)Sc3cccnc3 62a_200000701163_100000210063 [2,0,0,0,0,0|2,0,0]=4 32 B20R2.4648 O=C(Cc1cccc(c1)Br)C(=Cc2cccnc2)F 1458a_100000731744_100000211773 [0,0,1,0,1,0|1,0,1]=4 33 B20R2.4648 O=C(Nc1cccc(c1)Br)C(=Cc2cccnc2)F 11a_100000210019_100000731744 [0,0,1,0,1,0|2,0,0]=4 34 B20R2.4648 O=C(Nc1cccc(c1)Br)C(=Cc2cccnc2)F 22a_100000210019_100000731744 [0,0,1,0,1,0|2,0,0]=4 35 B20R2.4648 O=C(Nc1cccc(c1)Br)C(=Cc2cccnc2)F 527a_100000210019_100000731744 [0,0,1,0,1,0|2,0,0]=4 36 B20R2.4659 CN(C(=O)C=Cc1cccnc1)c2cccc(c2)Br 11a_100000219648_100000735890 [0,0,1,0,1,0|2,0,0]=4 37 B20R2.4659 CN(C(=O)C=Cc1cccnc1)c2cccc(c2)Br 22a_100000219648_100000735890 [0,0,1,0,1,0|2,0,0]=4 38 B20R3.160 Brc1cccc(c1)c2nc(no2)c3ccccc3 270196a_100000210280_100000210664 [1,0,0,0,1,0|2,0,0]=4 39 B20R3.160 Brc1cccc(c1)c2nc(no2)c3cccnc3 270196a_100000188564_100000210664 [1,0,0,0,1,0|1,0,0]=3 40 B20R3.160 Brc1cccc(c1)c2nc(no2)c3cccnn3 270196a_100000047776_100000210664 [1,0,0,0,1,0|2,0,0]=4 41 B20R3.160 Brc1cccc(c1)c2nc(no2)c3ccnnc3 270196a_100011830395_100000210664 [1,0,0,0,1,0|2,0,0]=4 42 B20R3.160 Brc1cccc(c1)c2nc(no2)c3cnccn3 270196a_100011215543_100000210664 [1,0,0,0,1,0|2,0,0]=4 43 B20R3.160 Brc1cccc(c1)c2nc(no2)c3cncnc3 270196a_100011219289_100000210664 [1,0,0,0,1,0|2,0,0]=4 44 B20R3.160 Cc1cccc(c1)c2nc(no2)c3cccnc3 270196a_100000188564_100000189346 [1,0,0,0,1,0|2,0,0]=4 45 B20R3.160 Clc1cccc(c1)c2nc(no2)c3cccnc3 270196a_100000188564_100000210390 [1,0,0,0,1,0|1,1,0]=4 46 B20R3.160 Fc1cccc(c1)c2nc(no2)c3cccnc3 270196a_100000188564_100000210950 [1,0,0,0,1,0|1,1,0]=4 47 B20R3.160 Ic1cccc(c1)c2nc(no2)c3cccnc3 270196a_100000188564_100000184098 [1,0,0,0,1,0|1,1,0]=4 48 B20R3.160 Oc1cccc(c1)c2nc(no2)c3cccnc3 270196a_100000188564_100000183914 [1,0,0,0,1,0|2,0,0]=4