0 B17R3.17530 Brc1ccc(o1)c2nc3ccccc3[nH]2 CSC000175111 [0,1,0,0,0,0|2,0,0]=3 1 B17R3.24914 Cn1nccc1c2nc3ccccc3[nH]2 CSC011242191 [0,1,0,0,0,0|0,0,2]=3 2 B17R3.30918 Clc1ccc2[nH]c(nc2c1)c3cccs3 CSC000175119 [0,1,0,0,0,0|2,0,0]=3 3 B17R3.30918 Clc1cnc2[nH]c(nc2c1)c3cccs3 CSC043646111 [0,1,0,0,0,0|3,0,0]=4 4 B15R2.64 O=C(Nc1ccccc1)c2ccco2 CSC000153480 [0,0,1,0,0,0|3,0,0]=4 5 B15R2.64 O=C(Nc1ccccc1)c2cccs2 CSC000153504 [0,0,1,0,0,0|3,0,0]=4 6 B15R2.64 O=C(Nc1ccccc1)c2ccsc2 CSC000193857 [0,0,1,0,0,0|3,0,0]=4 7 B15R2.64 O=C(Nc1ccccc1)c2cnsn2 CSC011361329 [0,0,1,0,0,0|3,0,0]=4 8 B15R2.64 O=C(Nc1ccccc1)c2csnn2 CSC011266267 [0,0,1,0,0,0|2,0,1]=4 9 B15R2.64 O=C(Nc1ccccc1)c2ncc[nH]2 CSC000024769 [0,0,1,0,0,0|3,0,0]=4 10 B15R2.2203 C=CCSCc1nc2ccccc2[nH]1 CSC000011622 [0,0,1,0,0,0|2,0,1]=4 11 B14R2.101 C(Nc1ccccc1)c2cc[nH]n2 CSC011332748 [1,0,1,0,0,0|0,0,1]=3 12 B16R2.133 Cc1ccc(cc1)NC(=O)c2nc[nH]n2 CSC044278122 [0,1,1,0,0,0|2,0,0]=4 13 B16R2.253 Cc1cccc(n1)NC(=O)c2cc[nH]n2 CSC000030061 [0,1,1,0,0,0|2,0,0]=4 14 B16R2.253 Cc1ccnc(c1)NC(=O)c2cc[nH]n2 CSC000028225 [0,1,1,0,0,0|2,0,0]=4 15 B16R2.2843 Cc1cc(no1)C(=O)Nc2ccccc2 CSC000153454 [0,1,1,0,0,0|2,0,0]=4 16 B16R2.2843 Cn1ccc(n1)C(=O)Nc2ccncc2 CSC048456078 [0,1,1,0,0,0|2,0,0]=4 17 B16R2.2957 Clc1ccccc1NC(=O)c2cc[nH]n2 CSC000022805 [0,1,1,0,0,0|1,0,0]=3 18 B16R2.1480 COc1ccccc1NCc2cc[nH]n2 CSC011332765 [0,1,1,0,0,0|1,0,1]=4 19 B16R2.3000 Cc1ccc(c(c1)F)NCc2cc[nH]n2 CSC011332872 [0,1,1,0,0,0|1,0,1]=4 20 B16R2.3000 Fc1ccc(c(c1)F)NCc2cc[nH]n2 CSC011332809 [0,1,1,0,0,0|1,0,1]=4 21 B16R2.11414 Cc1ccccc1NCc2ccn(n2)C CSC012354907 [0,1,1,0,0,0|1,0,1]=4 22 B16R2.11414 Cn1ccc(n1)CNc2ccccc2F CSC012349233 [0,1,1,0,0,0|1,0,1]=4 23 B16R2.12623 Fc1ccc(c(c1)NCc2cc[nH]n2)F CSC011332774 [0,1,1,0,0,0|1,0,1]=4 24 B18R3.111 Cn1c(nc2c1cccc2)c3ccccc3 CSC000011584 [0,1,0,0,0,1|2,0,0]=4 25 B18R3.5893 Cc1cccc2c1nc([nH]2)c3ccccc3 CSC000258255 [0,1,0,0,0,1|2,0,0]=4 26 B18R3.5893 Clc1cccc2c1[nH]c(n2)c3ccccc3 CSC020267928 [0,1,0,0,0,1|2,0,0]=4 27 B18R3.30705 Brc1ccc(cc1)c2nc3ccccc3[nH]2 CSC000258273 [0,1,0,0,0,1|2,0,0]=4 28 B18R3.30705 Ic1ccc(cc1)c2nc3ccccc3[nH]2 CSC000273789 [0,1,0,0,0,1|2,0,0]=4 29 B18R3.30705 Oc1ccc(cc1)c2nc3ccccc3[nH]2 CSC000258266 [0,1,0,0,0,1|2,0,0]=4 30 B18R3.31677 Clc1cccc(c1)c2nc3ccccc3[nH]2 CSC000258268 [0,1,0,0,0,1|2,0,0]=4 31 B18R3.31677 Fc1cccc(c1)c2nc3ccccc3[nH]2 CSC000258272 [0,1,0,0,0,1|2,0,0]=4 32 B18R3.31677 Oc1cccc(c1)c2nc3ccccc3[nH]2 CSC000258267 [0,1,0,0,0,1|2,0,0]=4 33 B18R3.32722 Cc1ccc2nc([nH]c2c1)c3ccccc3 CSC000261795 [0,1,0,0,0,1|2,0,0]=4 34 B18R3.32722 Clc1ccc2[nH]c(nc2c1)c3ccccc3 CSC000258288 [0,1,0,0,0,1|2,0,0]=4 35 B18R3.32722 Clc1ccc2[nH]c(nc2c1)c3ccncc3 CSC000258285 [0,1,0,0,0,1|1,0,1]=4 36 B18R3.2914 Cn1c(nc2c1cccc2)c3ccc(o3)Br CSC009814848 [0,2,0,0,0,0|2,0,0]=4 37 B18R3.2907 Clc1ccc2[nH]c(nc2c1)c3ccc(o3)Br CSC000258291 [0,2,0,0,0,0|2,0,0]=4 38 B18R3.11787 Cn1ncc(c1c2nc3ccccc3[nH]2)Br CSC020525458 [0,2,0,0,0,0|0,0,2]=4 39 B16R2.88 O=C(Nc1ccccc1)c2ccccn2 CSC000153471 [0,0,1,0,0,1|2,0,0]=4 40 B16R2.88 O=C(Nc1ccccc1)c2cccnc2 CSC000153478 [0,0,1,0,0,1|2,0,0]=4 41 B16R2.2238 O=C(NCc1ccccc1)c2cc[nH]n2 CSC000242570 [0,0,1,0,0,1|1,0,0]=3 42 B16R2.2959 Cc1ccccc1CNCc2cc[nH]n2 CSC011368955 [0,0,1,0,0,1|1,0,1]=4 43 B18R3.12728 C(Nc1nc2ccccc2[nH]1)c3ccco3 CSC005462430 [0,0,0,0,0,2|2,0,0]=4 44 B18R3.12728 C(Sc1nnc[nH]1)c2nc3ccccc3[nH]2 CSC000023963 [0,0,0,0,0,2|1,0,1]=4