0 B31R5.3975012 CC1=CC(=C(N1C2=CC=CC=C2)C)/C=C/3\SC4=NC5=C(N4C3=O)C=CC=C5 MCULE-1671426980 [0,0,0,0,0,0|1,0,0]=1 1 B31R5.3975012 CC1=CC(=C(N1C2=CC=CC=C2)C)/C=C\3/SC4=NC5=CC=CC=C5N4C3=O MCULE-7637087589 [0,0,0,0,0,0|1,0,0]=1 2 B31R5.3975012 CC1=CC(=C(N1C2=CC=CC=C2)C)C=C3SC4=NC5=C(N4C3=O)C=CC=C5 MCULE-9748670103 [0,0,0,0,0,0|1,0,0]=1 3 B31R5.3975012 CC1=CC(=C(N1C2=CC=CC=N2)C)C=C3SC4=NC5=CC=CC=C5N4C3=O MCULE-5311402608 [0,0,0,0,0,0|0,0,0]=0 4 B31R5.3975012 CC1=CC(=C(N1C2=CC=CN=C2)C)C=C3SC4=NC5=CC=CC=C5N4C3=O MCULE-4220043104 [0,0,0,0,0,0|2,0,0]=2 5 B31R5.3975012 CC1=CC(=C(N1C2=CC=NC=C2)C)C=C3SC4=NC5=C(N4C3=O)C=CC=C5 MCULE-4281421515 [0,0,0,0,0,0|2,0,0]=2 6 B31R5.3975012 CC1=CC(=C(N1C2=NC=CC=C2)C)/C=C\3/SC4=NC5=C(N4C3=O)C=CC=C5 MCULE-7302367998 [0,0,0,0,0,0|0,0,0]=0 7 B32R5.23603165 CC1=CC(=C(N1C2=C(C=CC=C2)F)C)C=C3SC4=NC5=C(N4C3=O)C=CC=C5 MCULE-4404541262 [0,1,0,0,0,0|1,0,0]=2 8 B32R5.45171182 CC1=CC(=C(N1C2=CC=C(C=C2)Br)C)C=C3SC4=NC5=C(N4C3=O)C=CC=C5 MCULE-6234324224 [0,1,0,0,0,0|1,0,0]=2 9 B32R5.45171182 CC1=CC(=C(N1C2=CC=C(C=C2)Cl)C)C=C3SC4=NC5=C(N4C3=O)C=CC=C5 MCULE-3643935007 [0,1,0,0,0,0|1,0,0]=2 10 B32R5.45171182 CC1=CC(=C(N1C2=CC=C(C=C2)F)C)C=C3SC4=NC5=C(N4C3=O)C=CC=C5 MCULE-8115158266 [0,1,0,0,0,0|1,0,0]=2 11 B32R5.45171182 CC1=CC(=C(N1C2=CC=C(C=C2)I)C)C=C3SC4=NC5=CC=CC=C5N4C3=O MCULE-3073314470 [0,1,0,0,0,0|1,0,0]=2 12 B32R5.45171182 CC1=CC(=C(N1C2=CC=C(C=C2)O)C)C=C3SC4=NC5=CC=CC=C5N4C3=O MCULE-8222073184 [0,1,0,0,0,0|1,0,0]=2 13 B32R5.45171182 CC1=CC=C(C=C1)N2C(=CC(=C2C)C=C3SC4=NC5=C(N4C3=O)C=CC=C5)C MCULE-9457189695 [0,1,0,0,0,0|1,0,0]=2 14 B32R5.83088946 CC1=CC(=C(N1C2=CC(=CC=C2)F)C)C=C3SC4=NC5=CC=CC=C5N4C3=O MCULE-6583620826 [0,1,0,0,0,0|1,0,0]=2 15 B32R5.83088946 CC1=CC(=C(N1C2=CC(=CC=C2)I)C)C=C3SC4=NC5=CC=CC=C5N4C3=O MCULE-6486879860 [0,1,0,0,0,0|1,0,0]=2 16 B32R5.83088946 CC1=CC=NC(=C1)N2C(=CC(=C2C)C=C3SC4=NC5=CC=CC=C5N4C3=O)C MCULE-6648499261 [0,1,0,0,0,0|0,0,0]=1 17 B30R4.22313418 CC1=CC(=C(N1C2=CC=CC=C2)C)/C=C\3/SC(=S)N(C3=O)C4=CC=CC=C4 MCULE-7851420045 [0,0,1,0,0,0|2,0,0]=3 18 B30R4.22313418 CC1=CC(=C(N1C2=CC=CC=C2)C)C=C3SC(=O)N(C3=O)C4=CC=CC=C4 MCULE-1859728994 [0,0,1,0,0,0|2,0,0]=3 19 B30R4.22313418 CC1=CC(=C(N1C2=CC=CC=C2)C)C=C3SC(=S)N(C3=O)C4=CC=CC=C4 MCULE-9014123074 [0,0,1,0,0,0|2,0,0]=3 20 B30R4.22313418 CC1=CC(=C(N1C2=CC=CC=N2)C)C=C3NC(=O)N(C3=O)C4=CC=CC=C4 MCULE-8708460853 [0,0,1,0,0,0|2,0,0]=3 21 B30R4.22313418 CC1=CC(=C(N1C2=CC=CN=C2)C)/C=C\3/SC(=O)N(C3=O)C4=CC=CC=C4 MCULE-5069018725 [0,0,1,0,0,0|3,0,0]=4 22 B30R4.22313418 CC1=CC(=C(N1C2=CC=NC=C2)C)C=C3SC(=O)N(C3=O)C4=CC=CC=C4 MCULE-5217375305 [0,0,1,0,0,0|3,0,0]=4 23 B30R4.22313418 CC1=CC(=C(N1C2=CN=CC=C2)C)/C=C/3\SC(=O)N(C3=O)C4=CC=CC=C4 MCULE-7289883627 [0,0,1,0,0,0|3,0,0]=4 24 B30R4.22313418 CC1=CC(=C(N1C2=CN=CC=C2)C)C=C3SC(=O)N(C3=O)C4=CC=CC=C4 MCULE-7812898303 [0,0,1,0,0,0|3,0,0]=4 25 B30R4.22313418 CC1=CC(=C(N1C2=CN=CC=C2)C)C=C3SC(=S)N(C3=O)C4=CC=CC=C4 MCULE-9205128689 [0,0,1,0,0,0|3,0,0]=4 26 B30R4.39345326 CC1=CC(=C(N1C2=CC=CC=C2)C)C=C3SC(=NC3=O)NC4=CC=CC=C4 MCULE-2441033348 [0,0,1,0,0,0|1,0,2]=4 27 B31R4.881494503 CC1=CC(=C(N1C2=CC=CC=C2)C)C=C3SC(=S)N(C3=O)C4=CC=C(C=C4)F MCULE-2040773464 [0,1,1,0,0,0|2,0,0]=4 28 B31R4.881494503 CC1=CC=C(N=C1)N2C(=CC(=C2C)C=C3NC(=O)N(C3=O)C4=CC=CC=C4)C MCULE-8095906617 [0,1,1,0,0,0|2,0,0]=4 29 B31R4.1413519940 CC1=CC(=C(N1C2=CC=CC=C2Cl)C)C=C3SC(=O)N(C3=O)C4=CC=CC=C4 MCULE-2271548962 [0,1,1,0,0,0|2,0,0]=4 30 B31R4.1413519940 CC1=CC=CC=C1N2C(=O)C(=CC3=C(N(C(=C3)C)C4=CC=CC=C4)C)SC2=S MCULE-8621184612 [0,1,1,0,0,0|2,0,0]=4 31 B31R4.2299293863 CC1=CC(=C(N1C2=CC(=CC=C2)F)C)C=C3SC(=O)N(C3=O)C4=CC=CC=C4 MCULE-7718845653 [0,1,1,0,0,0|2,0,0]=4 32 B31R4.2299293863 CC1=CC(=C(N1C2=CC=CC=C2)C)/C=C\3/SC(=S)N(C3=O)C4=CC=CC(=C4)Cl MCULE-7793770071 [0,1,1,0,0,0|2,0,0]=4 33 B31R4.2299293863 CC1=CC(=C(N1C2=CC=CC=C2)C)C=C3SC(=S)N(C3=O)C4=CC=CC(=C4)Cl MCULE-7312812163 [0,1,1,0,0,0|2,0,0]=4 34 B31R4.2299293863 CC1=CC(=C(N1C2=CC=CC=N2)C)C=C3NC(=O)N(C3=O)C4=CC=CC(=C4)Cl MCULE-9403280190 [0,1,1,0,0,0|2,0,0]=4 35 B31R4.2299293863 CC1=CC(=CC=C1)N2C(=CC(=C2C)C=C3SC(=O)N(C3=O)C4=CC=CC=C4)C MCULE-1521882385 [0,1,1,0,0,0|2,0,0]=4 36 B31R4.2299293863 CC1=CC=CC(=C1)N2C(=O)C(=CC3=C(N(C(=C3)C)C4=CC=CC=C4)C)SC2=S MCULE-9288942565 [0,1,1,0,0,0|2,0,0]=4 37 B31R4.2299293863 CC1=CC=NC(=C1)N2C(=CC(=C2C)C=C3NC(=O)N(C3=O)C4=CC=CC=C4)C MCULE-6234653958 [0,1,1,0,0,0|2,0,0]=4 38 B31R4.2299293863 CC1=CC=NC(=C1)N2C(=CC(=C2C)C=C3SC(=O)N(C3=O)C4=CC=CC=C4)C MCULE-1089819664 [0,1,1,0,0,0|1,0,0]=3 39 B31R4.345305556 CC1=CC(=C(N1C2=CC=CC=C2)C)C=C3S/C(=N/C4=CC=CC=C4Cl)/NC3=O MCULE-2518911161 [0,1,1,0,0,0|1,0,0]=3 40 B31R4.452879188 CC1=CC(=C(N1C2=CC=C(C=C2)Br)C)C=C3S/C(=N\C4=CC=CC=C4)/NC3=O MCULE-8335122366 [0,1,1,0,0,0|1,0,0]=3 41 B31R4.452879188 CC1=CC(=C(N1C2=CC=C(C=C2)Cl)C)C=C3S/C(=N/C4=CC=CC=C4)/NC3=O MCULE-5040363944 [0,1,1,0,0,0|1,0,0]=3 42 B31R4.452879188 CC1=CC(=C(N1C2=CC=C(C=C2)F)C)C=C3S/C(=N/C4=CC=CC=C4)/NC3=O MCULE-5411525041 [0,1,1,0,0,0|1,0,0]=3 43 B31R4.459605596 CC1=CC(=C(N1C2=CC=CC=C2)C)C=C3S/C(=N/C4=CC=C(C=C4)F)/NC3=O MCULE-3258381117 [0,1,1,0,0,0|1,0,0]=3 44 B31R4.459605596 CC1=CC(=C(N1C2=CC=NC=C2)C)C=C3S/C(=N\C4=CC=C(C=C4)Br)/NC3=O MCULE-9297983346 [0,1,1,0,0,0|2,0,0]=4 45 B31R4.459605596 CC1=CC(=C(N1C2=CC=NC=C2)C)C=C3S/C(=N\C4=CC=C(C=C4)F)/NC3=O MCULE-6589588366 [0,1,1,0,0,0|2,0,0]=4 46 B31R4.459605596 CC1=CC=C(C=C1)/N=C\2/NC(=O)C(=CC3=C(N(C(=C3)C)C4=CC=CN=C4)C)S2 MCULE-7838845849 [0,1,1,0,0,0|2,0,0]=4 47 B33R5.31704223 COC1=CC=CC=C1N2C(=CC(=C2C)C=C3SC4=NC5=CC=CC=C5N4C3=O)C MCULE-2396134422 [0,2,0,0,0,0|1,0,0]=3 48 B33R5.78491616 CC1=CC=CC(=C1N2C(=CC(=C2C)C=C3SC4=NC5=CC=CC=C5N4C3=O)C)C MCULE-4027172918 [0,2,0,0,0,0|1,0,0]=3 49 B33R5.212616467 CC1=CC(=C(C=C1)N2C(=CC(=C2C)C=C3SC4=NC5=CC=CC=C5N4C3=O)C)C MCULE-6622754571 [0,2,0,0,0,0|1,0,0]=3 50 B33R5.212723205 CC1=CC=C(C=C1N2C(=CC(=C2C)C=C3SC4=NC5=C(N4C3=O)C=CC=C5)C)Cl MCULE-1375955586 [0,2,0,0,0,0|1,0,0]=3 51 B33R5.49828402 CC1=CC(=C(N1C2=CC=C(C=C2)C#N)C)C=C3SC4=NC5=CC=CC=C5N4C3=O MCULE-6766712553 [0,2,0,0,0,0|1,0,0]=3 52 B33R5.49828402 COC1=CC=C(C=C1)N2C(=CC(=C2C)C=C3SC4=NC5=CC=CC=C5N4C3=O)C MCULE-6760554226 [0,2,0,0,0,0|1,0,0]=3 53 B33R5.382729194 CC1=CC(=C(N1C2=CC=C(C(=C2)Cl)Br)C)C=C3SC4=NC5=C(N4C3=O)C=CC=C5 MCULE-2055737909 [0,2,0,0,0,0|1,0,0]=3 54 B33R5.382729194 CC1=CC(=C(N1C2=CC=C(C(=C2)Cl)Cl)C)C=C3SC4=NC5=C(N4C3=O)C=CC=C5 MCULE-2679610186 [0,2,0,0,0,0|1,0,0]=3 55 B33R5.382729194 CC1=CC(=C(N1C2=CC=C(C(=C2)Cl)F)C)C=C3SC4=NC5=C(N4C3=O)C=CC=C5 MCULE-5708702153 [0,2,0,0,0,0|1,0,0]=3 56 B33R5.382729194 CC1=CC=C(C=C1C)N2C(=CC(=C2C)C=C3SC4=NC5=CC=CC=C5N4C3=O)C MCULE-6289468166 [0,2,0,0,0,0|1,0,0]=3 57 B33R5.188246476 CC1=CC(=C(N1C2=CC(=CC(=C2)Cl)Cl)C)C=C3SC4=NC5=C(N4C3=O)C=CC=C5 MCULE-2531244957 [0,2,0,0,0,0|1,0,0]=3 58 B29R4.68561733 CC1=CC(=C(N1C2=CC=CC=N2)C)C=C(C#N)C3=NC4=CC=CC=C4N3 MCULE-7967254599 [0,0,1,0,1,0|1,0,1]=4 59 B31R4.356265121 CC1=CC(=C(N1C2=CC=CC=C2)C)C=C3SC(=S)N(C3=O)CC4=CC=CC=C4 MCULE-4146161306 [0,0,1,0,0,1|2,0,0]=4 60 B31R4.356265121 CC1=CC(=C(N1C2=CC=CC=N2)C)C=C3NC(=O)N(C3=O)CC4=CC=CC=C4 MCULE-9604889734 [0,0,1,0,0,1|2,0,0]=4 61 B31R4.356265121 CC1=CC(=C(N1CC2=CC=CC=C2)C)C=C3SC(=O)N(C3=O)C4=CC=CC=C4 MCULE-9761131914 [0,0,1,0,0,1|2,0,0]=4