0 B26R4.127687 [O-][N+](=O)c1ccc(cc1)c2sc3n(n2)c(nn3)c4ccccc4 Amb1262122 [0,0,0,0,0,0|3,0,1]=4 1 B25R4.2787 COc1ccc(cc1)c2nn3c(s2)nnc3c4cccnc4 Amb1084685 [1,0,0,0,0,0|3,0,0]=4 2 B27R4.2325722 Brc1ccc(cc1)c2nnc3n2nc(s3)c4ccc(cc4)N(C)C Amb10072864 [0,1,0,0,0,0|1,0,0]=2 3 B27R4.2325722 Clc1ccc(cc1)c2nnc3n2nc(s3)c4ccc(cc4)N(C)C Amb1933294 [0,1,0,0,0,0|1,0,0]=2 4 B27R4.2385238 Cc1cccc(c1)c2nnc3n2nc(s3)c4ccc(cc4)N(C)C Amb1929054 [0,1,0,0,0,0|1,0,0]=2 5 B27R4.2967682 Brc1ccccc1c2nnc3n2nc(s3)c4ccc(cc4)N(C)C Amb10072859 [0,1,0,0,0,0|1,0,0]=2 6 B25R3.2605261 CC(C)c1ccc(\C=N\N2C(=S)NN=C2c3cccc[n]3)cc1 Amb22568558 [0,0,1,0,0,0|1,0,2]=4 7 B25R3.2605261 CC(c1ccc(cc1)C=Nn2c(S)nnc2c3ccccc3)C Amb2470428 [0,0,1,0,0,0|2,0,0]=3 8 B25R3.2605261 CC(c1ccc(cc1)\C=N\n2c(S)nnc2c3ccccc3)C Amb1824775 [0,0,1,0,0,0|2,0,0]=3 9 B25R3.2605261 CN(C)c1ccc(\C=N\N2C(=S)NN=C2c3cccc[n]3)cc1 Amb19785135 [0,0,1,0,0,0|0,0,2]=3 10 B25R3.2605261 CN(C)c1ccc(\C=N\N2C(=S)NN=C2c3ccccc3)cc1 Amb19846456 [0,0,1,0,0,0|1,0,2]=4 11 B25R3.2605261 CN(c1ccc(cc1)C=Nn2c(S)nnc2c3ccccc3)C Amb2470438 [0,0,1,0,0,0|1,0,0]=2 12 B25R3.2605261 CN(c1ccc(cc1)\C=N\n2c(S)nnc2c3ccccc3)C Amb1823116 [0,0,1,0,0,0|1,0,0]=2 13 B25R3.2605261 OC(=O)c1ccc(cc1)\C=N\n2c(S)nnc2c3ccccn3 Amb1209793 [0,0,1,0,0,0|3,0,0]=4 14 B27R4.4272522 CC(C)c1ccc(cc1)-c2[n][n]3c(Cc4ccccc4)[n][n]c3[s]2 Amb23595367 [0,0,0,0,0,1|2,0,0]=3 15 B24R3.26201 CCc1ccc(cc1)C=Nn2c(S)nnc2c3ccccc3 Amb2470452 [1,0,1,0,0,0|2,0,0]=4 16 B24R3.26201 CCc1ccc(cc1)\C=N\n2c(S)nnc2c3ccccc3 Amb1822771 [1,0,1,0,0,0|2,0,0]=4 17 B24R3.26201 COc1ccc(cc1)C=Nn2c(S)nnc2c3ccccc3 Amb2470439 [1,0,1,0,0,0|2,0,0]=4 18 B24R3.26201 COc1ccc(cc1)\C=N\n2c(S)nnc2c3ccccc3 Amb1639148 [1,0,1,0,0,0|2,0,0]=4 19 B24R3.26201 CSc1ccc(cc1)C=Nn2c(S)nnc2c3ccccc3 Amb2470444 [1,0,1,0,0,0|2,0,0]=4 20 B24R3.26201 CSc1ccc(cc1)\C=N\n2c(S)nnc2c3ccccc3 Amb1821636 [1,0,1,0,0,0|2,0,0]=4 21 B24R4.22342 Cc1ccc(cc1)c2nn3c(s2)nnc3c4ccccc4 Amb1101576 [2,0,0,0,0,0|1,0,0]=3 22 B24R4.22342 Cc1ccc(cc1)c2nn3c(s2)nnc3c4ccncc4 Amb1100255 [2,0,0,0,0,0|2,0,0]=4 23 B24R4.22342 Cc1ccc(cn1)c2nn3c(s2)nnc3c4ccccn4 Amb10072915 [2,0,0,0,0,0|1,0,0]=3 24 B24R4.22342 Clc1ccc(cc1)c2nn3c(s2)nnc3c4cnccn4 Amb1090767 [2,0,0,0,0,0|2,0,0]=4 25 B24R4.22342 Fc1ccc(cc1)c2nn3c(s2)nnc3c4ccccn4 Amb1098473 [2,0,0,0,0,0|1,0,0]=3 26 B24R4.22342 Fc1ccc(cc1)c2nn3c(s2)nnc3c4cnccn4 Amb1090418 [2,0,0,0,0,0|2,0,0]=4 27 B24R4.22342 Nc1ccc(cc1)c2nn3c(s2)nnc3c4ccccc4 Amb17193682 [2,0,0,0,0,0|1,0,0]=3 28 B26R3.565627 COC(=O)c1ccc(cc1)\C=N\n2c(S)nnc2c3ccccn3 Amb1209790 [0,1,1,0,0,0|2,0,0]=4 29 B26R3.2819243 Sc1nnc(n1N=Cc2ccc(cc2)C(C)(C)C)c3ccccc3 Amb1825736 [0,1,1,0,0,0|2,0,0]=4 30 B26R3.52979480 Brc1ccc(cc1)c2nnc(n2\N=C\c3ccc(cc3)N(C)C)S Amb16210107 [0,1,1,0,0,0|1,0,0]=3 31 B26R3.52979480 Clc1ccc(cc1)c2nnc(n2N=Cc3ccc(cc3)C(C)C)S Amb1825409 [0,1,1,0,0,0|2,0,0]=4 32 B26R3.52979480 Clc1ccc(cc1)c2nnc(n2N=Cc3ccc(cc3)N(C)C)S Amb1820846 [0,1,1,0,0,0|1,0,0]=3 33 B26R3.52979480 Clc1ccc(cc1)c2nnc(n2\N=C\c3ccc(cc3)C(C)C)S Amb1397961 [0,1,1,0,0,0|2,0,0]=4 34 B26R4.3142 COc1ccc(cc1)c2nn3c(s2)nnc3c4ccc(cc4)Cl Amb1100253 [1,1,0,0,0,0|2,0,0]=4 35 B26R4.53056 COc1ccc(cc1)c2nn3c(s2)nnc3c4ccccc4F Amb1262141 [1,1,0,0,0,0|2,0,0]=4 36 B26R4.53063 COc1ccc(cc1)c2nn3c(s2)nnc3c4cccc(c4)F Amb1101567 [1,1,0,0,0,0|2,0,0]=4 37 B26R4.1687791 CC(c1ccc(cc1)c2nn3c(s2)nnc3c4ccco4)(C)C Amb1933360 [0,1,0,0,1,0|2,0,0]=4 38 B28R4.19756171 CN(C)c1ccc(cc1)C2=NN3C(=O)C(=NN=C3S2)c4ccccc4 Amb19787443 [0,1,0,0,0,1|1,0,0]=3 39 B28R4.69035371 CN(C)c1ccc(\C=C\2/Sc3[n][n]c(-c4ccccc4)[n]3C2=O)cc1 Amb19763380 [0,1,0,0,0,1|2,0,0]=4 40 B28R4.69035371 CN(C)c1ccc(cc1)/C=c2/sc3nnc(-c4ccccc4)n3c2=O Amb17762525 [0,1,0,0,0,1|2,0,0]=4 41 B28R4.6547554 CC(C)c1ccc(cc1)-c2[n][n]3c(Cc4ccc(Cl)cc4)[n][n]c3[s]2 Amb23595369 [0,1,0,0,0,1|2,0,0]=4 42 B28R4.103928 COc1ccc(cc1)c2nnc3n2nc(s3)c4ccc(cc4)N(C)C Amb1933313 [0,2,0,0,0,0|1,0,0]=3 43 B24R4.2404 COc1ccc(cc1)c2nn3c(s2)nnc3c4cccs4 Amb1087666 [1,0,0,0,1,0|2,0,0]=4 44 B24R4.2404 COc1ccc(cc1)c2nn3c(s2)nnc3c4cscc4 Amb12805874 [1,0,0,0,1,0|2,0,0]=4 45 B26R4.46710 COc1ccc(cc1)C2=Nn3c(SC2)nnc3c4ccccc4 Amb1328135 [1,0,0,0,0,1|2,0,0]=4 46 B26R4.53053 CCc1ccc(cc1)-c2[n][n]3c(Cc4ccccc4)[n][n]c3[s]2 Amb23595366 [1,0,0,0,0,1|2,0,0]=4 47 B28R4.5220672 CN(c1ccc(cc1)c2nn3c(s2)nnc3CSc4ccccc4)C Amb1900501 [0,0,0,0,0,2|1,0,0]=3