0 B31R4.16367030 CCc1ccc(cc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-57039626178 [0,0,0,0,0,0|4,0,0]=4 1 B31R4.16367030 CCc1ccc(cc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-60360824618 [0,0,0,0,0,0|4,0,0]=4 2 B31R4.16367030 CCc1ccc(cc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57222527242 [0,0,0,0,0,0|4,0,0]=4 3 B31R4.16367030 CCc1ccc(cc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-63309777854 [0,0,0,0,0,0|4,0,0]=4 4 B31R4.16367030 COc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CC=CCC4 AIFCHEM-60300172416 [0,0,0,0,0,0|2,0,2]=4 5 B31R4.16367030 COc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61904792189 [0,0,0,0,0,0|2,0,0]=2 6 B31R4.16367030 COc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-57039599360 [0,0,0,0,0,0|3,0,0]=3 7 B31R4.16367030 COc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-60360809240 [0,0,0,0,0,0|3,0,0]=3 8 B31R4.16367030 COc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57222511864 [0,0,0,0,0,0|3,0,0]=3 9 B31R4.16367030 COc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4COCCO4 AIFCHEM-63284641272 [0,0,0,0,0,0|4,0,0]=4 10 B31R4.16367030 COc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4SCCCS4 AIFCHEM-53197011785 [0,0,0,0,0,0|4,0,0]=4 11 B31R4.16367030 COc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CC=CCC4 AIFCHEM-61352655218 [0,0,0,0,0,0|2,0,2]=4 12 B31R4.16367030 COc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4COCCO4 AIFCHEM-54375094380 [0,0,0,0,0,0|4,0,0]=4 13 B31R4.16367030 COc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC=CCC4 AIFCHEM-61307673354 [0,0,0,0,0,0|2,0,2]=4 14 B31R4.16367030 COc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4COCCO4 AIFCHEM-52628981569 [0,0,0,0,0,0|4,0,0]=4 15 B31R4.16367030 COc1cc(ccc1C#N)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61907147424 [0,0,0,0,0,0|3,0,0]=3 16 B31R4.16367030 COc1cc(ccc1C#N)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-57040537995 [0,0,0,0,0,0|4,0,0]=4 17 B31R4.16367030 COc1cc(ccc1C#N)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-60363823204 [0,0,0,0,0,0|4,0,0]=4 18 B31R4.16367030 COc1cc(ccc1C#N)c2cnc3[nH]nc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57224220599 [0,0,0,0,0,0|4,0,0]=4 19 B31R4.16367030 COc1cc(ccc1C#N)c2cnc3[nH]nc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-63311114851 [0,0,0,0,0,0|4,0,0]=4 20 B31R4.16367030 COc1cc(ccc1CO)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61904870772 [0,0,0,0,0,0|4,0,0]=4 21 B31R4.16367030 COc1cc(ccc1SC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-100200357005 [0,0,0,0,0,0|3,1,0]=4 22 B31R4.16367030 COc1cc(ccc1SC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-99889762439 [0,0,0,0,0,0|3,1,0]=4 23 B31R4.16367030 COc1cc(ccc1SC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-100346288871 [0,0,0,0,0,0|3,1,0]=4 24 B31R4.16367030 COc1cc(ccc1SC)c2ccc3[nH]nc(c3c2)NC(=O)[C@H]4CCCOC4 AIFCHEM-95165245116 [0,0,0,0,0,0|3,1,0]=4 25 B31R4.16367030 COc1cc(cnc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-78990055508 [0,0,0,0,0,0|3,0,0]=3 26 B31R4.16367030 COc1cc(cnc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-74252960964 [0,0,0,0,0,0|4,0,0]=4 27 B31R4.16367030 COc1cc(cnc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-77644588626 [0,0,0,0,0,0|4,0,0]=4 28 B31R4.16367030 COc1cc(cnc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-74500065912 [0,0,0,0,0,0|4,0,0]=4 29 B31R4.16367030 COc1cc(cnc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-78092650260 [0,0,0,0,0,0|4,0,0]=4 30 B31R4.16367030 COc1cc(cnc1OC)c2ccc3ncc(n3c2)NC(=O)C4CCCCC4 AIFCHEM-61907360497 [0,0,0,0,0,0|3,0,1]=4 31 B31R4.16367030 COc1cc(cnc1OC)c2ccc3snc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-88168979615 [0,0,0,0,0,0|4,0,0]=4 32 B31R4.16367030 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CC=CCC4 AIFCHEM-60303525620 [0,0,0,0,0,0|1,0,2]=3 33 B31R4.16367030 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61907413293 [0,0,0,0,0,0|1,0,0]=1 34 B31R4.16367030 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-57040803864 [0,0,0,0,0,0|2,0,0]=2 35 B31R4.16367030 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-60364089073 [0,0,0,0,0,0|2,0,0]=2 36 B31R4.16367030 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57224486468 [0,0,0,0,0,0|2,0,0]=2 37 B31R4.16367030 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-63311402960 [0,0,0,0,0,0|2,0,0]=2 38 B31R4.16367030 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4COCCO4 AIFCHEM-63289001556 [0,0,0,0,0,0|3,0,0]=3 39 B31R4.16367030 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4SCCCS4 AIFCHEM-53198769669 [0,0,0,0,0,0|3,0,0]=3 40 B31R4.16367030 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CC=CCC4 AIFCHEM-61356677942 [0,0,0,0,0,0|1,0,2]=3 41 B31R4.16367030 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4COCCO4 AIFCHEM-54376854004 [0,0,0,0,0,0|3,0,0]=3 42 B31R4.16367030 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC=CCC4 AIFCHEM-61310504818 [0,0,0,0,0,0|1,0,2]=3 43 B31R4.16367030 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4COCCO4 AIFCHEM-52631431493 [0,0,0,0,0,0|3,0,0]=3 44 B31R4.16367030 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CC=CCC4 AIFCHEM-60303369321 [0,0,0,0,0,0|2,0,2]=4 45 B31R4.16367030 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61907256994 [0,0,0,0,0,0|2,0,0]=2 46 B31R4.16367030 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-57040647565 [0,0,0,0,0,0|3,0,0]=3 47 B31R4.16367030 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-60363932774 [0,0,0,0,0,0|3,0,0]=3 48 B31R4.16367030 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57224330169 [0,0,0,0,0,0|3,0,0]=3 49 B31R4.16367030 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-63311246661 [0,0,0,0,0,0|3,0,0]=3 50 B31R4.16367030 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4COCCO4 AIFCHEM-63288676297 [0,0,0,0,0,0|4,0,0]=4 51 B31R4.16367030 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4SCCCS4 AIFCHEM-53198613370 [0,0,0,0,0,0|4,0,0]=4 52 B31R4.16367030 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)[C@@H]4CC=CCC4 AIFCHEM-61356521643 [0,0,0,0,0,0|2,0,2]=4 53 B31R4.16367030 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)[C@@H]4COCCO4 AIFCHEM-54376697705 [0,0,0,0,0,0|4,0,0]=4 54 B31R4.16367030 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CC=CCC4 AIFCHEM-61310348519 [0,0,0,0,0,0|2,0,2]=4 55 B31R4.16367030 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4COCCO4 AIFCHEM-52631275194 [0,0,0,0,0,0|4,0,0]=4 56 B31R4.16367030 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CC=CCC4 AIFCHEM-60300275319 [0,0,0,0,0,0|2,0,2]=4 57 B31R4.16367030 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61904895092 [0,0,0,0,0,0|2,0,0]=2 58 B31R4.16367030 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-57039779043 [0,0,0,0,0,0|3,0,0]=3 59 B31R4.16367030 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-60360912143 [0,0,0,0,0,0|3,0,0]=3 60 B31R4.16367030 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57222614767 [0,0,0,0,0,0|3,0,0]=3 61 B31R4.16367030 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4COCCO4 AIFCHEM-63284744175 [0,0,0,0,0,0|4,0,0]=4 62 B31R4.16367030 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4SCCCS4 AIFCHEM-53197186948 [0,0,0,0,0,0|4,0,0]=4 63 B31R4.16367030 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CC=CCC4 AIFCHEM-61352782761 [0,0,0,0,0,0|2,0,2]=4 64 B31R4.16367030 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4COCCO4 AIFCHEM-54375197283 [0,0,0,0,0,0|4,0,0]=4 65 B31R4.16367030 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC=CCC4 AIFCHEM-61307776257 [0,0,0,0,0,0|2,0,2]=4 66 B31R4.16367030 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4COCCO4 AIFCHEM-52629084472 [0,0,0,0,0,0|4,0,0]=4 67 B31R4.16367030 COc1ccc(cc1C#N)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61909021820 [0,0,0,0,0,0|3,0,0]=3 68 B31R4.16367030 COc1ccc(cc1C#N)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-57041721131 [0,0,0,0,0,0|4,0,0]=4 69 B31R4.16367030 COc1ccc(cc1C#N)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-60365838780 [0,0,0,0,0,0|4,0,0]=4 70 B31R4.16367030 COc1ccc(cc1C#N)c2cnc3[nH]nc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57224903735 [0,0,0,0,0,0|4,0,0]=4 71 B31R4.16367030 COc1ccc(cc1C#N)c2cnc3[nH]nc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-63311820227 [0,0,0,0,0,0|4,0,0]=4 72 B31R4.16367030 COc1ccc(cc1CO)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-88186474431 [0,0,0,0,0,0|4,0,0]=4 73 B31R4.16367030 COc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)C4CC=CCC4 AIFCHEM-60303288907 [0,0,0,0,0,0|2,0,2]=4 74 B31R4.16367030 COc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61907176580 [0,0,0,0,0,0|2,0,0]=2 75 B31R4.16367030 COc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-57040567151 [0,0,0,0,0,0|3,0,0]=3 76 B31R4.16367030 COc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-60363852360 [0,0,0,0,0,0|3,0,0]=3 77 B31R4.16367030 COc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57224249755 [0,0,0,0,0,0|3,0,0]=3 78 B31R4.16367030 COc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-63311162487 [0,0,0,0,0,0|3,0,0]=3 79 B31R4.16367030 COc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)C4COCCO4 AIFCHEM-63288561463 [0,0,0,0,0,0|4,0,0]=4 80 B31R4.16367030 COc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)C4SCCCS4 AIFCHEM-53198532956 [0,0,0,0,0,0|4,0,0]=4 81 B31R4.16367030 COc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CC=CCC4 AIFCHEM-61356441229 [0,0,0,0,0,0|2,0,2]=4 82 B31R4.16367030 COc1ccc(cc1CO)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61904848600 [0,0,0,0,0,0|3,0,0]=3 83 B31R4.16367030 COc1ccc(cc1CO)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-57039697511 [0,0,0,0,0,0|4,0,0]=4 84 B31R4.16367030 COc1ccc(cc1CO)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-60360865651 [0,0,0,0,0,0|4,0,0]=4 85 B31R4.16367030 COc1ccc(cc1CO)c2cnc3[nH]nc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57222568275 [0,0,0,0,0,0|4,0,0]=4 86 B31R4.16367030 COc1ccc(cc1CO)c2cnc3[nH]nc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-63309818887 [0,0,0,0,0,0|4,0,0]=4 87 B31R4.16367030 COc1ccc(cc1OC)c2ccc3c(c2)C(CO3)NC(=O)C4CCCCC4 AIFCHEM-61904791942 [0,0,0,0,0,0|2,0,2]=4 88 B31R4.16367030 COc1ccc(cc1OC)c2ccc3ncc(n3c2)NC(=O)C4CCCCC4 AIFCHEM-61909095916 [0,0,0,0,0,0|2,0,1]=3 89 B31R4.16367030 COc1ccc(cc1OC)c2ccc3ncc(n3c2)NC(=O)C4CCCCO4 AIFCHEM-57041795227 [0,0,0,0,0,0|3,0,1]=4 90 B31R4.16367030 COc1ccc(cc1OC)c2ccc3ncc(n3c2)NC(=O)C4CCCOC4 AIFCHEM-60365912876 [0,0,0,0,0,0|3,0,1]=4 91 B31R4.16367030 COc1ccc(cc1OC)c2ccc3ncc(n3c2)NC(=O)C4CCOCC4 AIFCHEM-57224977831 [0,0,0,0,0,0|3,0,1]=4 92 B31R4.16367030 COc1ccc(cc1OC)c2ccc3ncc(n3c2)NC(=O)C4CCSCC4 AIFCHEM-63311894323 [0,0,0,0,0,0|3,0,1]=4 93 B31R4.16367030 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CC=CCC4 AIFCHEM-60303435540 [0,0,0,0,0,0|0,0,2]=2 94 B31R4.16367030 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61907323213 [0,0,0,0,0,0|0,0,0]=0 95 B31R4.16367030 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-57040713784 [0,0,0,0,0,0|1,0,0]=1 96 B31R4.16367030 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-60363998993 [0,0,0,0,0,0|1,0,0]=1 97 B31R4.16367030 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57224396388 [0,0,0,0,0,0|1,0,0]=1 98 B31R4.16367030 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-63311312880 [0,0,0,0,0,0|1,0,0]=1 99 B31R4.16367030 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4COCCO4 AIFCHEM-63288818656 [0,0,0,0,0,0|2,0,0]=2 100 B31R4.16367030 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4SCCCS4 AIFCHEM-53198679589 [0,0,0,0,0,0|2,0,0]=2 101 B31R4.16367030 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CC=CCC4 AIFCHEM-61356587862 [0,0,0,0,0,0|0,0,2]=2 102 B31R4.16367030 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4COCCO4 AIFCHEM-54376763924 [0,0,0,0,0,0|2,0,0]=2 103 B31R4.16367030 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC=CCC4 AIFCHEM-61310414738 [0,0,0,0,0,0|0,0,2]=2 104 B31R4.16367030 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4COCCO4 AIFCHEM-52631341413 [0,0,0,0,0,0|2,0,0]=2 105 B31R4.16367030 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61909071952 [0,0,0,0,0,0|1,0,0]=1 106 B31R4.16367030 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-57041771263 [0,0,0,0,0,0|2,0,0]=2 107 B31R4.16367030 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-60365888912 [0,0,0,0,0,0|2,0,0]=2 108 B31R4.16367030 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57224953867 [0,0,0,0,0,0|2,0,0]=2 109 B31R4.16367030 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-63311870359 [0,0,0,0,0,0|2,0,0]=2 110 B31R4.16367030 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4COCCO4 AIFCHEM-63290430595 [0,0,0,0,0,0|3,0,0]=3 111 B31R4.16367030 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4SCCCS4 AIFCHEM-53199116928 [0,0,0,0,0,0|3,0,0]=3 112 B31R4.16367030 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)[C@@H]4CC=CCC4 AIFCHEM-61358524521 [0,0,0,0,0,0|1,0,2]=3 113 B31R4.16367030 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)[C@@H]4COCCO4 AIFCHEM-54377321403 [0,0,0,0,0,0|3,0,0]=3 114 B31R4.16367030 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CC=CCC4 AIFCHEM-61312683257 [0,0,0,0,0,0|1,0,2]=3 115 B31R4.16367030 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4COCCO4 AIFCHEM-52632066452 [0,0,0,0,0,0|3,0,0]=3 116 B31R4.16367030 COc1ccc(cc1SC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-90181157163 [0,0,0,0,0,0|3,1,0]=4 117 B31R4.16367030 COc1ccc(cc1SC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-85438215373 [0,0,0,0,0,0|3,1,0]=4 118 B31R4.16367030 COc1ccc(cc1SC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-81761013260 [0,0,0,0,0,0|3,1,0]=4 119 B31R4.16367030 COc1ccc(cc1SC)c2ccc3[nH]nc(c3c2)NC(=O)[C@H]4CCCOC4 AIFCHEM-82019695112 [0,0,0,0,0,0|3,1,0]=4 120 B31R4.16367030 COc1ccc(nc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61904860887 [0,0,0,0,0,0|3,0,0]=3 121 B31R4.16367030 COc1ccc(nc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-57039718998 [0,0,0,0,0,0|4,0,0]=4 122 B31R4.16367030 COc1ccc(nc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-60360877938 [0,0,0,0,0,0|4,0,0]=4 123 B31R4.16367030 COc1ccc(nc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57222580562 [0,0,0,0,0,0|4,0,0]=4 124 B31R4.16367030 COc1ncc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-78990070058 [0,0,0,0,0,0|3,0,0]=3 125 B31R4.16367030 COc1ncc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-77644613776 [0,0,0,0,0,0|4,0,0]=4 126 B31R4.16367030 COc1ncc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-74500080462 [0,0,0,0,0,0|4,0,0]=4 127 B31R4.16367030 COc1ncc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-78092679090 [0,0,0,0,0,0|4,0,0]=4 128 B31R4.16367030 COc1ncc(cc1C#N)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61907230986 [0,0,0,0,0,0|4,0,0]=4 129 B31R4.16367030 COc1ncc(nc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61904717622 [0,0,0,0,0,0|4,0,0]=4 130 B30R4.11021083 COc1ccc(cc1C)c2ccc3ncc(n3c2)NC(=O)C4CCCCC4 AIFCHEM-61904823910 [1,0,0,0,0,0|2,0,1]=4 131 B30R4.11021083 COc1ccc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CC=CCC4 AIFCHEM-60299985450 [1,0,0,0,0,0|0,0,2]=3 132 B30R4.11021083 COc1ccc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-57039358954 [1,0,0,0,0,0|1,0,0]=2 133 B30R4.11021083 COc1ccc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-60360622274 [1,0,0,0,0,0|1,0,0]=2 134 B30R4.11021083 COc1ccc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57222324898 [1,0,0,0,0,0|1,0,0]=2 135 B30R4.11021083 COc1ccc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-63309575510 [1,0,0,0,0,0|1,0,0]=2 136 B30R4.11021083 COc1ccc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4COCCO4 AIFCHEM-63284409586 [1,0,0,0,0,0|2,0,0]=3 137 B30R4.11021083 COc1ccc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4SCCCS4 AIFCHEM-53196796699 [1,0,0,0,0,0|2,0,0]=3 138 B30R4.11021083 COc1ccc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CC=CCC4 AIFCHEM-61352468252 [1,0,0,0,0,0|0,0,2]=3 139 B30R4.11021083 COc1ccc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4COCCO4 AIFCHEM-54374907414 [1,0,0,0,0,0|2,0,0]=3 140 B30R4.11021083 COc1ccc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC=CCC4 AIFCHEM-61307464348 [1,0,0,0,0,0|0,0,2]=3 141 B30R4.11021083 COc1ccc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4COCCO4 AIFCHEM-52628794603 [1,0,0,0,0,0|2,0,0]=3 142 B30R4.11021083 COc1ccc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CC=CCC4 AIFCHEM-60300059254 [1,0,0,0,0,0|1,0,2]=4 143 B30R4.11021083 COc1ccc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61904679027 [1,0,0,0,0,0|1,0,0]=2 144 B30R4.11021083 COc1ccc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-57039432758 [1,0,0,0,0,0|2,0,0]=3 145 B30R4.11021083 COc1ccc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-60360696078 [1,0,0,0,0,0|2,0,0]=3 146 B30R4.11021083 COc1ccc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57222398702 [1,0,0,0,0,0|2,0,0]=3 147 B30R4.11021083 COc1ccc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-63309649314 [1,0,0,0,0,0|2,0,0]=3 148 B30R4.11021083 COc1ccc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4COCCO4 AIFCHEM-63284528110 [1,0,0,0,0,0|3,0,0]=4 149 B30R4.11021083 COc1ccc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4SCCCS4 AIFCHEM-53196870503 [1,0,0,0,0,0|3,0,0]=4 150 B30R4.11021083 COc1ccc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)[C@@H]4CC=CCC4 AIFCHEM-61352542056 [1,0,0,0,0,0|1,0,2]=4 151 B30R4.11021083 COc1ccc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CC=CCC4 AIFCHEM-61307538152 [1,0,0,0,0,0|1,0,2]=4 152 B30R4.11021083 COc1ccc(cc1F)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61904503333 [1,0,0,0,0,0|2,0,0]=3 153 B30R4.11021083 COc1ccc(cc1F)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-57039257064 [1,0,0,0,0,0|3,0,0]=4 154 B30R4.11021083 COc1ccc(cc1F)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-60360520384 [1,0,0,0,0,0|3,0,0]=4 155 B30R4.11021083 COc1ccc(cc1F)c2cnc3[nH]nc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57222223008 [1,0,0,0,0,0|3,0,0]=4 156 B30R4.11021083 COc1ccc(cc1F)c2cnc3[nH]nc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-63309473620 [1,0,0,0,0,0|3,0,0]=4 157 B30R4.11021083 COc1ccc(cc1O)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-88179248707 [1,0,0,0,0,0|2,0,0]=3 158 B30R4.11021083 COc1ccc(cc1O)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-90180888588 [1,0,0,0,0,0|3,0,0]=4 159 B30R4.11021083 COc1ccc(cc1O)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-85437836638 [1,0,0,0,0,0|3,0,0]=4 160 B30R4.11021083 COc1ccc(cc1O)c2ccc3[nH]nc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-81760622605 [1,0,0,0,0,0|3,0,0]=4 161 B30R4.11021083 COc1ccc(cc1O)c2ccc3[nH]nc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-86081501884 [1,0,0,0,0,0|3,0,0]=4 162 B30R4.11021083 COc1ccc(cc1O)c2ccc3[nH]nc(c3c2)NC(=O)[C@H]4CCCOC4 AIFCHEM-82019260797 [1,0,0,0,0,0|3,0,0]=4 163 B30R4.11021083 COc1ccc(cc1O)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61904611118 [1,0,0,0,0,0|0,0,0]=1 164 B30R4.11021083 COc1ccc(cc1O)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-57039364849 [1,0,0,0,0,0|1,0,0]=2 165 B30R4.11021083 COc1ccc(cc1O)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-60360628169 [1,0,0,0,0,0|1,0,0]=2 166 B30R4.11021083 COc1ccc(cc1O)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57222330793 [1,0,0,0,0,0|1,0,0]=2 167 B30R4.11021083 COc1ccc(cc1O)c2cnc3[nH]cc(c3c2)NC(=O)C4SCCCS4 AIFCHEM-53196802594 [1,0,0,0,0,0|2,0,0]=3 168 B30R4.11021083 COc1ccc(cc1O)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61904742247 [1,0,0,0,0,0|1,0,0]=2 169 B30R4.11021083 COc1ccc(cc1O)c2cnc3[nH]nc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57222461922 [1,0,0,0,0,0|2,0,0]=3 170 B30R4.11021083 COc1ccc(cc1O)c2cnc3[nH]nc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-63309712534 [1,0,0,0,0,0|2,0,0]=3 171 B30R4.11021083 COc1ccc(nc1C)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-88169156336 [1,0,0,0,0,0|3,0,0]=4 172 B30R4.11021083 COc1ncc(cc1C)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-78989634764 [1,0,0,0,0,0|3,0,0]=4 173 B30R4.11021083 COc1ncc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CC=CCC4 AIFCHEM-60303541642 [1,0,0,0,0,0|1,0,2]=4 174 B30R4.11021083 COc1ncc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61907429315 [1,0,0,0,0,0|1,0,0]=2 175 B30R4.11021083 COc1ncc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-57040819886 [1,0,0,0,0,0|2,0,0]=3 176 B30R4.11021083 COc1ncc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-60364105095 [1,0,0,0,0,0|2,0,0]=3 177 B30R4.11021083 COc1ncc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57224502490 [1,0,0,0,0,0|2,0,0]=3 178 B30R4.11021083 COc1ncc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-63311418982 [1,0,0,0,0,0|2,0,0]=3 179 B30R4.11021083 COc1ncc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4COCCO4 AIFCHEM-63289035378 [1,0,0,0,0,0|3,0,0]=4 180 B30R4.11021083 COc1ncc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4SCCCS4 AIFCHEM-53198785691 [1,0,0,0,0,0|3,0,0]=4 181 B30R4.11021083 COc1ncc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CC=CCC4 AIFCHEM-61356693964 [1,0,0,0,0,0|1,0,2]=4 182 B30R4.11021083 COc1ncc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4COCCO4 AIFCHEM-54376870026 [1,0,0,0,0,0|3,0,0]=4 183 B30R4.11021083 COc1ncc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC=CCC4 AIFCHEM-61310520840 [1,0,0,0,0,0|1,0,2]=4 184 B30R4.11021083 COc1ncc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61907225579 [1,0,0,0,0,0|2,0,0]=3 185 B30R4.11021083 COc1ncc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-57040616150 [1,0,0,0,0,0|3,0,0]=4 186 B30R4.11021083 COc1ncc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-60363901359 [1,0,0,0,0,0|3,0,0]=4 187 B30R4.11021083 COc1ncc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57224298754 [1,0,0,0,0,0|3,0,0]=4 188 B30R4.11021083 COc1ncc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-63311215246 [1,0,0,0,0,0|3,0,0]=4 189 B30R4.11021083 COc1ncc(cc1O)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61904505104 [1,0,0,0,0,0|3,0,0]=4 190 B30R4.11021083 CSc1ccc(cc1C)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-98027764121 [1,0,0,0,0,0|2,1,0]=4 191 B30R4.11021083 CSc1ccc(cc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-74251313615 [1,0,0,0,0,0|2,1,0]=4 192 B30R4.11021083 CSc1ccc(cc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-77642252237 [1,0,0,0,0,0|2,1,0]=4 193 B30R4.11021083 CSc1ccc(cc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-74499112123 [1,0,0,0,0,0|2,1,0]=4 194 B30R4.11021083 CSc1ccc(cc1F)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61909095634 [1,0,0,0,0,0|2,1,0]=4 195 B30R4.11021083 Cc1cc(ccc1C#N)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-42224788599 [1,0,0,0,0,0|3,0,0]=4 196 B30R4.11021083 Cc1cc(ccc1CO)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61909092869 [1,0,0,0,0,0|2,0,0]=3 197 B30R4.11021083 Cc1cc(ccc1CO)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-60365909829 [1,0,0,0,0,0|3,0,0]=4 198 B30R4.11021083 Cc1cc(ccc1CO)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57224974784 [1,0,0,0,0,0|3,0,0]=4 199 B30R4.11021083 Cc1cc(ccc1CO)c2cnc3[nH]cc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-63311891276 [1,0,0,0,0,0|3,0,0]=4 200 B30R4.11021083 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc(c(c3)F)CO)C4CCCCC4 AIFCHEM-61908988373 [1,0,0,0,0,0|3,0,0]=4 201 B30R4.12220693 CCc1cc(ccc1O)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-98027944514 [1,0,0,0,0,0|1,0,0]=2 202 B30R4.12220693 CCc1cc(ccc1O)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-100346482926 [1,0,0,0,0,0|2,0,0]=3 203 B30R4.12220693 CCc1cc(ccc1O)c2cnc3[nH]cc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-97367003440 [1,0,0,0,0,0|2,0,0]=3 204 B30R4.12220693 COc1cc(ccc1C)c2ccc3ncc(n3c2)NC(=O)C4CCCCC4 AIFCHEM-61907077412 [1,0,0,0,0,0|2,0,1]=4 205 B30R4.12220693 COc1cc(ccc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CC=CCC4 AIFCHEM-60303617836 [1,0,0,0,0,0|0,0,2]=3 206 B30R4.12220693 COc1cc(ccc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-57040896080 [1,0,0,0,0,0|1,0,0]=2 207 B30R4.12220693 COc1cc(ccc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-60364181289 [1,0,0,0,0,0|1,0,0]=2 208 B30R4.12220693 COc1cc(ccc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57224578684 [1,0,0,0,0,0|1,0,0]=2 209 B30R4.12220693 COc1cc(ccc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-63311495176 [1,0,0,0,0,0|1,0,0]=2 210 B30R4.12220693 COc1cc(ccc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4COCCO4 AIFCHEM-63289197732 [1,0,0,0,0,0|2,0,0]=3 211 B30R4.12220693 COc1cc(ccc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4SCCCS4 AIFCHEM-53198861885 [1,0,0,0,0,0|2,0,0]=3 212 B30R4.12220693 COc1cc(ccc1C)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CC=CCC4 AIFCHEM-61356770158 [1,0,0,0,0,0|0,0,2]=3 213 B30R4.12220693 COc1cc(ccc1C)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4COCCO4 AIFCHEM-54376946220 [1,0,0,0,0,0|2,0,0]=3 214 B30R4.12220693 COc1cc(ccc1C)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC=CCC4 AIFCHEM-61310597034 [1,0,0,0,0,0|0,0,2]=3 215 B30R4.12220693 COc1cc(ccc1C)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4COCCO4 AIFCHEM-52631523709 [1,0,0,0,0,0|2,0,0]=3 216 B30R4.12220693 COc1cc(ccc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CC=CCC4 AIFCHEM-60300089700 [1,0,0,0,0,0|1,0,2]=4 217 B30R4.12220693 COc1cc(ccc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61904709473 [1,0,0,0,0,0|1,0,0]=2 218 B30R4.12220693 COc1cc(ccc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-57039463204 [1,0,0,0,0,0|2,0,0]=3 219 B30R4.12220693 COc1cc(ccc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-60360726524 [1,0,0,0,0,0|2,0,0]=3 220 B30R4.12220693 COc1cc(ccc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57222429148 [1,0,0,0,0,0|2,0,0]=3 221 B30R4.12220693 COc1cc(ccc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-63309679760 [1,0,0,0,0,0|2,0,0]=3 222 B30R4.12220693 COc1cc(ccc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4COCCO4 AIFCHEM-63284558556 [1,0,0,0,0,0|3,0,0]=4 223 B30R4.12220693 COc1cc(ccc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4SCCCS4 AIFCHEM-53196900949 [1,0,0,0,0,0|3,0,0]=4 224 B30R4.12220693 COc1cc(ccc1C)c2cnc3[nH]nc(c3c2)NC(=O)[C@@H]4CC=CCC4 AIFCHEM-61352572502 [1,0,0,0,0,0|1,0,2]=4 225 B30R4.12220693 COc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CC=CCC4 AIFCHEM-60300218397 [1,0,0,0,0,0|1,0,2]=4 226 B30R4.12220693 COc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61904838170 [1,0,0,0,0,0|1,0,0]=2 227 B30R4.12220693 COc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-57039679261 [1,0,0,0,0,0|2,0,0]=3 228 B30R4.12220693 COc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-60360855221 [1,0,0,0,0,0|2,0,0]=3 229 B30R4.12220693 COc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57222557845 [1,0,0,0,0,0|2,0,0]=3 230 B30R4.12220693 COc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-63309808457 [1,0,0,0,0,0|2,0,0]=3 231 B30R4.12220693 COc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4COCCO4 AIFCHEM-63284687253 [1,0,0,0,0,0|3,0,0]=4 232 B30R4.12220693 COc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4SCCCS4 AIFCHEM-53197089246 [1,0,0,0,0,0|3,0,0]=4 233 B30R4.12220693 COc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CC=CCC4 AIFCHEM-61352701199 [1,0,0,0,0,0|1,0,2]=4 234 B30R4.12220693 COc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4COCCO4 AIFCHEM-54375140361 [1,0,0,0,0,0|3,0,0]=4 235 B30R4.12220693 COc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC=CCC4 AIFCHEM-61307719335 [1,0,0,0,0,0|1,0,2]=4 236 B30R4.12220693 COc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4COCCO4 AIFCHEM-52629027550 [1,0,0,0,0,0|3,0,0]=4 237 B30R4.12220693 COc1cc(ccc1F)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61904597759 [1,0,0,0,0,0|2,0,0]=3 238 B30R4.12220693 COc1cc(ccc1F)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-57039351490 [1,0,0,0,0,0|3,0,0]=4 239 B30R4.12220693 COc1cc(ccc1F)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-60360614810 [1,0,0,0,0,0|3,0,0]=4 240 B30R4.12220693 COc1cc(ccc1F)c2cnc3[nH]nc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57222317434 [1,0,0,0,0,0|3,0,0]=4 241 B30R4.12220693 COc1cc(ccc1O)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-88179692072 [1,0,0,0,0,0|2,0,0]=3 242 B30R4.12220693 COc1cc(ccc1O)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-90181292133 [1,0,0,0,0,0|3,0,0]=4 243 B30R4.12220693 COc1cc(ccc1O)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-85438356103 [1,0,0,0,0,0|3,0,0]=4 244 B30R4.12220693 COc1cc(ccc1O)c2ccc3[nH]nc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-81761082810 [1,0,0,0,0,0|3,0,0]=4 245 B30R4.12220693 COc1cc(ccc1O)c2ccc3[nH]nc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-86082654789 [1,0,0,0,0,0|3,0,0]=4 246 B30R4.12220693 COc1cc(ccc1O)c2ccc3[nH]nc(c3c2)NC(=O)[C@H]4CCCOC4 AIFCHEM-82019849682 [1,0,0,0,0,0|3,0,0]=4 247 B30R4.12220693 COc1cc(ccc1O)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61909117185 [1,0,0,0,0,0|0,0,0]=1 248 B30R4.12220693 COc1cc(ccc1O)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-57041816496 [1,0,0,0,0,0|1,0,0]=2 249 B30R4.12220693 COc1cc(ccc1O)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-60365934145 [1,0,0,0,0,0|1,0,0]=2 250 B30R4.12220693 COc1cc(ccc1O)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57224999100 [1,0,0,0,0,0|1,0,0]=2 251 B30R4.12220693 COc1cc(ccc1O)c2cnc3[nH]cc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-63311915592 [1,0,0,0,0,0|1,0,0]=2 252 B30R4.12220693 COc1cc(ccc1O)c2cnc3[nH]cc(c3c2)NC(=O)C4SCCCS4 AIFCHEM-53199162161 [1,0,0,0,0,0|2,0,0]=3 253 B30R4.12220693 COc1cc(ccc1O)c2cnc3[nH]nc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57224857032 [1,0,0,0,0,0|2,0,0]=3 254 B30R4.12220693 COc1cc(ccc1O)c2cnc3[nH]nc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-63311773524 [1,0,0,0,0,0|2,0,0]=3 255 B30R4.12220693 COc1nc(ccc1O)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61907148828 [1,0,0,0,0,0|3,0,0]=4 256 B30R4.12220693 CSc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-74251612270 [1,0,0,0,0,0|2,1,0]=4 257 B30R4.12220693 CSc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-77642495312 [1,0,0,0,0,0|2,1,0]=4 258 B30R4.12220693 CSc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-74499254038 [1,0,0,0,0,0|2,1,0]=4 259 B30R4.12220693 CSc1cc(ccc1F)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61908963397 [1,0,0,0,0,0|2,1,0]=4 260 B30R4.12220693 Cc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-42227388818 [1,0,0,0,0,0|2,0,0]=3 261 B30R4.12220693 Cc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-39086725094 [1,0,0,0,0,0|3,0,0]=4 262 B30R4.12220693 Cc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-44971637028 [1,0,0,0,0,0|3,0,0]=4 263 B30R4.12220693 Cc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-46592428928 [1,0,0,0,0,0|3,0,0]=4 264 B30R4.12220693 Cc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-39911518088 [1,0,0,0,0,0|3,0,0]=4 265 B30R4.12220693 Cc1ccc(cc1C#N)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-42227527844 [1,0,0,0,0,0|3,0,0]=4 266 B30R4.12220693 Cc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61904804240 [1,0,0,0,0,0|2,0,0]=3 267 B30R4.12220693 Cc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-60360821291 [1,0,0,0,0,0|3,0,0]=4 268 B30R4.12220693 Cc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57222523915 [1,0,0,0,0,0|3,0,0]=4 269 B30R4.12220693 Cc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-63309774527 [1,0,0,0,0,0|3,0,0]=4 270 B30R4.12220693 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc(c(c3)CO)F)C4CCCCC4 AIFCHEM-61907436231 [1,0,0,0,0,0|3,0,0]=4 271 B32R4.15669696 COc1cc(ccc1C#N)c2cnc3c(c2)c(nn3C)NC(=O)C4CCCCC4 AIFCHEM-78987422710 [0,1,0,0,0,0|3,0,0]=4 272 B32R4.15669696 COc1cc(cnc1OC)c2ccc3c(c2)c(nn3C)NC(=O)C4CCCCC4 AIFCHEM-88178884512 [0,1,0,0,0,0|3,0,0]=4 273 B32R4.15669696 COc1cc(cnc1OC)c2cnc3c(c2)c(nn3C)NC(=O)C4CCCCC4 AIFCHEM-88186871358 [0,1,0,0,0,0|2,0,0]=3 274 B32R4.15669696 COc1cc(cnc1OC)c2cnc3c(c2)c(nn3C)NC(=O)C4CCCCO4 AIFCHEM-90188864999 [0,1,0,0,0,0|3,0,0]=4 275 B32R4.15669696 COc1cc(cnc1OC)c2cnc3c(c2)c(nn3C)NC(=O)C4CCCOC4 AIFCHEM-85441497069 [0,1,0,0,0,0|3,0,0]=4 276 B32R4.15669696 COc1cc(cnc1OC)c2cnc3c(c2)c(nn3C)NC(=O)C4CCOCC4 AIFCHEM-81766969316 [0,1,0,0,0,0|3,0,0]=4 277 B32R4.15669696 COc1cc(cnc1OC)c2cnc3c(c2)c(nn3C)NC(=O)C4CCSCC4 AIFCHEM-86087706835 [0,1,0,0,0,0|3,0,0]=4 278 B32R4.15669696 COc1cc(cnc1OC)c2cnc3c(c2)c(nn3C)NC(=O)[C@H]4CCCOC4 AIFCHEM-82025065528 [0,1,0,0,0,0|3,0,0]=4 279 B32R4.15669696 COc1ccc(cc1C#N)c2cnc3c(c2)c(nn3C)NC(=O)C4CCCCC4 AIFCHEM-78987445432 [0,1,0,0,0,0|3,0,0]=4 280 B32R4.15669696 COc1ccc(cc1CO)c2cnc3c(c2)c(nn3C)NC(=O)C4CCCCC4 AIFCHEM-78987333809 [0,1,0,0,0,0|3,0,0]=4 281 B32R4.15669696 COc1ccc(cc1OC)c2cnc3c(c2)c(nn3C)NC(=O)C4CC=CCC4 AIFCHEM-73869119197 [0,1,0,0,0,0|1,0,2]=4 282 B32R4.15669696 COc1ccc(cc1OC)c2cnc3c(c2)c(nn3C)NC(=O)C4CCCCC4 AIFCHEM-78987372605 [0,1,0,0,0,0|1,0,0]=2 283 B32R4.15669696 COc1ccc(cc1OC)c2cnc3c(c2)c(nn3C)NC(=O)C4CCCCO4 AIFCHEM-74246765001 [0,1,0,0,0,0|2,0,0]=3 284 B32R4.15669696 COc1ccc(cc1OC)c2cnc3c(c2)c(nn3C)NC(=O)C4CCCOC4 AIFCHEM-77637739143 [0,1,0,0,0,0|2,0,0]=3 285 B32R4.15669696 COc1ccc(cc1OC)c2cnc3c(c2)c(nn3C)NC(=O)C4CCOCC4 AIFCHEM-74495197929 [0,1,0,0,0,0|2,0,0]=3 286 B32R4.15669696 COc1ccc(cc1OC)c2cnc3c(c2)c(nn3C)NC(=O)C4CCSCC4 AIFCHEM-78088381297 [0,1,0,0,0,0|2,0,0]=3 287 B32R4.15669696 COc1ccc(cc1OC)c2cnc3c(c2)c(nn3C)NC(=O)C4COCCO4 AIFCHEM-78126626261 [0,1,0,0,0,0|3,0,0]=4 288 B32R4.15669696 COc1ccc(cc1OC)c2cnc3c(c2)c(nn3C)NC(=O)C4SCCCS4 AIFCHEM-69977152354 [0,1,0,0,0,0|3,0,0]=4 289 B32R4.15669696 COc1ccc(cc1OC)c2cnc3c(c2)c(nn3C)NC(=O)[C@@H]4CC=CCC4 AIFCHEM-74863127292 [0,1,0,0,0,0|1,0,2]=4 290 B32R4.15669696 COc1ccc(cc1OC)c2cnc3c(c2)c(nn3C)NC(=O)[C@H]4CC=CCC4 AIFCHEM-74868803875 [0,1,0,0,0,0|1,0,2]=4 291 B32R4.15669938 COc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC(CC4)C AIFCHEM-59989985820 [0,1,0,0,0,0|2,0,0]=3 292 B32R4.15669938 COc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)C AIFCHEM-50896295475 [0,1,0,0,0,0|2,0,0]=3 293 B32R4.15669938 COc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC[C@H](CC4)O AIFCHEM-59275951973 [0,1,0,0,0,0|2,0,0]=3 294 B32R4.15669938 COc1cc(ccc1C#N)c2cnc3[nH]nc(c3c2)NC(=O)C4CCC(CC4)C AIFCHEM-59992625215 [0,1,0,0,0,0|3,0,0]=4 295 B32R4.15669938 COc1cc(ccc1C#N)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)C AIFCHEM-50897743770 [0,1,0,0,0,0|3,0,0]=4 296 B32R4.15669938 COc1cc(ccc1SC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCC(CC4)O AIFCHEM-97201402320 [0,1,0,0,0,0|2,1,0]=4 297 B32R4.15669938 COc1cc(ccc1SC)c2ccc3[nH]nc(c3c2)NC(=O)[C@H]4CC[C@H](CC4)O AIFCHEM-100139893044 [0,1,0,0,0,0|2,1,0]=4 298 B32R4.15669938 COc1cc(cnc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCC(CC4)C AIFCHEM-73503158966 [0,1,0,0,0,0|3,0,0]=4 299 B32R4.15669938 COc1cc(cnc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCC(CC4)O AIFCHEM-68824909457 [0,1,0,0,0,0|3,0,0]=4 300 B32R4.15669938 COc1cc(cnc1OC)c2ccc3[nH]nc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)C AIFCHEM-66424608458 [0,1,0,0,0,0|3,0,0]=4 301 B32R4.15669938 COc1cc(cnc1OC)c2ccc3[nH]nc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)O AIFCHEM-72794140877 [0,1,0,0,0,0|3,0,0]=4 302 B32R4.15669938 COc1cc(cnc1OC)c2ccc3[nH]nc(c3c2)NC(=O)[C@H]4CC[C@H](CC4)O AIFCHEM-72757400458 [0,1,0,0,0,0|3,0,0]=4 303 B32R4.15669938 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CC=C(CC4)C AIFCHEM-59963521387 [0,1,0,0,0,0|1,0,2]=4 304 B32R4.15669938 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC(=O)CC4 AIFCHEM-60329671537 [0,1,0,0,0,0|1,0,1]=3 305 B32R4.15669938 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC(=O)NC4 AIFCHEM-53906443945 [0,1,0,0,0,0|2,0,1]=4 306 B32R4.15669938 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC(CC4)C AIFCHEM-59993128664 [0,1,0,0,0,0|1,0,0]=2 307 B32R4.15669938 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC(CC4)O AIFCHEM-52079392806 [0,1,0,0,0,0|1,0,0]=2 308 B32R4.15669938 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)C AIFCHEM-50898009639 [0,1,0,0,0,0|1,0,0]=2 309 B32R4.15669938 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)O AIFCHEM-59265759122 [0,1,0,0,0,0|1,0,0]=2 310 B32R4.15669938 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC[C@H](CC4)O AIFCHEM-59279672617 [0,1,0,0,0,0|1,0,0]=2 311 B32R4.15669938 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCC(CC4)C AIFCHEM-59992869965 [0,1,0,0,0,0|2,0,0]=3 312 B32R4.15669938 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCC(CC4)O AIFCHEM-52079236507 [0,1,0,0,0,0|2,0,0]=3 313 B32R4.15669938 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)C AIFCHEM-50897853340 [0,1,0,0,0,0|2,0,0]=3 314 B32R4.15669938 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CC[C@H](CC4)O AIFCHEM-59279359638 [0,1,0,0,0,0|2,0,0]=3 315 B32R4.15669938 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC(CC4)C AIFCHEM-59990088723 [0,1,0,0,0,0|2,0,0]=3 316 B32R4.15669938 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC(CC4)O AIFCHEM-52078281525 [0,1,0,0,0,0|2,0,0]=3 317 B32R4.15669938 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)C AIFCHEM-50896398378 [0,1,0,0,0,0|2,0,0]=3 318 B32R4.15669938 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC[C@H](CC4)O AIFCHEM-59276076156 [0,1,0,0,0,0|2,0,0]=3 319 B32R4.15669938 COc1ccc(cc1C#N)c2cnc3[nH]nc(c3c2)NC(=O)C4CCC(CC4)C AIFCHEM-59994479831 [0,1,0,0,0,0|3,0,0]=4 320 B32R4.15669938 COc1ccc(cc1C#N)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)C AIFCHEM-50898426926 [0,1,0,0,0,0|3,0,0]=4 321 B32R4.15669938 COc1ccc(cc1C#N)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CC[C@H](CC4)O AIFCHEM-59281551204 [0,1,0,0,0,0|3,0,0]=4 322 B32R4.15669938 COc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC(CC4)C AIFCHEM-59992676351 [0,1,0,0,0,0|2,0,0]=3 323 B32R4.15669938 COc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)C AIFCHEM-50897772926 [0,1,0,0,0,0|2,0,0]=3 324 B32R4.15669938 COc1ccc(cc1CO)c2cnc3[nH]nc(c3c2)NC(=O)C4CCC(CC4)C AIFCHEM-59990042231 [0,1,0,0,0,0|3,0,0]=4 325 B32R4.15669938 COc1ccc(cc1CO)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)C AIFCHEM-50896351886 [0,1,0,0,0,0|3,0,0]=4 326 B32R4.15669938 COc1ccc(cc1OC)c2ccc3ncc(n3c2)NC(=O)C4CCC(CC4)C AIFCHEM-59994632507 [0,1,0,0,0,0|2,0,1]=4 327 B32R4.15669938 COc1ccc(cc1OC)c2ccc3ncc(n3c2)NC(=O)C4CCC(CC4)O AIFCHEM-52080216609 [0,1,0,0,0,0|2,0,1]=4 328 B32R4.15669938 COc1ccc(cc1OC)c2ccc3ncc(n3c2)NC(=O)[C@H]4CC[C@@H](CC4)C AIFCHEM-50898501022 [0,1,0,0,0,0|2,0,1]=4 329 B32R4.15669938 COc1ccc(cc1OC)c2ccc3ncc(n3c2)NC(=O)[C@H]4CC[C@H](CC4)O AIFCHEM-59281625300 [0,1,0,0,0,0|2,0,1]=4 330 B32R4.15669938 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CC=C(CC4)C AIFCHEM-59963431307 [0,1,0,0,0,0|0,0,2]=3 331 B32R4.15669938 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC(=O)NC4 AIFCHEM-53906353865 [0,1,0,0,0,0|1,0,1]=3 332 B32R4.15669938 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC(CC4)O AIFCHEM-52079302726 [0,1,0,0,0,0|0,0,0]=1 333 B32R4.15669938 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC[C@H](CC4)O AIFCHEM-59279490777 [0,1,0,0,0,0|0,0,0]=1 334 B32R4.15669938 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CC=C(CC4)C AIFCHEM-59965578726 [0,1,0,0,0,0|1,0,2]=4 335 B32R4.15669938 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCC(=O)NC4 AIFCHEM-53906911344 [0,1,0,0,0,0|2,0,1]=4 336 B32R4.15669938 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCC(CC4)C AIFCHEM-59994582963 [0,1,0,0,0,0|1,0,0]=2 337 B32R4.15669938 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCC(CC4)O AIFCHEM-52080192645 [0,1,0,0,0,0|1,0,0]=2 338 B32R4.15669938 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)C AIFCHEM-50898477058 [0,1,0,0,0,0|1,0,0]=2 339 B32R4.15669938 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CC[C@H](CC4)O AIFCHEM-59281601336 [0,1,0,0,0,0|1,0,0]=2 340 B32R4.15669938 COc1ccc(cc1SC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCC(CC4)O AIFCHEM-88676674480 [0,1,0,0,0,0|2,1,0]=4 341 B32R4.15669938 COc1ccc(cc1SC)c2ccc3[nH]nc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)O AIFCHEM-90685940401 [0,1,0,0,0,0|2,1,0]=4 342 B32R4.15669938 COc1ccc(cc1SC)c2ccc3[nH]nc(c3c2)NC(=O)[C@H]4CC[C@H](CC4)O AIFCHEM-94335062021 [0,1,0,0,0,0|2,1,0]=4 343 B32R4.15669938 COc1ccc(nc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCC(CC4)C AIFCHEM-59990054518 [0,1,0,0,0,0|3,0,0]=4 344 B32R4.15669938 COc1ccc(nc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCC(CC4)O AIFCHEM-52078247320 [0,1,0,0,0,0|3,0,0]=4 345 B32R4.15669938 COc1ccc(nc1OC)c2ccc3[nH]nc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)C AIFCHEM-50896364173 [0,1,0,0,0,0|3,0,0]=4 346 B32R4.15669938 COc1ccc(nc1OC)c2ccc3[nH]nc(c3c2)NC(=O)[C@H]4CC[C@H](CC4)O AIFCHEM-59276041951 [0,1,0,0,0,0|3,0,0]=4 347 B32R4.15669938 COc1ncc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC(CC4)C AIFCHEM-73503173516 [0,1,0,0,0,0|3,0,0]=4 348 B32R4.15669938 COc1ncc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC(CC4)O AIFCHEM-68824924007 [0,1,0,0,0,0|3,0,0]=4 349 B32R4.15669938 COc1ncc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)C AIFCHEM-66424623008 [0,1,0,0,0,0|3,0,0]=4 350 B32R4.15669938 COc1ncc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC[C@H](CC4)O AIFCHEM-72757415008 [0,1,0,0,0,0|3,0,0]=4 351 B32R4.32589586 CCOc1ccc(cc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-74246809569 [0,1,0,0,0,0|3,0,0]=4 352 B32R4.32589586 CCOc1ccc(cc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-77637783711 [0,1,0,0,0,0|3,0,0]=4 353 B32R4.32589586 CCOc1ccc(cc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-74495247637 [0,1,0,0,0,0|3,0,0]=4 354 B32R4.32589586 CCOc1ccc(cc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-78088425865 [0,1,0,0,0,0|3,0,0]=4 355 B32R4.66233746 CCOc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-74246648214 [0,1,0,0,0,0|3,0,0]=4 356 B32R4.66233746 CCOc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-77637629396 [0,1,0,0,0,0|3,0,0]=4 357 B32R4.66233746 CCOc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-74494997062 [0,1,0,0,0,0|3,0,0]=4 358 B32R4.66233746 CCOc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-78088271550 [0,1,0,0,0,0|3,0,0]=4 359 B32R4.66233746 CCOc1cc(ccc1C#N)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-78987464740 [0,1,0,0,0,0|3,0,0]=4 360 B32R4.100078262 COc1cc(c(cc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCC4)F AIFCHEM-88179681883 [0,1,0,0,0,0|2,0,0]=3 361 B32R4.100078262 COc1cc(c(cc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCO4)F AIFCHEM-90181281224 [0,1,0,0,0,0|3,0,0]=4 362 B32R4.100078262 COc1cc(c(cc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCOC4)F AIFCHEM-85438344674 [0,1,0,0,0,0|3,0,0]=4 363 B32R4.100078262 COc1cc(c(cc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCOCC4)F AIFCHEM-81761077161 [0,1,0,0,0,0|3,0,0]=4 364 B32R4.100078262 COc1cc(c(cc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCSCC4)F AIFCHEM-86082604640 [0,1,0,0,0,0|3,0,0]=4 365 B32R4.100078262 COc1cc(c(cc1OC)c2ccc3[nH]nc(c3c2)NC(=O)[C@H]4CCCOC4)F AIFCHEM-82019834453 [0,1,0,0,0,0|3,0,0]=4 366 B32R4.120092168 COc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCC4C AIFCHEM-61258967070 [0,1,0,0,0,0|2,0,0]=3 367 B32R4.120092168 COc1cc(cnc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCC4C AIFCHEM-74835906928 [0,1,0,0,0,0|3,0,0]=4 368 B32R4.120092168 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCC4C AIFCHEM-61261329794 [0,1,0,0,0,0|1,0,0]=2 369 B32R4.120092168 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4C AIFCHEM-61261065215 [0,1,0,0,0,0|2,0,0]=3 370 B32R4.120092168 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCC4C AIFCHEM-61259069973 [0,1,0,0,0,0|2,0,0]=3 371 B32R4.120092168 COc1ccc(cc1C#N)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4C AIFCHEM-61262711741 [0,1,0,0,0,0|3,0,0]=4 372 B32R4.120092168 COc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCC4C AIFCHEM-61260916181 [0,1,0,0,0,0|2,0,0]=3 373 B32R4.120092168 COc1ccc(cc1OC)c2ccc3ncc(n3c2)NC(=O)C4CCCCC4C AIFCHEM-61262785837 [0,1,0,0,0,0|2,0,1]=4 374 B32R4.120092168 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4C AIFCHEM-61262761873 [0,1,0,0,0,0|1,0,0]=2 375 B32R4.120092168 COc1ccc(nc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCC4C AIFCHEM-61259035768 [0,1,0,0,0,0|3,0,0]=4 376 B32R4.120092168 COc1ncc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCC4C AIFCHEM-74835921478 [0,1,0,0,0,0|3,0,0]=4 377 B32R4.120092171 COc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC(C4)C AIFCHEM-51069688153 [0,1,0,0,0,0|2,0,0]=3 378 B32R4.120092171 COc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC(C4)O AIFCHEM-57979849474 [0,1,0,0,0,0|2,0,0]=3 379 B32R4.120092171 COc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCC[C@H](C4)O AIFCHEM-56105862880 [0,1,0,0,0,0|2,0,0]=3 380 B32R4.120092171 COc1cc(ccc1C#N)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCC(C4)C AIFCHEM-51070658188 [0,1,0,0,0,0|3,0,0]=4 381 B32R4.120092171 COc1cc(ccc1SC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCC(C4)O AIFCHEM-96700786643 [0,1,0,0,0,0|2,1,0]=4 382 B32R4.120092171 COc1cc(ccc1SC)c2ccc3[nH]nc(c3c2)NC(=O)[C@H]4CCC[C@H](C4)O AIFCHEM-99195420227 [0,1,0,0,0,0|2,1,0]=4 383 B32R4.120092171 COc1cc(cnc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCC(C4)C AIFCHEM-66644477499 [0,1,0,0,0,0|3,0,0]=4 384 B32R4.120092171 COc1cc(cnc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCC(C4)O AIFCHEM-75417173677 [0,1,0,0,0,0|3,0,0]=4 385 B32R4.120092171 COc1cc(cnc1OC)c2ccc3[nH]nc(c3c2)NC(=O)[C@H]4CCC[C@H](C4)O AIFCHEM-70395275150 [0,1,0,0,0,0|3,0,0]=4 386 B32R4.120092171 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC(=O)C4 AIFCHEM-51700090515 [0,1,0,0,0,0|1,0,1]=3 387 B32R4.120092171 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC(=O)N4 AIFCHEM-59375598335 [0,1,0,0,0,0|2,0,1]=4 388 B32R4.120092171 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC(C4)C AIFCHEM-51071084537 [0,1,0,0,0,0|1,0,0]=2 389 B32R4.120092171 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC(C4)O AIFCHEM-57981964278 [0,1,0,0,0,0|1,0,0]=2 390 B32R4.120092171 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCCC(=O)N4 AIFCHEM-59086437858 [0,1,0,0,0,0|2,0,1]=4 391 B32R4.120092171 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCC[C@H](C4)O AIFCHEM-56107101464 [0,1,0,0,0,0|1,0,0]=2 392 B32R4.120092171 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCC(=O)C4 AIFCHEM-51699934216 [0,1,0,0,0,0|2,0,1]=4 393 B32R4.120092171 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCC(C4)C AIFCHEM-51070779998 [0,1,0,0,0,0|2,0,0]=3 394 B32R4.120092171 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCC(C4)O AIFCHEM-57981807979 [0,1,0,0,0,0|2,0,0]=3 395 B32R4.120092171 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CCC[C@H](C4)O AIFCHEM-56106945165 [0,1,0,0,0,0|2,0,0]=3 396 B32R4.120092171 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC(=O)C4 AIFCHEM-51699095374 [0,1,0,0,0,0|2,0,1]=4 397 B32R4.120092171 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC(C4)C AIFCHEM-51069791056 [0,1,0,0,0,0|2,0,0]=3 398 B32R4.120092171 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC(C4)O AIFCHEM-57979952377 [0,1,0,0,0,0|2,0,0]=3 399 B32R4.120092171 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCC[C@H](C4)O AIFCHEM-56105965783 [0,1,0,0,0,0|2,0,0]=3 400 B32R4.120092171 COc1ccc(cc1C#N)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCC(C4)C AIFCHEM-51072008884 [0,1,0,0,0,0|3,0,0]=4 401 B32R4.120092171 COc1ccc(cc1C#N)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCC(C4)O AIFCHEM-57982392325 [0,1,0,0,0,0|3,0,0]=4 402 B32R4.120092171 COc1ccc(cc1C#N)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CCC[C@H](C4)O AIFCHEM-56107351171 [0,1,0,0,0,0|3,0,0]=4 403 B32R4.120092171 COc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC(C4)C AIFCHEM-51070687344 [0,1,0,0,0,0|2,0,0]=3 404 B32R4.120092171 COc1ccc(cc1CO)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCC(C4)C AIFCHEM-51069744564 [0,1,0,0,0,0|3,0,0]=4 405 B32R4.120092171 COc1ccc(cc1OC)c2ccc3ncc(n3c2)NC(=O)C4CCCC(C4)C AIFCHEM-51072082980 [0,1,0,0,0,0|2,0,1]=4 406 B32R4.120092171 COc1ccc(cc1OC)c2ccc3ncc(n3c2)NC(=O)C4CCCC(C4)O AIFCHEM-57982563221 [0,1,0,0,0,0|2,0,1]=4 407 B32R4.120092171 COc1ccc(cc1OC)c2ccc3ncc(n3c2)NC(=O)[C@H]4CCC[C@H](C4)O AIFCHEM-56107425267 [0,1,0,0,0,0|2,0,1]=4 408 B32R4.120092171 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC(=O)C4 AIFCHEM-51700000435 [0,1,0,0,0,0|0,0,1]=2 409 B32R4.120092171 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC(C4)O AIFCHEM-57981874198 [0,1,0,0,0,0|0,0,0]=1 410 B32R4.120092171 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CSCC(=O)N4 AIFCHEM-52077256541 [0,1,0,0,0,0|2,0,1]=4 411 B32R4.120092171 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCCC(=O)N4 AIFCHEM-59086340658 [0,1,0,0,0,0|1,0,1]=3 412 B32R4.120092171 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCC[C@H](C4)O AIFCHEM-56107011384 [0,1,0,0,0,0|0,0,0]=1 413 B32R4.120092171 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCC(C4)C AIFCHEM-51072059016 [0,1,0,0,0,0|1,0,0]=2 414 B32R4.120092171 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCC(C4)O AIFCHEM-57982508977 [0,1,0,0,0,0|1,0,0]=2 415 B32R4.120092171 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CCC[C@H](C4)O AIFCHEM-56107401303 [0,1,0,0,0,0|1,0,0]=2 416 B32R4.120092171 COc1ccc(cc1SC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCC(C4)O AIFCHEM-92497333247 [0,1,0,0,0,0|2,1,0]=4 417 B32R4.120092171 COc1ccc(cc1SC)c2ccc3[nH]nc(c3c2)NC(=O)[C@H]4CCC[C@H](C4)O AIFCHEM-86116817026 [0,1,0,0,0,0|2,1,0]=4 418 B32R4.120092171 COc1ccc(nc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCC(C4)C AIFCHEM-51069756851 [0,1,0,0,0,0|3,0,0]=4 419 B32R4.120092171 COc1ccc(nc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCC(C4)O AIFCHEM-57979918172 [0,1,0,0,0,0|3,0,0]=4 420 B32R4.120092171 COc1ccc(nc1OC)c2ccc3[nH]nc(c3c2)NC(=O)[C@H]4CCC[C@H](C4)O AIFCHEM-56105931578 [0,1,0,0,0,0|3,0,0]=4 421 B32R4.120092171 COc1ncc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC(C4)C AIFCHEM-66644492049 [0,1,0,0,0,0|3,0,0]=4 422 B32R4.120092171 COc1ncc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC(C4)O AIFCHEM-75417188227 [0,1,0,0,0,0|3,0,0]=4 423 B32R4.120092171 COc1ncc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCC[C@H](C4)O AIFCHEM-70395289700 [0,1,0,0,0,0|3,0,0]=4 424 B32R4.1611618876 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4(CCCCC4)C AIFCHEM-48342740446 [0,1,0,0,0,0|1,0,0]=2 425 B32R4.1611618876 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4(CCOCC4)C AIFCHEM-54015955636 [0,1,0,0,0,0|2,0,0]=3 426 B32R4.1611618876 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4(CCOCC4)O AIFCHEM-60404656613 [0,1,0,0,0,0|2,0,0]=3 427 B30R3.8304159654 C#CCCCCC(=O)Nc1c[nH]c2c1cc(cn2)c3ccc(c(c3)OC)OC AIFCHEM-55109437611 [0,0,1,0,0,0|0,0,2]=3 428 B30R3.8304159654 C#CCCCCC(=O)Nc1c[nH]c2c1cc(cn2)c3cnc(c(c3)OC)OC AIFCHEM-55109527691 [0,0,1,0,0,0|1,0,2]=4 429 B30R3.8304159654 C#CCCCCC(=O)Nc1n[nH]c2c1cc(cn2)c3ccc(c(c3)OC)OC AIFCHEM-55110516830 [0,0,1,0,0,0|1,0,2]=4 430 B30R3.8304159654 C#CCOCCC(=O)Nc1c[nH]c2c1cc(cn2)c3ccc(c(c3)OC)OC AIFCHEM-57532083149 [0,0,1,0,0,0|1,0,2]=4 431 B30R3.8304159654 CCCCOCC(=O)Nc1c[nH]c2c1cc(cn2)c3ccc(c(c3)OC)OC AIFCHEM-54292029084 [0,0,1,0,0,0|1,0,0]=2 432 B30R3.8304159654 CCCCOCC(=O)Nc1c[nH]c2c1cc(cn2)c3cnc(c(c3)OC)OC AIFCHEM-54292119164 [0,0,1,0,0,0|2,0,0]=3 433 B30R3.8304159654 COCCOCC(=O)Nc1c[nH]c2c1cc(cn2)c3ccc(c(c3)OC)OC AIFCHEM-51595769194 [0,0,1,0,0,0|2,0,0]=3 434 B30R3.8304159654 COCCOCC(=O)Nc1c[nH]c2c1cc(cn2)c3cnc(c(c3)OC)OC AIFCHEM-51595859274 [0,0,1,0,0,0|3,0,0]=4 435 B30R3.8304159654 COCCOCC(=O)Nc1n[nH]c2c1cc(cn2)c3ccc(c(c3)OC)OC AIFCHEM-51596181153 [0,0,1,0,0,0|3,0,0]=4 436 B30R3.8304159654 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)CCCCCO AIFCHEM-49397659009 [0,0,1,0,0,0|2,0,0]=3 437 B30R3.8304159654 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)CCOCCO AIFCHEM-63278776773 [0,0,1,0,0,0|3,0,0]=4 438 B30R3.8304159654 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)CCCCCO AIFCHEM-49397502710 [0,0,1,0,0,0|3,0,0]=4 439 B30R3.8304159654 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)CCCCCO AIFCHEM-49397568929 [0,0,1,0,0,0|1,0,0]=2 440 B30R3.8304159654 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)CCOCCO AIFCHEM-63278619173 [0,0,1,0,0,0|2,0,0]=3 441 B32R5.29411996 Cc1n[nH]c2c1ccc(c2)c3cnc4[nH]cc(c4c3)NC(=O)C5CCCCC5 AIFCHEM-98027980644 [0,0,0,1,0,0|3,0,0]=4 442 B32R5.29411996 Cn1cnc2c1ccc(c2)c3cnc4[nH]cc(c4c3)NC(=O)C5CCCCC5 AIFCHEM-78989721503 [0,0,0,1,0,0|2,0,1]=4 443 B32R5.100429934 CN1CCc2c1cc(cc2)c3cnc4[nH]cc(c4c3)NC(=O)C5CCCCC5 AIFCHEM-78989985429 [0,0,0,1,0,0|2,0,0]=3 444 B32R5.100429934 CN1CCc2c1cc(cc2)c3cnc4[nH]cc(c4c3)NC(=O)C5CCCCO5 AIFCHEM-74251832205 [0,0,0,1,0,0|3,0,0]=4 445 B32R5.100429934 CN1CCc2c1cc(cc2)c3cnc4[nH]cc(c4c3)NC(=O)C5CCCOC5 AIFCHEM-77642806287 [0,0,0,1,0,0|3,0,0]=4 446 B32R5.100429934 CN1CCc2c1cc(cc2)c3cnc4[nH]cc(c4c3)NC(=O)C5CCOCC5 AIFCHEM-74499468833 [0,0,0,1,0,0|3,0,0]=4 447 B32R5.100429934 CN1CCc2c1cc(cc2)c3cnc4[nH]cc(c4c3)NC(=O)C5CCSCC5 AIFCHEM-78091616861 [0,0,0,1,0,0|3,0,0]=4 448 B32R5.100429934 CN1CCc2c1cc(cc2)c3cnc4[nH]nc(c4c3)NC(=O)C5CCCCC5 AIFCHEM-78989788347 [0,0,0,1,0,0|3,0,0]=4 449 B32R5.100429934 Cc1[nH]nc2c1cc(cc2)c3cnc4[nH]cc(c4c3)NC(=O)C5CCCCC5 AIFCHEM-61907541702 [0,0,0,1,0,0|3,0,0]=4 450 B32R5.100429934 Cn1cnc2c1cc(cc2)c3cnc4[nH]cc(c4c3)NC(=O)C5CCCCC5 AIFCHEM-78990091275 [0,0,0,1,0,0|2,0,1]=4 451 B32R5.130249972 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)CCCC4)C5CCCCO5 AIFCHEM-57039422290 [0,0,0,1,0,0|3,0,0]=4 452 B32R5.130249972 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)CCCC4)C5CCCOC5 AIFCHEM-60360685610 [0,0,0,1,0,0|3,0,0]=4 453 B32R5.130249972 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)CCCC4)C5CCOCC5 AIFCHEM-57222388234 [0,0,0,1,0,0|3,0,0]=4 454 B32R5.130249972 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)C5CC=CCC5 AIFCHEM-60303686495 [0,0,0,1,0,0|0,0,2]=3 455 B32R5.130249972 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)C5CCCCC5 AIFCHEM-61907574168 [0,0,0,1,0,0|0,0,0]=1 456 B32R5.130249972 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)C5CCCCO5 AIFCHEM-57040964739 [0,0,0,1,0,0|1,0,0]=2 457 B32R5.130249972 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)C5CCCOC5 AIFCHEM-60364249948 [0,0,0,1,0,0|1,0,0]=2 458 B32R5.130249972 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)C5CCOCC5 AIFCHEM-57224647343 [0,0,0,1,0,0|1,0,0]=2 459 B32R5.130249972 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)C5CCSCC5 AIFCHEM-63311563835 [0,0,0,1,0,0|1,0,0]=2 460 B32R5.130249972 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)C5COCCO5 AIFCHEM-63289315931 [0,0,0,1,0,0|2,0,0]=3 461 B32R5.130249972 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)C5SCCCS5 AIFCHEM-53198930544 [0,0,0,1,0,0|2,0,0]=3 462 B32R5.130249972 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)[C@@H]5CC=CCC5 AIFCHEM-61356906977 [0,0,0,1,0,0|0,0,2]=3 463 B32R5.130249972 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)[C@@H]5COCCO5 AIFCHEM-54377014879 [0,0,0,1,0,0|2,0,0]=3 464 B32R5.130249972 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)[C@H]5CC=CCC5 AIFCHEM-61310665693 [0,0,0,1,0,0|0,0,2]=3 465 B32R5.130249972 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)[C@H]5COCCO5 AIFCHEM-52631592368 [0,0,0,1,0,0|2,0,0]=3 466 B32R5.130249972 O=C(Nc1cnc2n1cc(cc2)c3ccc4c(c3)OCCO4)C5CCCCC5 AIFCHEM-61907120666 [0,0,0,1,0,0|2,0,1]=4 467 B32R5.130249972 O=C(Nc1n[nH]c2c1cc(cc2)c3cnc4c(c3)OCCO4)C5CCCCC5 AIFCHEM-78989596015 [0,0,0,1,0,0|3,0,0]=4 468 B32R5.130249972 O=C(Nc1n[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)C5CC=CCC5 AIFCHEM-60303509937 [0,0,0,1,0,0|1,0,2]=4 469 B32R5.130249972 O=C(Nc1n[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)C5CCCCC5 AIFCHEM-61907397610 [0,0,0,1,0,0|1,0,0]=2 470 B32R5.130249972 O=C(Nc1n[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)C5CCCCO5 AIFCHEM-57040788181 [0,0,0,1,0,0|2,0,0]=3 471 B32R5.130249972 O=C(Nc1n[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)C5CCCOC5 AIFCHEM-60364073390 [0,0,0,1,0,0|2,0,0]=3 472 B32R5.130249972 O=C(Nc1n[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)C5CCOCC5 AIFCHEM-57224470785 [0,0,0,1,0,0|2,0,0]=3 473 B32R5.130249972 O=C(Nc1n[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)C5CCSCC5 AIFCHEM-63311387277 [0,0,0,1,0,0|2,0,0]=3 474 B32R5.130249972 O=C(Nc1n[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)C5COCCO5 AIFCHEM-63288969613 [0,0,0,1,0,0|3,0,0]=4 475 B32R5.130249972 O=C(Nc1n[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)C5SCCCS5 AIFCHEM-53198753986 [0,0,0,1,0,0|3,0,0]=4 476 B32R5.130249972 O=C(Nc1n[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)[C@@H]5CC=CCC5 AIFCHEM-61356662259 [0,0,0,1,0,0|1,0,2]=4 477 B32R5.130249972 O=C(Nc1n[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)[C@H]5CC=CCC5 AIFCHEM-61310489135 [0,0,0,1,0,0|1,0,2]=4 478 B30R4.10980148 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)C(=O)N4CCCOC4 AIFCHEM-83625739965 [0,0,0,0,1,0|3,0,0]=4 479 B30R4.10980148 COc1ccc(cc1OC)c2ccc3[nH]cc(c3c2)C(=O)N4CCCOC4 AIFCHEM-10011556625 [0,0,0,0,1,0|3,0,0]=4 480 B30R4.10980148 COc1ccc(cc1OC)c2ccc3[nH]cc(c3c2)C(=O)N4CCSCC4 AIFCHEM-7568628521 [0,0,0,0,1,0|3,0,0]=4 481 B30R4.10980148 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)C(=O)N4CCCOC4 AIFCHEM-83652403025 [0,0,0,0,1,0|2,0,0]=3 482 B30R4.10980148 COc1ccc(cc1OC)c2cnc3c(c2)N(CC3)C(=O)C4CCCCC4 AIFCHEM-61909038620 [0,0,0,0,1,0|2,0,1]=4 483 B30R4.10980158 CCc1cc(ccc1C=O)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC4 AIFCHEM-85725458682 [0,0,0,0,1,0|3,0,0]=4 484 B30R4.10980158 CCc1ccc(cc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCC4 AIFCHEM-55466763168 [0,0,0,0,1,0|3,0,0]=4 485 B30R4.10980158 COc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC4 AIFCHEM-86801451234 [0,0,0,0,1,0|2,0,0]=3 486 B30R4.10980158 COc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCO4 AIFCHEM-86801370769 [0,0,0,0,1,0|3,0,0]=4 487 B30R4.10980158 COc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCS4 AIFCHEM-52794375857 [0,0,0,0,1,0|3,0,0]=4 488 B30R4.10980158 COc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOC4 AIFCHEM-60891502952 [0,0,0,0,1,0|3,0,0]=4 489 B30R4.10980158 COc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CCCO4 AIFCHEM-86801342189 [0,0,0,0,1,0|3,0,0]=4 490 B30R4.10980158 COc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CCOC4 AIFCHEM-86801264140 [0,0,0,0,1,0|3,0,0]=4 491 B30R4.10980158 COc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCCO4 AIFCHEM-86801559407 [0,0,0,0,1,0|3,0,0]=4 492 B30R4.10980158 COc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCOC4 AIFCHEM-86801630256 [0,0,0,0,1,0|3,0,0]=4 493 B30R4.10980158 COc1cc(ccc1C#N)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCC4 AIFCHEM-55468435405 [0,0,0,0,1,0|3,0,0]=4 494 B30R4.10980158 COc1cc(ccc1C=O)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC4 AIFCHEM-88691360065 [0,0,0,0,1,0|2,0,0]=3 495 B30R4.10980158 COc1cc(ccc1C=O)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCO4 AIFCHEM-88691270720 [0,0,0,0,1,0|3,0,0]=4 496 B30R4.10980158 COc1cc(ccc1C=O)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOC4 AIFCHEM-88691335596 [0,0,0,0,1,0|3,0,0]=4 497 B30R4.10980158 COc1cc(ccc1C=O)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CCCO4 AIFCHEM-88691238700 [0,0,0,0,1,0|3,0,0]=4 498 B30R4.10980158 COc1cc(ccc1C=O)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CCOC4 AIFCHEM-88691134091 [0,0,0,0,1,0|3,0,0]=4 499 B30R4.10980158 COc1cc(ccc1C=O)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCCO4 AIFCHEM-88691500218 [0,0,0,0,1,0|3,0,0]=4 500 B30R4.10980158 COc1cc(ccc1C=O)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCOC4 AIFCHEM-93837445255 [0,0,0,0,1,0|3,0,0]=4 501 B30R4.10980158 COc1cc(cnc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCC4 AIFCHEM-72556870588 [0,0,0,0,1,0|3,0,0]=4 502 B30R4.10980158 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CC=CC4 AIFCHEM-62557725816 [0,0,0,0,1,0|1,0,2]=4 503 B30R4.10980158 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC4 AIFCHEM-55468701274 [0,0,0,0,1,0|1,0,0]=2 504 B30R4.10980158 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCO4 AIFCHEM-51941239131 [0,0,0,0,1,0|2,0,0]=3 505 B30R4.10980158 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCS4 AIFCHEM-52799375881 [0,0,0,0,1,0|2,0,0]=3 506 B30R4.10980158 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOC4 AIFCHEM-60895126776 [0,0,0,0,1,0|2,0,0]=3 507 B30R4.10980158 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CCCO4 AIFCHEM-83625633422 [0,0,0,0,1,0|2,0,0]=3 508 B30R4.10980158 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CCOC4 AIFCHEM-62193302257 [0,0,0,0,1,0|2,0,0]=3 509 B30R4.10980158 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCCO4 AIFCHEM-83625725680 [0,0,0,0,1,0|2,0,0]=3 510 B30R4.10980158 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCOC4 AIFCHEM-83625762589 [0,0,0,0,1,0|2,0,0]=3 511 B30R4.10980158 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCC4 AIFCHEM-55468544975 [0,0,0,0,1,0|2,0,0]=3 512 B30R4.10980158 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCO4 AIFCHEM-51941082832 [0,0,0,0,1,0|3,0,0]=4 513 B30R4.10980158 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCS4 AIFCHEM-52799219582 [0,0,0,0,1,0|3,0,0]=4 514 B30R4.10980158 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCOC4 AIFCHEM-60894970477 [0,0,0,0,1,0|3,0,0]=4 515 B30R4.10980158 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)[C@@H]4CCCO4 AIFCHEM-60337795036 [0,0,0,0,1,0|3,0,0]=4 516 B30R4.10980158 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)[C@@H]4CCOC4 AIFCHEM-62193145958 [0,0,0,0,1,0|3,0,0]=4 517 B30R4.10980158 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CCCO4 AIFCHEM-63124339059 [0,0,0,0,1,0|3,0,0]=4 518 B30R4.10980158 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CCOC4 AIFCHEM-51921981431 [0,0,0,0,1,0|3,0,0]=4 519 B30R4.10980158 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC4 AIFCHEM-83677268688 [0,0,0,0,1,0|2,0,0]=3 520 B30R4.10980158 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCO4 AIFCHEM-81439931386 [0,0,0,0,1,0|3,0,0]=4 521 B30R4.10980158 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCS4 AIFCHEM-52794478760 [0,0,0,0,1,0|3,0,0]=4 522 B30R4.10980158 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOC4 AIFCHEM-60891605855 [0,0,0,0,1,0|3,0,0]=4 523 B30R4.10980158 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CCCO4 AIFCHEM-81439897886 [0,0,0,0,1,0|3,0,0]=4 524 B30R4.10980158 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CCOC4 AIFCHEM-81439787957 [0,0,0,0,1,0|3,0,0]=4 525 B30R4.10980158 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCCO4 AIFCHEM-63121861277 [0,0,0,0,1,0|3,0,0]=4 526 B30R4.10980158 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCOC4 AIFCHEM-83677355110 [0,0,0,0,1,0|3,0,0]=4 527 B30R4.10980158 COc1ccc(cc1C#N)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCC4 AIFCHEM-55470040941 [0,0,0,0,1,0|3,0,0]=4 528 B30R4.10980158 COc1ccc(cc1C=O)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC4 AIFCHEM-82939086960 [0,0,0,0,1,0|2,0,0]=3 529 B30R4.10980158 COc1ccc(cc1C=O)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCO4 AIFCHEM-94297880281 [0,0,0,0,1,0|3,0,0]=4 530 B30R4.10980158 COc1ccc(cc1C=O)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOC4 AIFCHEM-82939070231 [0,0,0,0,1,0|3,0,0]=4 531 B30R4.10980158 COc1ccc(cc1C=O)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CCCO4 AIFCHEM-82939003735 [0,0,0,0,1,0|3,0,0]=4 532 B30R4.10980158 COc1ccc(cc1C=O)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CCOC4 AIFCHEM-82938931766 [0,0,0,0,1,0|3,0,0]=4 533 B30R4.10980158 COc1ccc(cc1C=O)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCCO4 AIFCHEM-94297961279 [0,0,0,0,1,0|3,0,0]=4 534 B30R4.10980158 COc1ccc(cc1C=O)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCOC4 AIFCHEM-82939259062 [0,0,0,0,1,0|3,0,0]=4 535 B30R4.10980158 COc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC4 AIFCHEM-55468464561 [0,0,0,0,1,0|2,0,0]=3 536 B30R4.10980158 COc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCO4 AIFCHEM-91538215148 [0,0,0,0,1,0|3,0,0]=4 537 B30R4.10980158 COc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCS4 AIFCHEM-52799139168 [0,0,0,0,1,0|3,0,0]=4 538 B30R4.10980158 COc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOC4 AIFCHEM-60894890063 [0,0,0,0,1,0|3,0,0]=4 539 B30R4.10980158 COc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CCCO4 AIFCHEM-60337714622 [0,0,0,0,1,0|3,0,0]=4 540 B30R4.10980158 COc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CCOC4 AIFCHEM-91538167039 [0,0,0,0,1,0|3,0,0]=4 541 B30R4.10980158 COc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCCO4 AIFCHEM-91538323606 [0,0,0,0,1,0|3,0,0]=4 542 B30R4.10980158 COc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCOC4 AIFCHEM-51921901017 [0,0,0,0,1,0|3,0,0]=4 543 B30R4.10980158 COc1ccc(cc1CO)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCC4 AIFCHEM-55466843861 [0,0,0,0,1,0|3,0,0]=4 544 B30R4.10980158 COc1ccc(cc1OC)c2ccc3ncc(n3c2)NC(=O)C4CCCC4 AIFCHEM-55470191317 [0,0,0,0,1,0|2,0,1]=4 545 B30R4.10980158 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CC=CC4 AIFCHEM-62557483656 [0,0,0,0,1,0|0,0,2]=3 546 B30R4.10980158 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC4 AIFCHEM-82894761120 [0,0,0,0,1,0|0,0,0]=1 547 B30R4.10980158 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCO4 AIFCHEM-82894709375 [0,0,0,0,1,0|1,0,0]=2 548 B30R4.10980158 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCS4 AIFCHEM-52799285801 [0,0,0,0,1,0|1,0,0]=2 549 B30R4.10980158 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOC4 AIFCHEM-60895036696 [0,0,0,0,1,0|1,0,0]=2 550 B30R4.10980158 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CCCO4 AIFCHEM-83652296482 [0,0,0,0,1,0|1,0,0]=2 551 B30R4.10980158 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CCOC4 AIFCHEM-62193212177 [0,0,0,0,1,0|1,0,0]=2 552 B30R4.10980158 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCCO4 AIFCHEM-83652388740 [0,0,0,0,1,0|1,0,0]=2 553 B30R4.10980158 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCOC4 AIFCHEM-82894904182 [0,0,0,0,1,0|1,0,0]=2 554 B30R4.10980158 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CC=CC4 AIFCHEM-62558672715 [0,0,0,0,1,0|1,0,2]=4 555 B30R4.10980158 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCC4 AIFCHEM-55470141313 [0,0,0,0,1,0|1,0,0]=2 556 B30R4.10980158 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCO4 AIFCHEM-51941538970 [0,0,0,0,1,0|2,0,0]=3 557 B30R4.10980158 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCS4 AIFCHEM-52801532580 [0,0,0,0,1,0|2,0,0]=3 558 B30R4.10980158 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCOC4 AIFCHEM-60896378295 [0,0,0,0,1,0|2,0,0]=3 559 B30R4.10980158 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)[C@@H]4CCCO4 AIFCHEM-60339122834 [0,0,0,0,1,0|2,0,0]=3 560 B30R4.10980158 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)[C@@H]4CCOC4 AIFCHEM-62193980736 [0,0,0,0,1,0|2,0,0]=3 561 B30R4.10980158 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CCCO4 AIFCHEM-63126319617 [0,0,0,0,1,0|2,0,0]=3 562 B30R4.10980158 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CCOC4 AIFCHEM-51922437569 [0,0,0,0,1,0|2,0,0]=3 563 B30R4.10980158 COc1ccc(nc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCC4 AIFCHEM-55466866168 [0,0,0,0,1,0|3,0,0]=4 564 B30R4.10980158 COc1ncc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC4 AIFCHEM-79253545619 [0,0,0,0,1,0|3,0,0]=4 565 B32R4.15669401 COc1cc(cnc1OC)c2ccc3ccnc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-78987327325 [0,0,0,0,0,1|3,0,0]=4 566 B32R4.15669401 COc1cc(cnc1OC)c2ccc3nccc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-78987585260 [0,0,0,0,0,1|2,0,1]=4 567 B32R4.15669401 COc1cc(cnc1OC)c2cnc3cccc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-78987380414 [0,0,0,0,0,1|2,0,0]=3 568 B32R4.15669401 COc1cc(cnc1OC)c2cnc3cccc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-74246772810 [0,0,0,0,0,1|3,0,0]=4 569 B32R4.15669401 COc1cc(cnc1OC)c2cnc3cccc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-77637746952 [0,0,0,0,0,1|3,0,0]=4 570 B32R4.15669401 COc1cc(cnc1OC)c2cnc3cccc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-74495210878 [0,0,0,0,0,1|3,0,0]=4 571 B32R4.15669401 COc1cc(cnc1OC)c2cnc3cccc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-78088389106 [0,0,0,0,0,1|3,0,0]=4 572 B32R4.15669401 COc1ccc(cc1CO)c2cnc3cccc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-78987415013 [0,0,0,0,0,1|3,0,0]=4 573 B32R4.15669401 COc1ccc(cc1OC)c2ccc3cccc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-77637972524 [0,0,0,0,0,1|3,0,0]=4 574 B32R4.15669401 COc1ccc(cc1OC)c2ccc3cccc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-74495524790 [0,0,0,0,0,1|3,0,0]=4 575 B32R4.15669426 COc1cc(cnc1OC)c2ccc3ccc(nc3c2)NC(=O)C4CCCCC4 AIFCHEM-78987250101 [0,0,0,0,0,1|3,0,0]=4 576 B32R4.15669426 COc1cc(cnc1OC)c2ccc3ncc(nc3c2)NC(=O)C4CCCCC4 AIFCHEM-78987173420 [0,0,0,0,0,1|2,0,1]=4 577 B32R4.15669426 COc1cc(cnc1OC)c2cnc3ccc(cc3c2)NC(=O)C4CCCCC4 AIFCHEM-78987357307 [0,0,0,0,0,1|2,0,0]=3 578 B32R4.15669426 COc1cc(cnc1OC)c2cnc3ccc(cc3c2)NC(=O)C4CCCCO4 AIFCHEM-74246749703 [0,0,0,0,0,1|3,0,0]=4 579 B32R4.15669426 COc1cc(cnc1OC)c2cnc3ccc(cc3c2)NC(=O)C4CCCOC4 AIFCHEM-77637723845 [0,0,0,0,0,1|3,0,0]=4 580 B32R4.15669426 COc1cc(cnc1OC)c2cnc3ccc(cc3c2)NC(=O)C4CCOCC4 AIFCHEM-74495165191 [0,0,0,0,0,1|3,0,0]=4 581 B32R4.15669426 COc1cc(cnc1OC)c2cnc3ccc(cc3c2)NC(=O)C4CCSCC4 AIFCHEM-78088365999 [0,0,0,0,0,1|3,0,0]=4 582 B32R4.15669426 COc1ccc(cc1CO)c2cnc3ccc(cc3c2)NC(=O)C4CCCCC4 AIFCHEM-78987260166 [0,0,0,0,0,1|3,0,0]=4 583 B32R4.15669426 COc1ccc(cc1OC)c2ccc3ncc(nc3c2)NC(=O)C4CCCCC4 AIFCHEM-98027192493 [0,0,0,0,0,1|1,0,1]=3 584 B32R4.15669426 COc1ccc(cc1OC)c2ccc3ncc(nc3c2)NC(=O)C4CCCOC4 AIFCHEM-99889116153 [0,0,0,0,0,1|2,0,1]=4 585 B32R4.15669426 COc1ccc(cc1OC)c2ccc3ncc(nc3c2)NC(=O)C4CCOCC4 AIFCHEM-100345613865 [0,0,0,0,0,1|2,0,1]=4 586 B32R4.15669426 COc1ccc(cc1OC)c2ccc3ncc(nc3c2)NC(=O)C4CCSCC4 AIFCHEM-97366105199 [0,0,0,0,0,1|2,0,1]=4 587 B32R4.15669426 COc1ccc(cc1OC)c2cnc3ccc(cc3c2)NC(=O)C4CCCCO4 AIFCHEM-74246738222 [0,0,0,0,0,1|2,0,0]=3 588 B32R4.15669426 COc1ccc(cc1OC)c2cnc3ccc(cc3c2)NC(=O)C4CCCOC4 AIFCHEM-77637712364 [0,0,0,0,0,1|2,0,0]=3 589 B32R4.15669426 COc1ccc(cc1OC)c2cnc3ccc(cc3c2)NC(=O)C4CCOCC4 AIFCHEM-74495141110 [0,0,0,0,0,1|2,0,0]=3 590 B32R4.15669426 COc1ccc(cc1OC)c2cnc3ccc(cc3c2)NC(=O)C4CCSCC4 AIFCHEM-78088354518 [0,0,0,0,0,1|2,0,0]=3 591 B32R4.15669426 COc1ccc(cc1OC)c2cnc3ccc(cc3c2)NC(=O)C4COCCO4 AIFCHEM-78126593162 [0,0,0,0,0,1|3,0,0]=4 592 B32R4.15669426 COc1ccc(cc1OC)c2cnc3ccc(cc3c2)NC(=O)[C@@H]4COCCO4 AIFCHEM-69107461736 [0,0,0,0,0,1|3,0,0]=4 593 B32R4.15669426 COc1ccc(cc1OC)c2cnc3ccc(cc3c2)NC(=O)[C@H]4COCCO4 AIFCHEM-69549122267 [0,0,0,0,0,1|3,0,0]=4 594 B32R4.120092068 COc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCCCO4 AIFCHEM-50897463036 [0,0,0,0,0,1|3,0,0]=4 595 B32R4.120092068 COc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCCOC4 AIFCHEM-48014276316 [0,0,0,0,0,1|3,0,0]=4 596 B32R4.120092068 COc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCOCC4 AIFCHEM-62890826179 [0,0,0,0,0,1|3,0,0]=4 597 B32R4.120092068 COc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCSCC4 AIFCHEM-51528085200 [0,0,0,0,0,1|3,0,0]=4 598 B32R4.120092068 COc1cc(cnc1OC)c2ccc3[nH]nc(c3c2)NC(=O)CC4CCCCC4 AIFCHEM-74535463468 [0,0,0,0,0,1|3,0,0]=4 599 B32R4.120092068 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)CC4=CCCCC4 AIFCHEM-54432082773 [0,0,0,0,0,1|1,0,2]=4 600 B32R4.120092068 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCCCC4 AIFCHEM-57209965778 [0,0,0,0,0,1|1,0,0]=2 601 B32R4.120092068 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCCCO4 AIFCHEM-50899686320 [0,0,0,0,0,1|2,0,0]=3 602 B32R4.120092068 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCCOC4 AIFCHEM-48015368660 [0,0,0,0,0,1|2,0,0]=3 603 B32R4.120092068 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCOCC4 AIFCHEM-62896197083 [0,0,0,0,0,1|2,0,0]=3 604 B32R4.120092068 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCSCC4 AIFCHEM-51529012404 [0,0,0,0,0,1|2,0,0]=3 605 B32R4.120092068 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)CC4CCCCC4 AIFCHEM-57209809479 [0,0,0,0,0,1|2,0,0]=3 606 B32R4.120092068 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)CC4CCCCO4 AIFCHEM-50899401481 [0,0,0,0,0,1|3,0,0]=4 607 B32R4.120092068 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)CC4CCCOC4 AIFCHEM-48015212361 [0,0,0,0,0,1|3,0,0]=4 608 B32R4.120092068 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)CC4CCOCC4 AIFCHEM-62896040784 [0,0,0,0,0,1|3,0,0]=4 609 B32R4.120092068 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)CC4CCSCC4 AIFCHEM-51528856105 [0,0,0,0,0,1|3,0,0]=4 610 B32R4.120092068 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCCCO4 AIFCHEM-50897565939 [0,0,0,0,0,1|3,0,0]=4 611 B32R4.120092068 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCCOC4 AIFCHEM-48014379219 [0,0,0,0,0,1|3,0,0]=4 612 B32R4.120092068 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCOCC4 AIFCHEM-62890967522 [0,0,0,0,0,1|3,0,0]=4 613 B32R4.120092068 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCSCC4 AIFCHEM-51528188103 [0,0,0,0,0,1|3,0,0]=4 614 B32R4.120092068 COc1ccc(cc1C#N)c2cnc3[nH]nc(c3c2)NC(=O)CC4CCCCC4 AIFCHEM-57210906765 [0,0,0,0,0,1|3,0,0]=4 615 B32R4.120092068 COc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCCCC4 AIFCHEM-57209729065 [0,0,0,0,0,1|2,0,0]=3 616 B32R4.120092068 COc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCCCO4 AIFCHEM-50899321067 [0,0,0,0,0,1|3,0,0]=4 617 B32R4.120092068 COc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCCOC4 AIFCHEM-48015131947 [0,0,0,0,0,1|3,0,0]=4 618 B32R4.120092068 COc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCOCC4 AIFCHEM-62895960370 [0,0,0,0,0,1|3,0,0]=4 619 B32R4.120092068 COc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCSCC4 AIFCHEM-51528775691 [0,0,0,0,0,1|3,0,0]=4 620 B32R4.120092068 COc1ccc(cc1OC)c2ccc3ncc(n3c2)NC(=O)CC4CCCCC4 AIFCHEM-57210980861 [0,0,0,0,0,1|2,0,1]=4 621 B32R4.120092068 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCCCO4 AIFCHEM-50899507200 [0,0,0,0,0,1|1,0,0]=2 622 B32R4.120092068 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCCOC4 AIFCHEM-48015278580 [0,0,0,0,0,1|1,0,0]=2 623 B32R4.120092068 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCOCC4 AIFCHEM-62896107003 [0,0,0,0,0,1|1,0,0]=2 624 B32R4.120092068 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCSCC4 AIFCHEM-51528922324 [0,0,0,0,0,1|1,0,0]=2 625 B32R4.120092068 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)CC4CCCCC4 AIFCHEM-57210956897 [0,0,0,0,0,1|1,0,0]=2 626 B32R4.120092068 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)CC4CCCCO4 AIFCHEM-50900761899 [0,0,0,0,0,1|2,0,0]=3 627 B32R4.120092068 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)CC4CCCOC4 AIFCHEM-48015668499 [0,0,0,0,0,1|2,0,0]=3 628 B32R4.120092068 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)CC4CCOCC4 AIFCHEM-62897248502 [0,0,0,0,0,1|2,0,0]=3 629 B32R4.120092068 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)CC4CCSCC4 AIFCHEM-51529335943 [0,0,0,0,0,1|2,0,0]=3 630 B32R4.120092068 COc1ccc(nc1OC)c2ccc3[nH]nc(c3c2)NC(=O)CC4CCCCC4 AIFCHEM-57208963452 [0,0,0,0,0,1|3,0,0]=4 631 B32R4.120092068 COc1ncc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCCCC4 AIFCHEM-74535478018 [0,0,0,0,0,1|3,0,0]=4 632 B32R4.1040991174 COc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC=CCC4 AIFCHEM-53241977898 [0,0,0,0,0,1|2,0,1]=4 633 B32R4.1040991174 COc1cc(ccc1C#N)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCCC4 AIFCHEM-51051092578 [0,0,0,0,0,1|3,0,0]=4 634 B32R4.1040991174 COc1cc(cnc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCCC4 AIFCHEM-67718324788 [0,0,0,0,0,1|3,0,0]=4 635 B32R4.1040991174 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC=CCC4 AIFCHEM-53244494582 [0,0,0,0,0,1|1,0,1]=3 636 B32R4.1040991174 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCCC4 AIFCHEM-51051358447 [0,0,0,0,0,1|1,0,0]=2 637 B32R4.1040991174 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCC=CCC4 AIFCHEM-53244338283 [0,0,0,0,0,1|2,0,1]=4 638 B32R4.1040991174 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCCC4 AIFCHEM-51051202148 [0,0,0,0,0,1|2,0,0]=3 639 B32R4.1040991174 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC=CCC4 AIFCHEM-53242147221 [0,0,0,0,0,1|2,0,1]=4 640 B32R4.1040991174 COc1ccc(cc1C#N)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCCC4 AIFCHEM-51052476134 [0,0,0,0,0,1|3,0,0]=4 641 B32R4.1040991174 COc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC=CCC4 AIFCHEM-53244257869 [0,0,0,0,0,1|2,0,1]=4 642 B32R4.1040991174 COc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCCC4 AIFCHEM-51051121734 [0,0,0,0,0,1|2,0,0]=3 643 B32R4.1040991174 COc1ccc(cc1CO)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCCC4 AIFCHEM-51050132474 [0,0,0,0,0,1|3,0,0]=4 644 B32R4.1040991174 COc1ccc(cc1OC)c2ccc3ncc(n3c2)NC(=O)C4CCCCCC4 AIFCHEM-51052604210 [0,0,0,0,0,1|2,0,1]=4 645 B32R4.1040991174 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC=CCC4 AIFCHEM-53244404502 [0,0,0,0,0,1|0,0,1]=2 646 B32R4.1040991174 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCC=CCC4 AIFCHEM-53244983721 [0,0,0,0,0,1|1,0,1]=3 647 B32R4.1040991174 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCCC4 AIFCHEM-51052562126 [0,0,0,0,0,1|1,0,0]=2 648 B32R4.1040991174 COc1ccc(nc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCCC4 AIFCHEM-51050144761 [0,0,0,0,0,1|3,0,0]=4 649 B32R4.1040991174 COc1ncc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCCC4 AIFCHEM-67718354318 [0,0,0,0,0,1|3,0,0]=4 650 B29R3.2333405 COc1ccc(cc1OC)c2cncc(c2)[C@@H](C)NC(=O)C3CCCCC3 AIFCHEM-61904622648 [1,0,1,0,0,0|0,0,2]=4 651 B29R3.1299906294 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C(OC)OC AIFCHEM-62410044377 [1,0,1,0,0,0|2,0,0]=4 652 B29R3.7336689797 CCOC(C)C(=O)Nc1c[nH]c2c1cc(cn2)c3ccc(c(c3)OC)OC AIFCHEM-57270452949 [1,0,1,0,0,0|1,0,0]=3 653 B29R3.7336689797 CCOC(C)C(=O)Nc1c[nH]c2c1cc(cn2)c3cnc(c(c3)OC)OC AIFCHEM-57270543029 [1,0,1,0,0,0|2,0,0]=4 654 B29R3.2260841467 C#CCCCC(=O)Nc1c[nH]c2c1cc(cn2)c3ccc(c(c3)OC)OC AIFCHEM-60805294133 [1,0,1,0,0,0|0,0,2]=4 655 B29R3.2260841467 CCCOCC(=O)Nc1c[nH]c2c1cc(cn2)c3ccc(c(c3)OC)OC AIFCHEM-61056240255 [1,0,1,0,0,0|1,0,0]=3 656 B29R3.2260841467 CCCOCC(=O)Nc1c[nH]c2c1cc(cn2)c3cnc(c(c3)OC)OC AIFCHEM-61056330335 [1,0,1,0,0,0|2,0,0]=4 657 B29R3.2260841467 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)CCCC#N AIFCHEM-56061282950 [1,0,1,0,0,0|1,0,1]=4 658 B29R3.2766585754 C#CCCCCC(=O)Nc1c[nH]c2c1cc(cn2)c3ccc(c(c3)C)OC AIFCHEM-55107626561 [1,0,1,0,0,0|0,0,2]=4 659 B29R3.2766585754 CCCCOCC(=O)Nc1c[nH]c2c1cc(cn2)c3cnc(c(c3)C)OC AIFCHEM-54292135186 [1,0,1,0,0,0|2,0,0]=4 660 B29R3.2766585754 COCCOCC(=O)Nc1c[nH]c2c1cc(cn2)c3ccc(c(c3)C)OC AIFCHEM-51593557504 [1,0,1,0,0,0|2,0,0]=4 661 B29R3.2766585754 COCCOCC(=O)Nc1c[nH]c2c1cc(cn2)c3ccc(c(c3)O)OC AIFCHEM-51593563399 [1,0,1,0,0,0|2,0,0]=4 662 B29R3.2766585754 COc1ncc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)CCCCCO AIFCHEM-49397675031 [1,0,1,0,0,0|2,0,0]=4 663 B29R3.2766585755 C#CCCCCC(=O)Nc1c[nH]c2c1cc(cn2)c3ccc(c(c3)OC)C AIFCHEM-55109619907 [1,0,1,0,0,0|0,0,2]=4 664 B29R3.2766585755 COCCOCC(=O)Nc1c[nH]c2c1cc(cn2)c3ccc(c(c3)OC)C AIFCHEM-51595951490 [1,0,1,0,0,0|2,0,0]=4 665 B29R3.2766585755 COCCOCC(=O)Nc1c[nH]c2c1cc(cn2)c3ccc(c(c3)OC)O AIFCHEM-51596226386 [1,0,1,0,0,0|2,0,0]=4 666 B29R4.125769 CCc1ccc(cc1)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-46592338957 [2,0,0,0,0,0|2,0,0]=4 667 B29R4.125769 CCc1ccc(cc1)c2cnc3[nH]cc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-39911491977 [2,0,0,0,0,0|2,0,0]=4 668 B29R4.125769 CCc1ccc(cn1)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-78990094988 [2,0,0,0,0,0|2,0,0]=4 669 B29R4.125769 COc1ccc(cc1)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-42224772150 [2,0,0,0,0,0|2,0,0]=4 670 B29R4.125769 COc1ccc(cc1)c2cnc3[nH]cc(c3c2)NC(=O)C4CC=CCC4 AIFCHEM-38785115370 [2,0,0,0,0,0|0,0,2]=4 671 B29R4.125769 COc1ccc(cc1)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-42224912933 [2,0,0,0,0,0|0,0,0]=2 672 B29R4.125769 COc1ccc(cc1)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-39084579869 [2,0,0,0,0,0|1,0,0]=3 673 B29R4.125769 COc1ccc(cc1)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-44969977463 [2,0,0,0,0,0|1,0,0]=3 674 B29R4.125769 COc1ccc(cc1)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-46590073973 [2,0,0,0,0,0|1,0,0]=3 675 B29R4.125769 COc1ccc(cc1)c2cnc3[nH]cc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-39908403443 [2,0,0,0,0,0|1,0,0]=3 676 B29R4.125769 COc1ccc(cc1)c2cnc3[nH]cc(c3c2)NC(=O)C4COCCO4 AIFCHEM-42958073939 [2,0,0,0,0,0|2,0,0]=4 677 B29R4.125769 COc1ccc(cc1)c2cnc3[nH]cc(c3c2)NC(=O)C4SCCCS4 AIFCHEM-44641971395 [2,0,0,0,0,0|2,0,0]=4 678 B29R4.125769 COc1ccc(cc1)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CC=CCC4 AIFCHEM-46761868164 [2,0,0,0,0,0|0,0,2]=4 679 B29R4.125769 COc1ccc(cc1)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4COCCO4 AIFCHEM-45365316853 [2,0,0,0,0,0|2,0,0]=4 680 B29R4.125769 COc1ccc(cc1)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC=CCC4 AIFCHEM-39437552279 [2,0,0,0,0,0|0,0,2]=4 681 B29R4.125769 COc1ccc(cc1)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-42224809836 [2,0,0,0,0,0|1,0,0]=3 682 B29R4.125769 COc1ccc(cc1)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-39084362332 [2,0,0,0,0,0|2,0,0]=4 683 B29R4.125769 COc1ccc(cc1)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-44969874366 [2,0,0,0,0,0|2,0,0]=4 684 B29R4.125769 COc1ccc(cc1)c2cnc3[nH]nc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-46589967516 [2,0,0,0,0,0|2,0,0]=4 685 B29R4.125769 COc1ccc(cc1)c2cnc3[nH]nc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-39908234386 [2,0,0,0,0,0|2,0,0]=4 686 B29R4.125769 COc1ccc(cn1)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-42224566212 [2,0,0,0,0,0|2,0,0]=4 687 B29R4.125769 CSc1ccc(cc1)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61907234477 [2,0,0,0,0,0|1,1,0]=4 688 B29R4.125769 N#Cc1ccc(cc1)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-42224476707 [2,0,0,0,0,0|2,0,0]=4 689 B29R4.8198390 Cc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-74251214315 [2,0,0,0,0,0|2,0,0]=4 690 B29R4.8198390 Cc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-77642141137 [2,0,0,0,0,0|2,0,0]=4 691 B29R4.8198390 Cc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-74499066323 [2,0,0,0,0,0|2,0,0]=4 692 B29R4.8198390 Cc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-78091031271 [2,0,0,0,0,0|2,0,0]=4 693 B29R4.8198390 Cc1cc(ccc1F)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-42224498096 [2,0,0,0,0,0|2,0,0]=4 694 B29R4.8198390 Cc1cc(ccc1O)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-88169572086 [2,0,0,0,0,0|2,0,0]=4 695 B29R4.8198390 Cc1cc(ccc1O)c2cnc3[nH]cc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-39907940112 [2,0,0,0,0,0|1,0,0]=3 696 B29R4.8198390 Cc1cc(cnc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-78989802899 [2,0,0,0,0,0|1,0,0]=3 697 B29R4.8198390 Cc1cc(cnc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-74251649675 [2,0,0,0,0,0|2,0,0]=4 698 B29R4.8198390 Cc1cc(cnc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-77642527577 [2,0,0,0,0,0|2,0,0]=4 699 B29R4.8198390 Cc1cc(cnc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-74499286303 [2,0,0,0,0,0|2,0,0]=4 700 B29R4.8198390 Cc1cc(cnc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-78091434331 [2,0,0,0,0,0|2,0,0]=4 701 B29R4.8198390 Cc1cc(cnc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-42227638863 [2,0,0,0,0,0|2,0,0]=4 702 B29R4.8198390 Cc1ccc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-39084227634 [2,0,0,0,0,0|1,0,0]=3 703 B29R4.8198390 Cc1ccc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-44969794988 [2,0,0,0,0,0|1,0,0]=3 704 B29R4.8198390 Cc1ccc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-46589888138 [2,0,0,0,0,0|1,0,0]=3 705 B29R4.8198390 Cc1ccc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-39908100128 [2,0,0,0,0,0|1,0,0]=3 706 B29R4.8198390 Cc1ccc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4COCCO4 AIFCHEM-42957731564 [2,0,0,0,0,0|2,0,0]=4 707 B29R4.8198390 Cc1ccc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4SCCCS4 AIFCHEM-44641788920 [2,0,0,0,0,0|2,0,0]=4 708 B29R4.8198390 Cc1ccc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4COCCO4 AIFCHEM-45365134378 [2,0,0,0,0,0|2,0,0]=4 709 B29R4.8198390 Cc1ccc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-42224602572 [2,0,0,0,0,0|1,0,0]=3 710 B29R4.8198390 Cc1ccc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-39084020388 [2,0,0,0,0,0|2,0,0]=4 711 B29R4.8198390 Cc1ccc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-44969666002 [2,0,0,0,0,0|2,0,0]=4 712 B29R4.8198390 Cc1ccc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-46589756892 [2,0,0,0,0,0|2,0,0]=4 713 B29R4.8198390 Cc1ccc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-39907892922 [2,0,0,0,0,0|2,0,0]=4 714 B29R4.8198390 Cc1ccc(cc1F)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-42227661267 [2,0,0,0,0,0|2,0,0]=4 715 B29R4.8198390 Cc1ccc(cc1O)c2cnc3[nH]cc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-39911623182 [2,0,0,0,0,0|1,0,0]=3 716 B29R4.8198390 Cc1ncc(cc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-78989820535 [2,0,0,0,0,0|2,0,0]=4 717 B29R4.2266074 CCc1cccc(c1)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-74251576286 [2,0,0,0,0,0|2,0,0]=4 718 B29R4.2266074 CCc1cccc(c1)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-77642470948 [2,0,0,0,0,0|2,0,0]=4 719 B29R4.2266074 CCc1cccc(c1)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-74499236914 [2,0,0,0,0,0|2,0,0]=4 720 B29R4.2266074 CCc1cccc(c1)c2cnc3[nH]cc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-78091384942 [2,0,0,0,0,0|2,0,0]=4 721 B29R4.2266074 CCc1cncc(c1)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-98027434529 [2,0,0,0,0,0|2,0,0]=4 722 B29R4.2266074 COc1cc(ccn1)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-42224872271 [2,0,0,0,0,0|2,0,0]=4 723 B29R4.2266074 COc1cccc(c1)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-42224525704 [2,0,0,0,0,0|2,0,0]=4 724 B29R4.2266074 COc1cccc(c1)c2cnc3[nH]cc(c3c2)NC(=O)C4CC=CCC4 AIFCHEM-38784536439 [2,0,0,0,0,0|0,0,2]=4 725 B29R4.2266074 COc1cccc(c1)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-42224503942 [2,0,0,0,0,0|0,0,0]=2 726 B29R4.2266074 COc1cccc(c1)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-39083919458 [2,0,0,0,0,0|1,0,0]=3 727 B29R4.2266074 COc1cccc(c1)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-44969479532 [2,0,0,0,0,0|1,0,0]=3 728 B29R4.2266074 COc1cccc(c1)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-46589654922 [2,0,0,0,0,0|1,0,0]=3 729 B29R4.2266074 COc1cccc(c1)c2cnc3[nH]cc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-39907757512 [2,0,0,0,0,0|1,0,0]=3 730 B29R4.2266074 COc1cccc(c1)c2cnc3[nH]cc(c3c2)NC(=O)C4COCCO4 AIFCHEM-42957392788 [2,0,0,0,0,0|2,0,0]=4 731 B29R4.2266074 COc1cccc(c1)c2cnc3[nH]cc(c3c2)NC(=O)C4SCCCS4 AIFCHEM-44641562404 [2,0,0,0,0,0|2,0,0]=4 732 B29R4.2266074 COc1cccc(c1)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CC=CCC4 AIFCHEM-46761114933 [2,0,0,0,0,0|0,0,2]=4 733 B29R4.2266074 COc1cccc(c1)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4COCCO4 AIFCHEM-45364907862 [2,0,0,0,0,0|2,0,0]=4 734 B29R4.2266074 COc1cccc(c1)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC=CCC4 AIFCHEM-39437143288 [2,0,0,0,0,0|0,0,2]=4 735 B29R4.2266074 COc1cccc(c1)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4COCCO4 AIFCHEM-44973132424 [2,0,0,0,0,0|2,0,0]=4 736 B29R4.2266074 COc1cccc(c1)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-42224612240 [2,0,0,0,0,0|1,0,0]=3 737 B29R4.2266074 COc1cccc(c1)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-39084035336 [2,0,0,0,0,0|2,0,0]=4 738 B29R4.2266074 COc1cccc(c1)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-44969676770 [2,0,0,0,0,0|2,0,0]=4 739 B29R4.2266074 COc1cccc(c1)c2cnc3[nH]nc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-46589766560 [2,0,0,0,0,0|2,0,0]=4 740 B29R4.2266074 COc1cccc(c1)c2cnc3[nH]nc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-39907908470 [2,0,0,0,0,0|2,0,0]=4 741 B29R4.2266074 COc1cncc(c1)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-42224614238 [2,0,0,0,0,0|2,0,0]=4 742 B29R4.2266074 COc1cncc(n1)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-98027299825 [2,0,0,0,0,0|2,0,0]=4 743 B29R4.2266074 CSc1cccc(c1)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61904626842 [2,0,0,0,0,0|1,1,0]=4 744 B31R3.13300768 COc1ccc(cc1OC)c2ccc(cc2)NC(=O)CNC(=O)C3CCCCC3 AIFCHEM-94145461017 [0,1,1,0,0,0|1,0,1]=4 745 B31R3.1337073245 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)CCCCC(=O)C AIFCHEM-55190172615 [0,1,1,0,0,0|1,0,1]=4 746 B31R3.1337073245 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)CCCCC(C)C AIFCHEM-63593355068 [0,1,1,0,0,0|1,0,0]=3 747 B31R3.1337073245 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)CCCCC(C)C AIFCHEM-63593198769 [0,1,1,0,0,0|2,0,0]=4 748 B31R3.1337073245 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)CCCCC(=O)C AIFCHEM-55190082535 [0,1,1,0,0,0|0,0,1]=3 749 B31R3.2353509541 COC(=O)CCCC(=O)Nc1c[nH]c2c1cc(cn2)c3ccc(c(c3)OC)OC AIFCHEM-51209561137 [0,1,1,0,0,0|1,0,1]=4 750 B31R3.5462413472 CCCCCCC(=O)Nc1nn(c2c1cc(cn2)c3cnc(c(c3)OC)OC)C AIFCHEM-85601398477 [0,1,1,0,0,0|2,0,0]=4 751 B31R3.7251983813 C#CCCCCCC(=O)Nc1c[nH]c2c1cc(cn2)c3ccc(c(c3)OC)OC AIFCHEM-47812401532 [0,1,1,0,0,0|0,0,1]=3 752 B31R3.7251983813 C#CCCCCCC(=O)Nc1c[nH]c2c1cc(cn2)c3cnc(c(c3)OC)OC AIFCHEM-47812491612 [0,1,1,0,0,0|1,0,1]=4 753 B31R3.7251983813 C#CCCCCCC(=O)Nc1n[nH]c2c1cc(cn2)c3ccc(c(c3)OC)OC AIFCHEM-47813291451 [0,1,1,0,0,0|1,0,1]=4 754 B31R3.7251983813 CCCCCCCC(=O)Nc1c[nH]c2c1cc(cn2)c3cnc(c(c3)OC)OC AIFCHEM-50149775761 [0,1,1,0,0,0|1,0,0]=3 755 B31R3.7251983813 COCCCCCC(=O)Nc1c[nH]c2c1cc(cn2)c3ccc(c(c3)C#N)OC AIFCHEM-56308755485 [0,1,1,0,0,0|2,0,0]=4 756 B31R3.7251983813 COCCCCCC(=O)Nc1c[nH]c2c1cc(cn2)c3ccc(c(c3)CO)OC AIFCHEM-56310258693 [0,1,1,0,0,0|2,0,0]=4 757 B31R3.7251983813 COCCCCCC(=O)Nc1c[nH]c2c1cc(cn2)c3ccc(c(c3)OC)C#N AIFCHEM-56308597702 [0,1,1,0,0,0|2,0,0]=4 758 B31R3.7251983813 COCCCCCC(=O)Nc1c[nH]c2c1cc(cn2)c3ccc(c(c3)OC)OC AIFCHEM-56310405326 [0,1,1,0,0,0|0,0,0]=2 759 B31R3.7251983813 COCCCCCC(=O)Nc1c[nH]c2c1cc(cn2)c3cnc(c(c3)OC)OC AIFCHEM-56310495406 [0,1,1,0,0,0|1,0,0]=3 760 B31R3.7251983813 COCCCCCC(=O)Nc1n[nH]c2c1cc(cn2)c3ccc(c(c3)OC)OC AIFCHEM-56311486525 [0,1,1,0,0,0|1,0,0]=3 761 B31R3.7251983813 COCCCCCC(=O)Nc1n[nH]c2c1cc(cn2)c3cnc(c(c3)OC)OC AIFCHEM-56310339107 [0,1,1,0,0,0|2,0,0]=4 762 B31R3.7251983813 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)CCCCCCO AIFCHEM-55850712683 [0,1,1,0,0,0|1,0,0]=3 763 B31R3.7251983813 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)CCCCCCO AIFCHEM-55850622603 [0,1,1,0,0,0|0,0,0]=2 764 B31R4.16433413 COc1ccc(cc1C)c2cnc3c(c2)c(nn3C)NC(=O)C4CCCCC4 AIFCHEM-61909080222 [1,1,0,0,0,0|1,0,0]=3 765 B31R4.16433413 COc1ccc(cc1C)c2cnc3c(c2)c(nn3C)NC(=O)C4CCCCO4 AIFCHEM-57041779533 [1,1,0,0,0,0|2,0,0]=4 766 B31R4.16433413 COc1ccc(cc1C)c2cnc3c(c2)c(nn3C)NC(=O)C4CCCOC4 AIFCHEM-60365897182 [1,1,0,0,0,0|2,0,0]=4 767 B31R4.16433413 COc1ccc(cc1C)c2cnc3c(c2)c(nn3C)NC(=O)C4CCOCC4 AIFCHEM-57224962137 [1,1,0,0,0,0|2,0,0]=4 768 B31R4.16433413 COc1ccc(cc1C)c2cnc3c(c2)c(nn3C)NC(=O)C4CCSCC4 AIFCHEM-63311878629 [1,1,0,0,0,0|2,0,0]=4 769 B31R4.16433413 COc1ccc(cc1F)c2cnc3c(c2)c(nn3C)NC(=O)C4CCCCC4 AIFCHEM-61909033612 [1,1,0,0,0,0|2,0,0]=4 770 B31R4.16433413 COc1ccc(cc1O)c2ccc3c(c2)c(nn3C)NC(=O)C4CCCCC4 AIFCHEM-88179058152 [1,1,0,0,0,0|2,0,0]=4 771 B31R4.16433413 COc1ccc(cc1O)c2cnc3c(c2)c(nn3C)NC(=O)C4CCSCC4 AIFCHEM-63311271218 [1,1,0,0,0,0|2,0,0]=4 772 B31R4.16433413 COc1ncc(cc1C)c2cnc3c(c2)c(nn3C)NC(=O)C4CCCCC4 AIFCHEM-78990076201 [1,1,0,0,0,0|2,0,0]=4 773 B31R4.16433827 COc1ccc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC(=O)NC4 AIFCHEM-53903999035 [1,1,0,0,0,0|1,0,1]=4 774 B31R4.16433827 COc1ccc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC(CC4)O AIFCHEM-52077991656 [1,1,0,0,0,0|0,0,0]=2 775 B31R4.16433827 COc1ccc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC[C@H](CC4)O AIFCHEM-59275404267 [1,1,0,0,0,0|0,0,0]=2 776 B31R4.16433827 COc1ccc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCC(CC4)C AIFCHEM-59989872658 [1,1,0,0,0,0|1,0,0]=3 777 B31R4.16433827 COc1ccc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)C AIFCHEM-50896182313 [1,1,0,0,0,0|1,0,0]=3 778 B31R4.16433827 COc1ccc(cc1F)c2cnc3[nH]nc(c3c2)NC(=O)C4CCC(CC4)C AIFCHEM-59989696964 [1,1,0,0,0,0|2,0,0]=4 779 B31R4.16433827 COc1ccc(cc1F)c2cnc3[nH]nc(c3c2)NC(=O)C4CCC(CC4)O AIFCHEM-52077889766 [1,1,0,0,0,0|2,0,0]=4 780 B31R4.16433827 COc1ccc(cc1F)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)C AIFCHEM-50896006619 [1,1,0,0,0,0|2,0,0]=4 781 B31R4.16433827 COc1ccc(cc1F)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CC[C@H](CC4)O AIFCHEM-59275111117 [1,1,0,0,0,0|2,0,0]=4 782 B31R4.16433827 COc1ccc(cc1O)c2ccc3[nH]nc(c3c2)NC(=O)C4CCC(CC4)C AIFCHEM-88272210494 [1,1,0,0,0,0|2,0,0]=4 783 B31R4.16433827 COc1ccc(cc1O)c2ccc3[nH]nc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)C AIFCHEM-85889479802 [1,1,0,0,0,0|2,0,0]=4 784 B31R4.16433827 COc1ccc(cc1O)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC(CC4)C AIFCHEM-59989804749 [1,1,0,0,0,0|0,0,0]=2 785 B31R4.16433827 COc1ccc(cc1O)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)C AIFCHEM-50896114404 [1,1,0,0,0,0|0,0,0]=2 786 B31R4.16433827 COc1ccc(cc1O)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)C AIFCHEM-50896245533 [1,1,0,0,0,0|1,0,0]=3 787 B31R4.16433827 COc1ncc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC(CC4)C AIFCHEM-59993144686 [1,1,0,0,0,0|1,0,0]=3 788 B31R4.16433827 COc1ncc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC(CC4)O AIFCHEM-52079408828 [1,1,0,0,0,0|1,0,0]=3 789 B31R4.16433827 COc1ncc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)C AIFCHEM-50898025661 [1,1,0,0,0,0|1,0,0]=3 790 B31R4.16433827 COc1ncc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC[C@H](CC4)O AIFCHEM-59279711279 [1,1,0,0,0,0|1,0,0]=3 791 B31R4.16433827 COc1ncc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCC(CC4)C AIFCHEM-59992804230 [1,1,0,0,0,0|2,0,0]=4 792 B31R4.16433827 COc1ncc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCC(CC4)O AIFCHEM-52079205092 [1,1,0,0,0,0|2,0,0]=4 793 B31R4.16433827 COc1ncc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)C AIFCHEM-50897821925 [1,1,0,0,0,0|2,0,0]=4 794 B31R4.16433827 COc1ncc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CC[C@H](CC4)O AIFCHEM-59279298603 [1,1,0,0,0,0|2,0,0]=4 795 B31R4.16433827 CSc1ccc(cc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC(CC4)O AIFCHEM-68823955648 [1,1,0,0,0,0|1,1,0]=4 796 B31R4.16433827 CSc1ccc(cc1F)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC[C@H](CC4)O AIFCHEM-72755887749 [1,1,0,0,0,0|1,1,0]=4 797 B31R4.16433827 Cc1cc(ccc1CO)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)C AIFCHEM-50898497975 [1,1,0,0,0,0|2,0,0]=4 798 B31R4.35066442 CCOc1ccc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61904602723 [1,1,0,0,0,0|1,0,0]=3 799 B31R4.35066442 CCOc1ccc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-57039356454 [1,1,0,0,0,0|2,0,0]=4 800 B31R4.35066442 CCOc1ccc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-60360619774 [1,1,0,0,0,0|2,0,0]=4 801 B31R4.35066442 CCOc1ccc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57222322398 [1,1,0,0,0,0|2,0,0]=4 802 B31R4.35066442 CCOc1ccc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-63309573010 [1,1,0,0,0,0|2,0,0]=4 803 B31R4.35066442 CCOc1ccc(cc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-74251672655 [1,1,0,0,0,0|2,0,0]=4 804 B31R4.35066442 CCOc1ccc(cc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-77642550557 [1,1,0,0,0,0|2,0,0]=4 805 B31R4.35066442 CCOc1ccc(cc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-74499309283 [1,1,0,0,0,0|2,0,0]=4 806 B31R4.35066442 CCOc1ccc(cc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-78091457311 [1,1,0,0,0,0|2,0,0]=4 807 B31R4.35066442 CCOc1ccc(cc1F)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61907176450 [1,1,0,0,0,0|2,0,0]=4 808 B31R4.35066442 CCOc1ncc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61904513654 [1,1,0,0,0,0|1,0,0]=3 809 B31R4.35066442 CCOc1ncc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-57039267385 [1,1,0,0,0,0|2,0,0]=4 810 B31R4.35066442 CCOc1ncc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-60360530705 [1,1,0,0,0,0|2,0,0]=4 811 B31R4.35066442 CCOc1ncc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57222233329 [1,1,0,0,0,0|2,0,0]=4 812 B31R4.35066442 CCOc1ncc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-63309483941 [1,1,0,0,0,0|2,0,0]=4 813 B31R4.35066442 CCOc1ncc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61907333274 [1,1,0,0,0,0|2,0,0]=4 814 B31R4.114978382 COc1cc(c(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCO4)C AIFCHEM-57041800079 [1,1,0,0,0,0|1,0,0]=3 815 B31R4.114978382 COc1cc(c(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCOC4)C AIFCHEM-60365917728 [1,1,0,0,0,0|1,0,0]=3 816 B31R4.114978382 COc1cc(c(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4)C AIFCHEM-57224982683 [1,1,0,0,0,0|1,0,0]=3 817 B31R4.114978382 COc1cc(c(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCSCC4)C AIFCHEM-63311899175 [1,1,0,0,0,0|1,0,0]=3 818 B31R4.114978382 COc1cc(c(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4COCCO4)C AIFCHEM-63290459411 [1,1,0,0,0,0|2,0,0]=4 819 B31R4.114978382 COc1cc(c(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4SCCCS4)C AIFCHEM-53199145744 [1,1,0,0,0,0|2,0,0]=4 820 B31R4.114978382 COc1cc(c(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4COCCO4)C AIFCHEM-54377350219 [1,1,0,0,0,0|2,0,0]=4 821 B31R4.114978382 COc1cc(c(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4COCCO4)C AIFCHEM-52632095268 [1,1,0,0,0,0|2,0,0]=4 822 B31R4.114978382 COc1cc(c(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4)C AIFCHEM-61907546678 [1,1,0,0,0,0|1,0,0]=3 823 B31R4.114978382 COc1cc(c(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCO4)C AIFCHEM-57040937249 [1,1,0,0,0,0|2,0,0]=4 824 B31R4.114978382 COc1cc(c(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCOC4)C AIFCHEM-60364222458 [1,1,0,0,0,0|2,0,0]=4 825 B31R4.114978382 COc1cc(c(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCOCC4)C AIFCHEM-57224619853 [1,1,0,0,0,0|2,0,0]=4 826 B31R4.114978382 COc1cc(c(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCSCC4)C AIFCHEM-63311536345 [1,1,0,0,0,0|2,0,0]=4 827 B31R4.114978382 COc1cc(c(cc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCO4)F AIFCHEM-74246856432 [1,1,0,0,0,0|2,0,0]=4 828 B31R4.114978382 COc1cc(c(cc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCOC4)F AIFCHEM-77637830574 [1,1,0,0,0,0|2,0,0]=4 829 B31R4.114978382 COc1cc(c(cc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4)F AIFCHEM-74495294500 [1,1,0,0,0,0|2,0,0]=4 830 B31R4.114978382 COc1cc(c(cc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCSCC4)F AIFCHEM-78088472728 [1,1,0,0,0,0|2,0,0]=4 831 B31R4.114978382 COc1cc(c(cc1F)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4)F AIFCHEM-78987502344 [1,1,0,0,0,0|2,0,0]=4 832 B31R4.114978382 COc1cc(c(cc1O)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCC4)C AIFCHEM-61907424070 [1,1,0,0,0,0|2,0,0]=4 833 B31R4.115917870 COc1ccc(c(c1C)C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61904578623 [1,1,0,0,0,0|1,0,0]=3 834 B31R4.115917870 COc1ccc(c(c1C)C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-57039332354 [1,1,0,0,0,0|2,0,0]=4 835 B31R4.115917870 COc1ccc(c(c1C)C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-60360595674 [1,1,0,0,0,0|2,0,0]=4 836 B31R4.115917870 COc1ccc(c(c1C)C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57222298298 [1,1,0,0,0,0|2,0,0]=4 837 B31R4.115917870 COc1ccc(c(c1C)C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-63309548910 [1,1,0,0,0,0|2,0,0]=4 838 B31R4.115917870 COc1ccc(c(c1F)F)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-98028010780 [1,1,0,0,0,0|2,0,0]=4 839 B31R4.115917870 COc1ccc(c(c1O)O)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-98027957750 [1,1,0,0,0,0|2,0,0]=4 840 B31R4.139475533 COc1ccc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4C AIFCHEM-61258853908 [1,1,0,0,0,0|1,0,0]=3 841 B31R4.139475533 COc1ccc(cc1F)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4C AIFCHEM-61258678214 [1,1,0,0,0,0|2,0,0]=4 842 B31R4.139475533 COc1ccc(cc1O)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCC4C AIFCHEM-90739895186 [1,1,0,0,0,0|2,0,0]=4 843 B31R4.139475533 COc1ncc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCC4C AIFCHEM-61261357276 [1,1,0,0,0,0|1,0,0]=3 844 B31R4.139475533 COc1ncc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4C AIFCHEM-61261008500 [1,1,0,0,0,0|2,0,0]=4 845 B31R4.139475537 COc1ccc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC(C4)O AIFCHEM-57979662508 [1,1,0,0,0,0|0,0,0]=2 846 B31R4.139475537 COc1ccc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCC[C@H](C4)O AIFCHEM-56105675914 [1,1,0,0,0,0|0,0,0]=2 847 B31R4.139475537 COc1ccc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCC(C4)C AIFCHEM-51069574991 [1,1,0,0,0,0|1,0,0]=3 848 B31R4.139475537 COc1ccc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCC(C4)O AIFCHEM-57979736312 [1,1,0,0,0,0|1,0,0]=3 849 B31R4.139475537 COc1ccc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CCC[C@H](C4)O AIFCHEM-56105749718 [1,1,0,0,0,0|1,0,0]=3 850 B31R4.139475537 COc1ccc(cc1F)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCC(C4)C AIFCHEM-51069399297 [1,1,0,0,0,0|2,0,0]=4 851 B31R4.139475537 COc1ccc(cc1F)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCC(C4)O AIFCHEM-57979560618 [1,1,0,0,0,0|2,0,0]=4 852 B31R4.139475537 COc1ccc(cc1F)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CCC[C@H](C4)O AIFCHEM-56105574024 [1,1,0,0,0,0|2,0,0]=4 853 B31R4.139475537 COc1ccc(cc1O)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCC(C4)C AIFCHEM-85622429374 [1,1,0,0,0,0|2,0,0]=4 854 B31R4.139475537 COc1ccc(cc1O)c2ccc3[nH]nc(c3c2)NC(=O)[C@H]4CCC[C@H](C4)O AIFCHEM-86116418731 [1,1,0,0,0,0|2,0,0]=4 855 B31R4.139475537 COc1ccc(cc1O)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC(C4)C AIFCHEM-51069507082 [1,1,0,0,0,0|0,0,0]=2 856 B31R4.139475537 COc1ncc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC(=O)C4 AIFCHEM-51700106537 [1,1,0,0,0,0|1,0,1]=4 857 B31R4.139475537 COc1ncc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC(C4)C AIFCHEM-51071107639 [1,1,0,0,0,0|1,0,0]=3 858 B31R4.139475537 COc1ncc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC(C4)O AIFCHEM-57981980300 [1,1,0,0,0,0|1,0,0]=3 859 B31R4.139475537 COc1ncc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCC[C@H](C4)O AIFCHEM-56107117486 [1,1,0,0,0,0|1,0,0]=3 860 B31R4.139475537 COc1ncc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCC(C4)C AIFCHEM-51070736343 [1,1,0,0,0,0|2,0,0]=4 861 B31R4.139475537 COc1ncc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCC(C4)O AIFCHEM-57981776564 [1,1,0,0,0,0|2,0,0]=4 862 B31R4.139475537 COc1ncc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CCC[C@H](C4)O AIFCHEM-56106913750 [1,1,0,0,0,0|2,0,0]=4 863 B31R4.139475537 CSc1ccc(cc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC(C4)O AIFCHEM-75415123608 [1,1,0,0,0,0|1,1,0]=4 864 B31R4.139475537 CSc1ccc(cc1F)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCC[C@H](C4)O AIFCHEM-70392759141 [1,1,0,0,0,0|1,1,0]=4 865 B31R4.205323303 COc1c(cc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4)C AIFCHEM-61904514453 [1,1,0,0,0,0|1,0,0]=3 866 B31R4.205323303 COc1c(cc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCO4)C AIFCHEM-57039268184 [1,1,0,0,0,0|2,0,0]=4 867 B31R4.205323303 COc1c(cc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCOC4)C AIFCHEM-60360531504 [1,1,0,0,0,0|2,0,0]=4 868 B31R4.205323303 COc1c(cc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCOCC4)C AIFCHEM-57222234128 [1,1,0,0,0,0|2,0,0]=4 869 B31R4.205323303 COc1c(cc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCSCC4)C AIFCHEM-63309484740 [1,1,0,0,0,0|2,0,0]=4 870 B31R4.205323303 COc1c(cc(cc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCO4)F AIFCHEM-74246946308 [1,1,0,0,0,0|2,0,0]=4 871 B31R4.205323303 COc1c(cc(cc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCOC4)F AIFCHEM-77637920450 [1,1,0,0,0,0|2,0,0]=4 872 B31R4.205323303 COc1c(cc(cc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4)F AIFCHEM-74495422956 [1,1,0,0,0,0|2,0,0]=4 873 B31R4.205323303 COc1c(cc(cc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCSCC4)F AIFCHEM-78088562604 [1,1,0,0,0,0|2,0,0]=4 874 B31R4.205323303 COc1c(cc(cc1F)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4)F AIFCHEM-78987390377 [1,1,0,0,0,0|2,0,0]=4 875 B31R4.7657885 COc1cc(cc(c1O)O)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-78989698351 [1,1,0,0,0,0|2,0,0]=4 876 B31R4.18384987 COc1cc(ccc1C)c2cnc3c(c2)c(nn3C)NC(=O)C4CCCCC4 AIFCHEM-61907288402 [1,1,0,0,0,0|1,0,0]=3 877 B31R4.18384987 COc1cc(ccc1C)c2cnc3c(c2)c(nn3C)NC(=O)C4CCCCO4 AIFCHEM-57040678973 [1,1,0,0,0,0|2,0,0]=4 878 B31R4.18384987 COc1cc(ccc1C)c2cnc3c(c2)c(nn3C)NC(=O)C4CCCOC4 AIFCHEM-60363964182 [1,1,0,0,0,0|2,0,0]=4 879 B31R4.18384987 COc1cc(ccc1C)c2cnc3c(c2)c(nn3C)NC(=O)C4CCOCC4 AIFCHEM-57224361577 [1,1,0,0,0,0|2,0,0]=4 880 B31R4.18384987 COc1cc(ccc1C)c2cnc3c(c2)c(nn3C)NC(=O)C4CCSCC4 AIFCHEM-63311278069 [1,1,0,0,0,0|2,0,0]=4 881 B31R4.18384987 COc1cc(ccc1F)c2cnc3c(c2)c(nn3C)NC(=O)C4CCCCC4 AIFCHEM-61909100918 [1,1,0,0,0,0|2,0,0]=4 882 B31R4.18384987 COc1cc(ccc1O)c2cnc3c(c2)c(nn3C)NC(=O)C4CCSCC4 AIFCHEM-63311748399 [1,1,0,0,0,0|2,0,0]=4 883 B31R4.18385418 CCc1cc(ccc1O)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)C AIFCHEM-95544695354 [1,1,0,0,0,0|1,0,0]=3 884 B31R4.18385418 COc1cc(ccc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC(CC4)O AIFCHEM-52079485022 [1,1,0,0,0,0|0,0,0]=2 885 B31R4.18385418 COc1cc(ccc1C)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC[C@H](CC4)O AIFCHEM-59279873693 [1,1,0,0,0,0|0,0,0]=2 886 B31R4.18385418 COc1cc(ccc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCC(CC4)C AIFCHEM-59989903104 [1,1,0,0,0,0|1,0,0]=3 887 B31R4.18385418 COc1cc(ccc1C)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)C AIFCHEM-50896212759 [1,1,0,0,0,0|1,0,0]=3 888 B31R4.18385418 COc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC(CC4)O AIFCHEM-52078224603 [1,1,0,0,0,0|1,0,0]=3 889 B31R4.18385418 COc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC[C@H](CC4)O AIFCHEM-59276019234 [1,1,0,0,0,0|1,0,0]=3 890 B31R4.18385418 COc1cc(ccc1F)c2cnc3[nH]nc(c3c2)NC(=O)C4CCC(CC4)C AIFCHEM-59989791390 [1,1,0,0,0,0|2,0,0]=4 891 B31R4.18385418 COc1cc(ccc1F)c2cnc3[nH]nc(c3c2)NC(=O)C4CCC(CC4)O AIFCHEM-52077984192 [1,1,0,0,0,0|2,0,0]=4 892 B31R4.18385418 COc1cc(ccc1F)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)C AIFCHEM-50896101045 [1,1,0,0,0,0|2,0,0]=4 893 B31R4.18385418 COc1cc(ccc1F)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CC[C@H](CC4)O AIFCHEM-59275380723 [1,1,0,0,0,0|2,0,0]=4 894 B31R4.18385418 COc1cc(ccc1O)c2ccc3[nH]nc(c3c2)NC(=O)C4CCC(CC4)C AIFCHEM-88272625959 [1,1,0,0,0,0|2,0,0]=4 895 B31R4.18385418 COc1cc(ccc1O)c2ccc3[nH]nc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)C AIFCHEM-85890058987 [1,1,0,0,0,0|2,0,0]=4 896 B31R4.18385418 COc1cc(ccc1O)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC(CC4)C AIFCHEM-59994669976 [1,1,0,0,0,0|0,0,0]=2 897 B31R4.18385418 COc1cc(ccc1O)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)C AIFCHEM-50898522291 [1,1,0,0,0,0|0,0,0]=2 898 B31R4.18385418 COc1cc(ccc1O)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)C AIFCHEM-50898380223 [1,1,0,0,0,0|1,0,0]=3 899 B31R4.18385418 CSc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC(CC4)O AIFCHEM-68824097563 [1,1,0,0,0,0|1,1,0]=4 900 B31R4.18385418 CSc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC[C@H](CC4)O AIFCHEM-72756165264 [1,1,0,0,0,0|1,1,0]=4 901 B31R4.18385418 Cc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)C AIFCHEM-50896307526 [1,1,0,0,0,0|2,0,0]=4 902 B31R4.29731912 COc1c(ccc(c1F)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4)F AIFCHEM-78987505642 [1,1,0,0,0,0|2,0,0]=4 903 B31R4.74698567 CCOc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-57041822269 [1,1,0,0,0,0|2,0,0]=4 904 B31R4.74698567 CCOc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-60365939918 [1,1,0,0,0,0|2,0,0]=4 905 B31R4.74698567 CCOc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57225004873 [1,1,0,0,0,0|2,0,0]=4 906 B31R4.74698567 CCOc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-63311921365 [1,1,0,0,0,0|2,0,0]=4 907 B31R4.74698567 CCOc1cc(ccc1F)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61904850037 [1,1,0,0,0,0|2,0,0]=4 908 B31R4.114928133 COc1cc(c(cc1C)F)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-98027471597 [1,1,0,0,0,0|2,0,0]=4 909 B31R4.114928133 COc1cc(c(cc1C)F)c2cnc3[nH]cc(c3c2)NC(=O)C4CC=CCC4 AIFCHEM-60303307577 [1,1,0,0,0,0|0,0,2]=4 910 B31R4.114928133 COc1cc(c(cc1C)F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-57040585821 [1,1,0,0,0,0|1,0,0]=3 911 B31R4.114928133 COc1cc(c(cc1C)F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-60363871030 [1,1,0,0,0,0|1,0,0]=3 912 B31R4.114928133 COc1cc(c(cc1C)F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57224268425 [1,1,0,0,0,0|1,0,0]=3 913 B31R4.114928133 COc1cc(c(cc1C)F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-63311184917 [1,1,0,0,0,0|1,0,0]=3 914 B31R4.114928133 COc1cc(c(cc1C)F)c2cnc3[nH]cc(c3c2)NC(=O)C4COCCO4 AIFCHEM-63288580133 [1,1,0,0,0,0|2,0,0]=4 915 B31R4.114928133 COc1cc(c(cc1C)F)c2cnc3[nH]cc(c3c2)NC(=O)C4SCCCS4 AIFCHEM-53198551626 [1,1,0,0,0,0|2,0,0]=4 916 B31R4.114928133 COc1cc(c(cc1C)F)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CC=CCC4 AIFCHEM-61356459899 [1,1,0,0,0,0|0,0,2]=4 917 B31R4.114928133 COc1cc(c(cc1C)F)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4COCCO4 AIFCHEM-54376635961 [1,1,0,0,0,0|2,0,0]=4 918 B31R4.114928133 COc1cc(c(cc1C)F)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC=CCC4 AIFCHEM-61310286775 [1,1,0,0,0,0|0,0,2]=4 919 B31R4.114928133 COc1cc(c(cc1C)F)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61908957127 [1,1,0,0,0,0|1,0,0]=3 920 B31R4.114928133 COc1cc(c(cc1C)F)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-57041656438 [1,1,0,0,0,0|2,0,0]=4 921 B31R4.114928133 COc1cc(c(cc1C)F)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-60365767707 [1,1,0,0,0,0|2,0,0]=4 922 B31R4.114928133 COc1cc(c(cc1C)F)c2cnc3[nH]nc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57224839042 [1,1,0,0,0,0|2,0,0]=4 923 B31R4.114928133 COc1cc(c(cc1C)F)c2cnc3[nH]nc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-63311755534 [1,1,0,0,0,0|2,0,0]=4 924 B31R4.114928133 COc1cc(c(cc1O)F)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61907101954 [1,1,0,0,0,0|2,0,0]=4 925 B31R4.150726229 COc1cc(ccc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4C AIFCHEM-61258884354 [1,1,0,0,0,0|1,0,0]=3 926 B31R4.150726229 COc1cc(ccc1F)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4C AIFCHEM-61258772640 [1,1,0,0,0,0|2,0,0]=4 927 B31R4.150726229 COc1cc(ccc1O)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCC4C AIFCHEM-90740418531 [1,1,0,0,0,0|2,0,0]=4 928 B31R4.150726232 COc1cc(ccc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC(C4)O AIFCHEM-57982056494 [1,1,0,0,0,0|0,0,0]=2 929 B31R4.150726232 COc1cc(ccc1C)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCC[C@H](C4)O AIFCHEM-56107193680 [1,1,0,0,0,0|0,0,0]=2 930 B31R4.150726232 COc1cc(ccc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCC(C4)C AIFCHEM-51069605437 [1,1,0,0,0,0|1,0,0]=3 931 B31R4.150726232 COc1cc(ccc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCC(C4)O AIFCHEM-57979766758 [1,1,0,0,0,0|1,0,0]=3 932 B31R4.150726232 COc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC(=O)C4 AIFCHEM-51698988972 [1,1,0,0,0,0|1,0,1]=4 933 B31R4.150726232 COc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC(C4)O AIFCHEM-57979895455 [1,1,0,0,0,0|1,0,0]=3 934 B31R4.150726232 COc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCC[C@H](C4)O AIFCHEM-56105908861 [1,1,0,0,0,0|1,0,0]=3 935 B31R4.150726232 COc1cc(ccc1F)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCC(C4)C AIFCHEM-51069493723 [1,1,0,0,0,0|2,0,0]=4 936 B31R4.150726232 COc1cc(ccc1F)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCC(C4)O AIFCHEM-57979655044 [1,1,0,0,0,0|2,0,0]=4 937 B31R4.150726232 COc1cc(ccc1F)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CCC[C@H](C4)O AIFCHEM-56105668450 [1,1,0,0,0,0|2,0,0]=4 938 B31R4.150726232 COc1cc(ccc1O)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCC(C4)C AIFCHEM-85623109419 [1,1,0,0,0,0|2,0,0]=4 939 B31R4.150726232 COc1cc(ccc1O)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCC(C4)O AIFCHEM-92497509177 [1,1,0,0,0,0|2,0,0]=4 940 B31R4.150726232 COc1cc(ccc1O)c2ccc3[nH]nc(c3c2)NC(=O)[C@H]4CCC[C@H](C4)O AIFCHEM-86117053496 [1,1,0,0,0,0|2,0,0]=4 941 B31R4.150726232 COc1cc(ccc1O)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC(C4)C AIFCHEM-51072104249 [1,1,0,0,0,0|0,0,0]=2 942 B31R4.150726232 CSc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC(C4)O AIFCHEM-75415265523 [1,1,0,0,0,0|1,1,0]=4 943 B31R4.150726232 CSc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCC[C@H](C4)O AIFCHEM-70393141916 [1,1,0,0,0,0|1,1,0]=4 944 B31R4.150726232 Cc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC(C4)O AIFCHEM-43372610128 [1,1,0,0,0,0|2,0,0]=4 945 B31R4.150726232 Cc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCC[C@H](C4)O AIFCHEM-42009767996 [1,1,0,0,0,0|2,0,0]=4 946 B31R4.150726232 Cc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC(C4)C AIFCHEM-51069700204 [1,1,0,0,0,0|2,0,0]=4 947 B31R4.139067674 COc1ccc(cc1OC)c2ccc3[nH]cc(c3c2)C(=O)N4CCCC[C@H]4C AIFCHEM-11782132581 [0,1,0,0,1,0|2,0,0]=4 948 B31R4.16367031 COc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC(C4)C AIFCHEM-56920184835 [0,1,0,0,1,0|2,0,0]=4 949 B31R4.16367031 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC(=O)C4 AIFCHEM-61857287044 [0,1,0,0,1,0|1,0,1]=4 950 B31R4.16367031 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC(C4)C AIFCHEM-56922660919 [0,1,0,0,1,0|1,0,0]=3 951 B31R4.16367031 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCC(=O)C4 AIFCHEM-58986997786 [0,1,0,0,1,0|1,0,1]=4 952 B31R4.16367031 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCC(C4)C AIFCHEM-56922419000 [0,1,0,0,1,0|2,0,0]=4 953 B31R4.16367031 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC(C4)C AIFCHEM-56920287738 [0,1,0,0,1,0|2,0,0]=4 954 B31R4.16367031 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC(=O)C4 AIFCHEM-61857126284 [0,1,0,0,1,0|0,0,1]=3 955 B31R4.16367031 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC(=O)O4 AIFCHEM-59923966813 [0,1,0,0,1,0|1,0,1]=4 956 B31R4.16367031 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC(C4)C AIFCHEM-56922537279 [0,1,0,0,1,0|0,0,0]=2 957 B31R4.16367031 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CNC(=O)C4 AIFCHEM-59149182426 [0,1,0,0,1,0|1,0,1]=4 958 B31R4.16367031 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCC(=O)C4 AIFCHEM-58986835646 [0,1,0,0,1,0|0,0,1]=3 959 B31R4.16367031 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCC(=O)N4 AIFCHEM-59759685992 [0,1,0,0,1,0|1,0,1]=4 960 B31R4.16367031 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCC(=O)O4 AIFCHEM-60921457757 [0,1,0,0,1,0|1,0,1]=4 961 B31R4.16367031 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CNC(=O)C4 AIFCHEM-56407181598 [0,1,0,0,1,0|1,0,1]=4 962 B31R4.16367031 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCC(C4)C AIFCHEM-56923296278 [0,1,0,0,1,0|1,0,0]=3 963 B31R4.18647386 COc1cc(ccc1C(=O)N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC4 AIFCHEM-86740434758 [0,1,0,0,1,0|2,0,0]=4 964 B31R4.35016030 CCOc1ccc(cc1CC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCO4 AIFCHEM-91952039718 [0,1,0,0,1,0|2,0,0]=4 965 B31R4.35016030 CCOc1ccc(cc1CC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOC4 AIFCHEM-91952082974 [0,1,0,0,1,0|2,0,0]=4 966 B31R4.35016030 CCOc1ccc(cc1CC)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CCCO4 AIFCHEM-91952019218 [0,1,0,0,1,0|2,0,0]=4 967 B31R4.35016030 CCOc1ccc(cc1CC)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CCOC4 AIFCHEM-91951952869 [0,1,0,0,1,0|2,0,0]=4 968 B31R4.35016030 CCOc1ccc(cc1CC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCCO4 AIFCHEM-91952193916 [0,1,0,0,1,0|2,0,0]=4 969 B31R4.35016030 CCOc1ccc(cc1CC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCOC4 AIFCHEM-91952263805 [0,1,0,0,1,0|2,0,0]=4 970 B31R4.35016030 CCOc1ccc(cc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCC4 AIFCHEM-72552047953 [0,1,0,0,1,0|2,0,0]=4 971 B31R4.74679938 CCOc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC4 AIFCHEM-72551893638 [0,1,0,0,1,0|2,0,0]=4 972 B31R4.139066317 COc1cc(cnc1OC)c2cnc3c(c2)c(nn3C)NC(=O)C4CCCC4 AIFCHEM-86736214317 [0,1,0,0,1,0|2,0,0]=4 973 B31R4.139066317 COc1ccc(cc1OC)c2cnc3c(c2)c(nn3C)NC(=O)C4CCCC4 AIFCHEM-72552003385 [0,1,0,0,1,0|1,0,0]=3 974 B31R4.139066317 COc1ccc(cc1OC)c2cnc3c(c2)c(nn3C)NC(=O)C4CCCO4 AIFCHEM-68548442114 [0,1,0,0,1,0|2,0,0]=4 975 B31R4.139066317 COc1ccc(cc1OC)c2cnc3c(c2)c(nn3C)NC(=O)C4CCCS4 AIFCHEM-69600962667 [0,1,0,0,1,0|2,0,0]=4 976 B31R4.139066317 COc1ccc(cc1OC)c2cnc3c(c2)c(nn3C)NC(=O)C4CCOC4 AIFCHEM-78100490819 [0,1,0,0,1,0|2,0,0]=4 977 B31R4.139066317 COc1ccc(cc1OC)c2cnc3c(c2)c(nn3C)NC(=O)[C@@H]4CCCO4 AIFCHEM-77606567106 [0,1,0,0,1,0|2,0,0]=4 978 B31R4.139066317 COc1ccc(cc1OC)c2cnc3c(c2)c(nn3C)NC(=O)[C@@H]4CCOC4 AIFCHEM-75953466701 [0,1,0,0,1,0|2,0,0]=4 979 B31R4.139066317 COc1ccc(cc1OC)c2cnc3c(c2)c(nn3C)NC(=O)[C@H]4CCCO4 AIFCHEM-77582625006 [0,1,0,0,1,0|2,0,0]=4 980 B31R4.139066317 COc1ccc(cc1OC)c2cnc3c(c2)c(nn3C)NC(=O)[C@H]4CCOC4 AIFCHEM-68602795933 [0,1,0,0,1,0|2,0,0]=4 981 B31R4.139067719 COc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC4C AIFCHEM-60994870909 [0,1,0,0,1,0|2,0,0]=4 982 B31R4.139067719 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC4C AIFCHEM-60999153453 [0,1,0,0,1,0|1,0,0]=3 983 B31R4.139067719 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCC4C AIFCHEM-60998813934 [0,1,0,0,1,0|2,0,0]=4 984 B31R4.139067719 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC4C AIFCHEM-60994973812 [0,1,0,0,1,0|2,0,0]=4 985 B31R4.139067719 COc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC4C AIFCHEM-60998577300 [0,1,0,0,1,0|2,0,0]=4 986 B31R4.139067719 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC4C AIFCHEM-60998990853 [0,1,0,0,1,0|0,0,0]=2 987 B31R4.139067719 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCC4C AIFCHEM-61000441352 [0,1,0,0,1,0|1,0,0]=3 988 B33R4.16386013 COc1cc(cnc1OC)c2cnc3cccc(c3c2)NC(=O)C4CCC(CC4)O AIFCHEM-68820968363 [0,1,0,0,0,1|2,0,0]=4 989 B33R4.16386013 COc1cc(cnc1OC)c2cnc3cccc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)O AIFCHEM-72789123703 [0,1,0,0,0,1|2,0,0]=4 990 B33R4.16386013 COc1cc(cnc1OC)c2cnc3cccc(c3c2)NC(=O)[C@H]4CC[C@H](CC4)O AIFCHEM-72753582624 [0,1,0,0,0,1|2,0,0]=4 991 B33R4.121324854 COc1cc(cnc1OC)c2cnc3cccc(c3c2)NC(=O)C4CCCC(C4)O AIFCHEM-75410420043 [0,1,0,0,0,1|2,0,0]=4 992 B33R4.121324854 COc1cc(cnc1OC)c2cnc3cccc(c3c2)NC(=O)[C@H]4CCC[C@H](C4)O AIFCHEM-70389608556 [0,1,0,0,0,1|2,0,0]=4 993 B33R4.1583035904 COc1cc(cnc1OC)c2cnc3cccc(c3c2)NC(=O)C4(CCCCC4)O AIFCHEM-64865031546 [0,1,0,0,0,1|2,0,0]=4 994 B33R4.16386034 COc1cc(cnc1OC)c2cnc3ccc(cc3c2)NC(=O)C4CCC(CC4)O AIFCHEM-68820945256 [0,1,0,0,0,1|2,0,0]=4 995 B33R4.16386034 COc1cc(cnc1OC)c2cnc3ccc(cc3c2)NC(=O)[C@H]4CC[C@@H](CC4)O AIFCHEM-72789098076 [0,1,0,0,0,1|2,0,0]=4 996 B33R4.16386034 COc1cc(cnc1OC)c2cnc3ccc(cc3c2)NC(=O)[C@H]4CC[C@H](CC4)O AIFCHEM-72753559517 [0,1,0,0,0,1|2,0,0]=4 997 B33R4.16386034 COc1ccc(cc1OC)c2cnc3ccc(cc3c2)NC(=O)C4CCC(=O)CC4 AIFCHEM-77625907510 [0,1,0,0,0,1|1,0,1]=4 998 B33R4.16386034 COc1ccc(cc1OC)c2cnc3ccc(cc3c2)NC(=O)C4CCC(CC4)O AIFCHEM-68820933775 [0,1,0,0,0,1|1,0,0]=3 999 B33R4.16386034 COc1ccc(cc1OC)c2cnc3ccc(cc3c2)NC(=O)C4CCN(CC4)C AIFCHEM-76081724924 [0,1,0,0,0,1|2,0,0]=4 1000 B33R4.16386034 COc1ccc(cc1OC)c2cnc3ccc(cc3c2)NC(=O)[C@H]4CC[C@@H](CC4)O AIFCHEM-72789084695 [0,1,0,0,0,1|1,0,0]=3 1001 B33R4.16386034 COc1ccc(cc1OC)c2cnc3ccc(cc3c2)NC(=O)[C@H]4CC[C@H](CC4)O AIFCHEM-72753548036 [0,1,0,0,0,1|1,0,0]=3 1002 B33R4.121321282 COc1cc(cnc1OC)c2ccc3[nH]cc(c(=O)c3c2)NC(=O)C4CCCCC4 AIFCHEM-88179358075 [0,1,0,0,0,1|2,0,0]=4 1003 B33R4.121321282 COc1ccc(cc1OC)c2ccc3[nH]cc(c(=O)c3c2)NC(=O)C4CCCCC4 AIFCHEM-88179218067 [0,1,0,0,0,1|1,0,0]=3 1004 B33R4.121321282 COc1ccc(cc1OC)c2ccc3[nH]cc(c(=O)c3c2)NC(=O)C4CCCCO4 AIFCHEM-90180872248 [0,1,0,0,0,1|2,0,0]=4 1005 B33R4.121321282 COc1ccc(cc1OC)c2ccc3[nH]cc(c(=O)c3c2)NC(=O)C4CCCOC4 AIFCHEM-85437804558 [0,1,0,0,0,1|2,0,0]=4 1006 B33R4.121321282 COc1ccc(cc1OC)c2ccc3[nH]cc(c(=O)c3c2)NC(=O)C4CCOCC4 AIFCHEM-81760590845 [0,1,0,0,0,1|2,0,0]=4 1007 B33R4.121321282 COc1ccc(cc1OC)c2ccc3[nH]cc(c(=O)c3c2)NC(=O)C4CCSCC4 AIFCHEM-86081439624 [0,1,0,0,0,1|2,0,0]=4 1008 B33R4.121321282 COc1ccc(cc1OC)c2ccc3[nH]cc(c(=O)c3c2)NC(=O)[C@H]4CCCOC4 AIFCHEM-82019206937 [0,1,0,0,0,1|2,0,0]=4 1009 B33R4.121324981 COc1ccc(cc1OC)c2cnc3ccc(cc3c2)NC(=O)[C@H]4CCCCN4C AIFCHEM-71709418135 [0,1,0,0,0,1|2,0,0]=4 1010 B33R4.121324984 COc1cc(cnc1OC)c2cnc3ccc(cc3c2)NC(=O)C4CCCC(C4)O AIFCHEM-75410389616 [0,1,0,0,0,1|2,0,0]=4 1011 B33R4.121324984 COc1cc(cnc1OC)c2cnc3ccc(cc3c2)NC(=O)[C@H]4CCC[C@H](C4)O AIFCHEM-70389564249 [0,1,0,0,0,1|2,0,0]=4 1012 B33R4.121324984 COc1ccc(cc1OC)c2cnc3ccc(cc3c2)NC(=O)C4CCCC(=O)C4 AIFCHEM-68326227908 [0,1,0,0,0,1|1,0,1]=4 1013 B33R4.121324984 COc1ccc(cc1OC)c2cnc3ccc(cc3c2)NC(=O)C4CCCC(C4)O AIFCHEM-75410377935 [0,1,0,0,0,1|1,0,0]=3 1014 B33R4.121324984 COc1ccc(cc1OC)c2cnc3ccc(cc3c2)NC(=O)C4CCCN(C4)C AIFCHEM-69796315822 [0,1,0,0,0,1|2,0,0]=4 1015 B33R4.121324984 COc1ccc(cc1OC)c2cnc3ccc(cc3c2)NC(=O)[C@@H]4CCCN(C4)C AIFCHEM-78884302396 [0,1,0,0,0,1|2,0,0]=4 1016 B33R4.121324984 COc1ccc(cc1OC)c2cnc3ccc(cc3c2)NC(=O)[C@H]4CCC[C@H](C4)O AIFCHEM-70389542568 [0,1,0,0,0,1|1,0,0]=3 1017 B33R4.121330629 COc1cc(cnc1OC)c2cnc3c(cc(cc3c2)NC(=O)C4CCCCC4)F AIFCHEM-88169374990 [0,1,0,0,0,1|2,0,0]=4 1018 B33R4.1583036203 COc1cc(cnc1OC)c2cnc3ccc(cc3c2)NC(=O)C4(CCCCC4)O AIFCHEM-64865008439 [0,1,0,0,0,1|2,0,0]=4 1019 B33R4.1583036203 COc1ccc(cc1OC)c2cnc3ccc(cc3c2)NC(=O)C4(CCCCC4)O AIFCHEM-64864996958 [0,1,0,0,0,1|1,0,0]=3 1020 B33R4.1583036203 COc1ccc(cc1OC)c2cnc3ccc(cc3c2)NC(=O)C4(CCOCC4)C AIFCHEM-70707564677 [0,1,0,0,0,1|2,0,0]=4 1021 B33R4.1583036203 COc1ccc(cc1OC)c2cnc3ccc(cc3c2)NC(=O)C4(CCOCC4)O AIFCHEM-74007323291 [0,1,0,0,0,1|2,0,0]=4 1022 B33R4.121327051 COc1cc(cnc1OC)c2cnc3c(c2)c(nn3C)NC(=O)CC4CCCCC4 AIFCHEM-80816638479 [0,1,0,0,0,1|2,0,0]=4 1023 B33R4.121327051 COc1ccc(cc1OC)c2cnc3c(c2)c(nn3C)NC(=O)CC4CCCCC4 AIFCHEM-74528910490 [0,1,0,0,0,1|1,0,0]=3 1024 B33R4.121327051 COc1ccc(cc1OC)c2cnc3c(c2)c(nn3C)NC(=O)CC4CCCCO4 AIFCHEM-66495978602 [0,1,0,0,0,1|2,0,0]=4 1025 B33R4.121327051 COc1ccc(cc1OC)c2cnc3c(c2)c(nn3C)NC(=O)CC4CCCOC4 AIFCHEM-64164755872 [0,1,0,0,0,1|2,0,0]=4 1026 B33R4.121327051 COc1ccc(cc1OC)c2cnc3c(c2)c(nn3C)NC(=O)CC4CCOCC4 AIFCHEM-77332092113 [0,1,0,0,0,1|2,0,0]=4 1027 B33R4.121327051 COc1ccc(cc1OC)c2cnc3c(c2)c(nn3C)NC(=O)CC4CCSCC4 AIFCHEM-67122185271 [0,1,0,0,0,1|2,0,0]=4 1028 B33R4.121328493 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCC(=O)CC4 AIFCHEM-60740932692 [0,1,0,0,0,1|1,0,1]=4 1029 B33R4.121328493 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCC(CC4)C AIFCHEM-62178447535 [0,1,0,0,0,1|1,0,0]=3 1030 B33R4.121328493 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCC(CC4)O AIFCHEM-63819813339 [0,1,0,0,0,1|1,0,0]=3 1031 B33R4.121328493 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)CC4CCC(CC4)C AIFCHEM-62178291236 [0,1,0,0,0,1|2,0,0]=4 1032 B33R4.121328493 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)CC4CCC(CC4)O AIFCHEM-63819657040 [0,1,0,0,0,1|2,0,0]=4 1033 B33R4.121328493 COc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCC(CC4)C AIFCHEM-62178210822 [0,1,0,0,0,1|2,0,0]=4 1034 B33R4.121328493 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCC(CC4)O AIFCHEM-63819723259 [0,1,0,0,0,1|0,0,0]=2 1035 B33R4.121328493 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)CC4CCC(CC4)C AIFCHEM-62180127934 [0,1,0,0,0,1|1,0,0]=3 1036 B33R4.1033141615 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCCC(=O)C4 AIFCHEM-56138923971 [0,1,0,0,0,1|1,0,1]=4 1037 B33R4.1033141615 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCCC(C4)C AIFCHEM-62174711753 [0,1,0,0,0,1|1,0,0]=3 1038 B33R4.1033141615 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)CC4CCCC(C4)C AIFCHEM-62174555454 [0,1,0,0,0,1|2,0,0]=4 1039 B33R4.1033141615 COc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCCC(C4)C AIFCHEM-62174475040 [0,1,0,0,0,1|2,0,0]=4 1040 B33R4.1033141615 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)CC4CCCC(C4)C AIFCHEM-62177390512 [0,1,0,0,0,1|1,0,0]=3 1041 B33R4.1033142103 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCCCC4C AIFCHEM-58520055874 [0,1,0,0,0,1|1,0,0]=3 1042 B33R4.1033142103 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)CC4CCCCC4C AIFCHEM-58519817875 [0,1,0,0,0,1|2,0,0]=4 1043 B33R4.121327160 COc1cc(cnc1OC)c2cnc3c(c2)c(nn3C)NC(=O)C4CCC(CC4)C AIFCHEM-88276699825 [0,2,0,0,0,0|2,0,0]=4 1044 B33R4.121327160 COc1cc(cnc1OC)c2cnc3c(c2)c(nn3C)NC(=O)C4CCC(CC4)O AIFCHEM-88682073076 [0,2,0,0,0,0|2,0,0]=4 1045 B33R4.121327160 COc1cc(cnc1OC)c2cnc3c(c2)c(nn3C)NC(=O)[C@H]4CC[C@@H](CC4)C AIFCHEM-85893246033 [0,2,0,0,0,0|2,0,0]=4 1046 B33R4.121327160 COc1cc(cnc1OC)c2cnc3c(c2)c(nn3C)NC(=O)[C@H]4CC[C@H](CC4)O AIFCHEM-94340898917 [0,2,0,0,0,0|2,0,0]=4 1047 B33R4.121327160 COc1ccc(cc1OC)c2cnc3c(c2)c(nn3C)NC(=O)C4CCC(CC4)C AIFCHEM-73498078003 [0,2,0,0,0,0|1,0,0]=3 1048 B33R4.121327160 COc1ccc(cc1OC)c2cnc3c(c2)c(nn3C)NC(=O)C4CCC(CC4)O AIFCHEM-68820960554 [0,2,0,0,0,0|1,0,0]=3 1049 B33R4.121327160 COc1ccc(cc1OC)c2cnc3c(c2)c(nn3C)NC(=O)[C@H]4CC[C@@H](CC4)C AIFCHEM-66419732255 [0,2,0,0,0,0|1,0,0]=3 1050 B33R4.121327160 COc1ccc(cc1OC)c2cnc3c(c2)c(nn3C)NC(=O)[C@H]4CC[C@H](CC4)O AIFCHEM-72753574815 [0,2,0,0,0,0|1,0,0]=3 1051 B33R4.421403268 COc1cc(c(cc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCC(CC4)O)F AIFCHEM-88676882721 [0,2,0,0,0,0|2,0,0]=4 1052 B33R4.421403268 COc1cc(c(cc1OC)c2ccc3[nH]nc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)O)F AIFCHEM-90686071762 [0,2,0,0,0,0|2,0,0]=4 1053 B33R4.421403268 COc1cc(c(cc1OC)c2ccc3[nH]nc(c3c2)NC(=O)[C@H]4CC[C@H](CC4)O)F AIFCHEM-94335186522 [0,2,0,0,0,0|2,0,0]=4 1054 B33R4.1583046150 COc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC(CC4)(F)F AIFCHEM-49301751072 [0,2,0,0,0,0|2,0,0]=4 1055 B33R4.1583046150 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC(CC4)(F)F AIFCHEM-49303596316 [0,2,0,0,0,0|1,0,0]=3 1056 B33R4.1583046150 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCS(=O)(=O)CC4 AIFCHEM-61984091115 [0,2,0,0,0,0|2,0,0]=4 1057 B33R4.1583046150 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCC(CC4)(F)F AIFCHEM-49303402837 [0,2,0,0,0,0|2,0,0]=4 1058 B33R4.1583046150 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC(CC4)(F)F AIFCHEM-49301890115 [0,2,0,0,0,0|2,0,0]=4 1059 B33R4.1583046150 COc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC(CC4)(F)F AIFCHEM-49303322423 [0,2,0,0,0,0|2,0,0]=4 1060 B33R4.1583046150 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCS(=O)(=O)CC4 AIFCHEM-61984001035 [0,2,0,0,0,0|1,0,0]=3 1061 B33R4.1583046150 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4COC(OC4)(C)C AIFCHEM-51688207540 [0,2,0,0,0,0|2,0,0]=4 1062 B33R4.1583046150 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCC(CC4)(F)F AIFCHEM-49304930815 [0,2,0,0,0,0|1,0,0]=3 1063 B33R4.1583046150 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCS(=O)(=O)CC4 AIFCHEM-61985737494 [0,2,0,0,0,0|2,0,0]=4 1064 B33R4.1583046176 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC(=O)N(C4)C AIFCHEM-56558296538 [0,2,0,0,0,0|1,0,1]=4 1065 B33R4.1583046176 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCN(C(=O)C4)C AIFCHEM-47550782327 [0,2,0,0,0,0|1,0,1]=4 1066 B33R4.1850182764 CCC1CCC(CC1)C(=O)Nc2c[nH]c3c2cc(cn3)c4ccc(c(c4)CO)OC AIFCHEM-61152287802 [0,2,0,0,0,0|2,0,0]=4 1067 B33R4.1850182764 CCC1CCC(CC1)C(=O)Nc2c[nH]c3c2cc(cn3)c4cnc(c(c4)OC)OC AIFCHEM-61152524515 [0,2,0,0,0,0|1,0,0]=3 1068 B33R4.1850182764 CCC1CCC(CC1)C(=O)Nc2n[nH]c3c2cc(cn3)c4ccc(c(c4)OC)OC AIFCHEM-61154063754 [0,2,0,0,0,0|1,0,0]=3 1069 B33R4.1850182764 CCC1CCC(CC1)C(=O)Nc2n[nH]c3c2cc(cn3)c4cnc(c(c4)OC)OC AIFCHEM-61152368216 [0,2,0,0,0,0|2,0,0]=4 1070 B33R4.1850182764 CC[C@H]1CC[C@@H](CC1)C(=O)Nc2c[nH]c3c2cc(cn3)c4ccc(c(c4)CO)OC AIFCHEM-58674016714 [0,2,0,0,0,0|2,0,0]=4 1071 B33R4.1850182764 CC[C@H]1CC[C@@H](CC1)C(=O)Nc2c[nH]c3c2cc(cn3)c4cnc(c(c4)OC)OC AIFCHEM-58674427287 [0,2,0,0,0,0|1,0,0]=3 1072 B33R4.1850182764 CC[C@H]1CC[C@@H](CC1)C(=O)Nc2n[nH]c3c2cc(cn3)c4ccc(c(c4)OC)OC AIFCHEM-58675384206 [0,2,0,0,0,0|1,0,0]=3 1073 B33R4.1850182764 CC[C@H]1CC[C@@H](CC1)C(=O)Nc2n[nH]c3c2cc(cn3)c4cnc(c(c4)OC)OC AIFCHEM-58674155348 [0,2,0,0,0,0|2,0,0]=4 1074 B33R4.1850182764 COc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC(CC4)OC AIFCHEM-61784329419 [0,2,0,0,0,0|2,0,0]=4 1075 B33R4.1850182764 COc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)C#N AIFCHEM-51311168361 [0,2,0,0,0,0|2,0,0]=4 1076 B33R4.1850182764 COc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)CO AIFCHEM-58540030151 [0,2,0,0,0,0|2,0,0]=4 1077 B33R4.1850182764 COc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)OC AIFCHEM-59198736729 [0,2,0,0,0,0|2,0,0]=4 1078 B33R4.1850182764 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC(CC4)OC AIFCHEM-61788478903 [0,2,0,0,0,0|1,0,0]=3 1079 B33R4.1850182764 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)C#N AIFCHEM-51312494325 [0,2,0,0,0,0|1,0,0]=3 1080 B33R4.1850182764 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)CO AIFCHEM-58543547315 [0,2,0,0,0,0|1,0,0]=3 1081 B33R4.1850182764 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)OC AIFCHEM-59202550573 [0,2,0,0,0,0|1,0,0]=3 1082 B33R4.1850182764 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCC(CC4)OC AIFCHEM-61788175684 [0,2,0,0,0,0|2,0,0]=4 1083 B33R4.1850182764 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)C#N AIFCHEM-51312186766 [0,2,0,0,0,0|2,0,0]=4 1084 B33R4.1850182764 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)CO AIFCHEM-58543391016 [0,2,0,0,0,0|2,0,0]=4 1085 B33R4.1850182764 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)OC AIFCHEM-59202394274 [0,2,0,0,0,0|2,0,0]=4 1086 B33R4.1850182764 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC(CC4)OC AIFCHEM-61784452522 [0,2,0,0,0,0|2,0,0]=4 1087 B33R4.1850182764 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)C#N AIFCHEM-51311271264 [0,2,0,0,0,0|2,0,0]=4 1088 B33R4.1850182764 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)CO AIFCHEM-58540133054 [0,2,0,0,0,0|2,0,0]=4 1089 B33R4.1850182764 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)OC AIFCHEM-59198963492 [0,2,0,0,0,0|2,0,0]=4 1090 B33R4.1850182764 COc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC(CC4)OC AIFCHEM-61788032750 [0,2,0,0,0,0|2,0,0]=4 1091 B33R4.1850182764 COc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)C#N AIFCHEM-51312019112 [0,2,0,0,0,0|2,0,0]=4 1092 B33R4.1850182764 COc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)CO AIFCHEM-58543310602 [0,2,0,0,0,0|2,0,0]=4 1093 B33R4.1850182764 COc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)OC AIFCHEM-59202297640 [0,2,0,0,0,0|2,0,0]=4 1094 B33R4.1850182764 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC(CC4)OC AIFCHEM-61788305643 [0,2,0,0,0,0|0,0,0]=2 1095 B33R4.1850182764 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)C#N AIFCHEM-51312322425 [0,2,0,0,0,0|0,0,0]=2 1096 B33R4.1850182764 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)CO AIFCHEM-58543457235 [0,2,0,0,0,0|0,0,0]=2 1097 B33R4.1850182764 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)OC AIFCHEM-59202460493 [0,2,0,0,0,0|0,0,0]=2 1098 B33R4.1850182764 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCC(CC4)OC AIFCHEM-61790080642 [0,2,0,0,0,0|1,0,0]=3 1099 B33R4.1850182764 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)C#N AIFCHEM-51313086944 [0,2,0,0,0,0|1,0,0]=3 1100 B33R4.1850182764 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)CO AIFCHEM-58546052994 [0,2,0,0,0,0|1,0,0]=3 1101 B33R4.1850182764 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CC[C@@H](CC4)OC AIFCHEM-59202885552 [0,2,0,0,0,0|1,0,0]=3 1102 B33R4.151932130 COc1ccc(cc1C(C)(C)C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-85430222237 [0,2,0,0,0,0|2,0,0]=4 1103 B33R4.151932130 COc1ccc(cc1C(C)(C)C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-81748658004 [0,2,0,0,0,0|2,0,0]=4 1104 B33R4.151932130 COc1ccc(cc1C(C)(C)C)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCCOC4 AIFCHEM-82007554356 [0,2,0,0,0,0|2,0,0]=4 1105 B33R4.396935250 CNC(=O)c1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-88179580058 [0,2,0,0,0,0|1,0,0]=3 1106 B33R4.396935250 CNC(=O)c1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-90181169919 [0,2,0,0,0,0|2,0,0]=4 1107 B33R4.396935250 CNC(=O)c1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-85438228729 [0,2,0,0,0,0|2,0,0]=4 1108 B33R4.396935250 CNC(=O)c1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-81761019896 [0,2,0,0,0,0|2,0,0]=4 1109 B33R4.396935250 CNC(=O)c1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-86082370475 [0,2,0,0,0,0|2,0,0]=4 1110 B33R4.396935250 CNC(=O)c1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCCOC4 AIFCHEM-82019707348 [0,2,0,0,0,0|2,0,0]=4 1111 B33R4.396935250 CNC(=O)c1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-88186919025 [0,2,0,0,0,0|2,0,0]=4 1112 B33R4.396935250 COC(=O)c1ccc(cc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-88169320978 [0,2,0,0,0,0|2,0,0]=4 1113 B33R4.21617041 COc1cc(ccc1OCCO)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-88169401612 [0,2,0,0,0,0|2,0,0]=4 1114 B33R4.191832539 CCOc1ccc(cc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCC(C4)O AIFCHEM-75410491902 [0,2,0,0,0,0|2,0,0]=4 1115 B33R4.191832539 CCOc1ccc(cc1OC)c2ccc3[nH]nc(c3c2)NC(=O)[C@H]4CCC[C@H](C4)O AIFCHEM-70389679555 [0,2,0,0,0,0|2,0,0]=4 1116 B33R4.60251676 COc1cc(cc(c1OC)OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-88179504287 [0,2,0,0,0,0|2,0,0]=4 1117 B33R4.60251676 COc1cc(cc(c1OC)OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CC=CCC4 AIFCHEM-83049980194 [0,2,0,0,0,0|0,0,2]=4 1118 B33R4.60251676 COc1cc(cc(c1OC)OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-88169315533 [0,2,0,0,0,0|0,0,0]=2 1119 B33R4.60251676 COc1cc(cc(c1OC)OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-90168594794 [0,2,0,0,0,0|1,0,0]=3 1120 B33R4.60251676 COc1cc(cc(c1OC)OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-85429876164 [0,2,0,0,0,0|1,0,0]=3 1121 B33R4.60251676 COc1cc(cc(c1OC)OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-81748524931 [0,2,0,0,0,0|1,0,0]=3 1122 B33R4.60251676 COc1cc(cc(c1OC)OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-86071282630 [0,2,0,0,0,0|1,0,0]=3 1123 B33R4.60251676 COc1cc(cc(c1OC)OC)c2cnc3[nH]cc(c3c2)NC(=O)C4COCCO4 AIFCHEM-93761532754 [0,2,0,0,0,0|2,0,0]=4 1124 B33R4.60251676 COc1cc(cc(c1OC)OC)c2cnc3[nH]cc(c3c2)NC(=O)C4SCCCS4 AIFCHEM-90015025848 [0,2,0,0,0,0|2,0,0]=4 1125 B33R4.60251676 COc1cc(cc(c1OC)OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CC=CCC4 AIFCHEM-92700801082 [0,2,0,0,0,0|0,0,2]=4 1126 B33R4.60251676 COc1cc(cc(c1OC)OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4COCCO4 AIFCHEM-79410734629 [0,2,0,0,0,0|2,0,0]=4 1127 B33R4.60251676 COc1cc(cc(c1OC)OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC=CCC4 AIFCHEM-91179361922 [0,2,0,0,0,0|0,0,2]=4 1128 B33R4.60251676 COc1cc(cc(c1OC)OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCCOC4 AIFCHEM-82007169783 [0,2,0,0,0,0|1,0,0]=3 1129 B33R4.60251676 COc1cc(cc(c1OC)OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4COCCO4 AIFCHEM-89414731934 [0,2,0,0,0,0|2,0,0]=4 1130 B33R4.60251676 COc1cc(cc(c1OC)OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-88186837274 [0,2,0,0,0,0|1,0,0]=3 1131 B33R4.60251676 COc1cc(cc(c1OC)OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-90188847195 [0,2,0,0,0,0|2,0,0]=4 1132 B33R4.60251676 COc1cc(cc(c1OC)OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-85441481225 [0,2,0,0,0,0|2,0,0]=4 1133 B33R4.60251676 COc1cc(cc(c1OC)OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-81766953392 [0,2,0,0,0,0|2,0,0]=4 1134 B33R4.60251676 COc1cc(cc(c1OC)OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-86087697631 [0,2,0,0,0,0|2,0,0]=4 1135 B33R4.60251676 COc1cc(cc(c1OC)OC)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CCCOC4 AIFCHEM-82025033904 [0,2,0,0,0,0|2,0,0]=4 1136 B33R4.89861030 CCCOc1cc(ccc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-90168657496 [0,2,0,0,0,0|1,0,0]=3 1137 B33R4.89861030 CCCOc1cc(ccc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-85429911626 [0,2,0,0,0,0|1,0,0]=3 1138 B33R4.89861030 CCCOc1cc(ccc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-81748541413 [0,2,0,0,0,0|1,0,0]=3 1139 B33R4.89861030 CCCOc1cc(ccc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4COCCO4 AIFCHEM-93761562696 [0,2,0,0,0,0|2,0,0]=4 1140 B33R4.89861030 CCCOc1cc(ccc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CC=CCC4 AIFCHEM-92700860724 [0,2,0,0,0,0|0,0,2]=4 1141 B33R4.89861030 CCCOc1cc(ccc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4COCCO4 AIFCHEM-79410751111 [0,2,0,0,0,0|2,0,0]=4 1142 B33R4.89861030 CCCOc1cc(ccc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCCOC4 AIFCHEM-82007217585 [0,2,0,0,0,0|1,0,0]=3 1143 B33R4.89861030 CCCOc1cc(ccc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4COCCO4 AIFCHEM-89414779016 [0,2,0,0,0,0|2,0,0]=4 1144 B33R4.89861030 CCCOc1cc(ccc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-88169279356 [0,2,0,0,0,0|1,0,0]=3 1145 B33R4.89861030 CCCOc1cc(ccc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-90168507037 [0,2,0,0,0,0|2,0,0]=4 1146 B33R4.89861030 CCCOc1cc(ccc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-85429833647 [0,2,0,0,0,0|2,0,0]=4 1147 B33R4.89861030 CCCOc1cc(ccc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-81748501814 [0,2,0,0,0,0|2,0,0]=4 1148 B33R4.89861030 CCCOc1cc(ccc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-86071223573 [0,2,0,0,0,0|2,0,0]=4 1149 B33R4.89861030 CCCOc1cc(ccc1OC)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CCCOC4 AIFCHEM-82007102866 [0,2,0,0,0,0|2,0,0]=4 1150 B33R4.421403262 COc1cc(c(cc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCC4)C#N AIFCHEM-88169210428 [0,2,0,0,0,0|2,0,0]=4 1151 B33R4.421403262 COc1cc(c(cc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCC4)CO AIFCHEM-88179157839 [0,2,0,0,0,0|2,0,0]=4 1152 B33R4.421403262 COc1cc(c(cc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCC4)OC AIFCHEM-88179482049 [0,2,0,0,0,0|2,0,0]=4 1153 B33R4.421403274 COc1cc(c(cc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCC(C4)O)F AIFCHEM-92497501488 [0,2,0,0,0,0|2,0,0]=4 1154 B33R4.421403274 COc1cc(c(cc1OC)c2ccc3[nH]nc(c3c2)NC(=O)[C@H]4CCC[C@H](C4)O)F AIFCHEM-86117034167 [0,2,0,0,0,0|2,0,0]=4 1155 B33R4.413141298 COc1ccc(c(c1OC)OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-88179249113 [0,2,0,0,0,0|2,0,0]=4 1156 B33R4.413141298 COc1ccc(c(c1OC)OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CC=CCC4 AIFCHEM-83049899332 [0,2,0,0,0,0|0,0,2]=4 1157 B33R4.413141298 COc1ccc(c(c1OC)OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-88169149571 [0,2,0,0,0,0|0,0,0]=2 1158 B33R4.413141298 COc1ccc(c(c1OC)OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-90168287672 [0,2,0,0,0,0|1,0,0]=3 1159 B33R4.413141298 COc1ccc(c(c1OC)OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-85429727802 [0,2,0,0,0,0|1,0,0]=3 1160 B33R4.413141298 COc1ccc(c(c1OC)OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-81748438549 [0,2,0,0,0,0|1,0,0]=3 1161 B33R4.413141298 COc1ccc(c(c1OC)OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-86071081588 [0,2,0,0,0,0|1,0,0]=3 1162 B33R4.413141298 COc1ccc(c(c1OC)OC)c2cnc3[nH]cc(c3c2)NC(=O)C4COCCO4 AIFCHEM-93761449592 [0,2,0,0,0,0|2,0,0]=4 1163 B33R4.413141298 COc1ccc(c(c1OC)OC)c2cnc3[nH]cc(c3c2)NC(=O)C4SCCCS4 AIFCHEM-90014849486 [0,2,0,0,0,0|2,0,0]=4 1164 B33R4.413141298 COc1ccc(c(c1OC)OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CC=CCC4 AIFCHEM-92700514580 [0,2,0,0,0,0|0,0,2]=4 1165 B33R4.413141298 COc1ccc(c(c1OC)OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4COCCO4 AIFCHEM-79410653767 [0,2,0,0,0,0|2,0,0]=4 1166 B33R4.413141298 COc1ccc(c(c1OC)OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC=CCC4 AIFCHEM-91179273760 [0,2,0,0,0,0|0,0,2]=4 1167 B33R4.413141298 COc1ccc(c(c1OC)OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCCOC4 AIFCHEM-82006982641 [0,2,0,0,0,0|1,0,0]=3 1168 B33R4.413141298 COc1ccc(c(c1OC)OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4COCCO4 AIFCHEM-89414499212 [0,2,0,0,0,0|2,0,0]=4 1169 B33R4.413141298 COc1ccc(c(c1OC)OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-88179529588 [0,2,0,0,0,0|1,0,0]=3 1170 B33R4.413141298 COc1ccc(c(c1OC)OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-90181105889 [0,2,0,0,0,0|2,0,0]=4 1171 B33R4.413141298 COc1ccc(c(c1OC)OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-85438161659 [0,2,0,0,0,0|2,0,0]=4 1172 B33R4.413141298 COc1ccc(c(c1OC)OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-81760978486 [0,2,0,0,0,0|2,0,0]=4 1173 B33R4.413141298 COc1ccc(c(c1OC)OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-86082245805 [0,2,0,0,0,0|2,0,0]=4 1174 B33R4.413141298 COc1ccc(c(c1OC)OC)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CCCOC4 AIFCHEM-82019645938 [0,2,0,0,0,0|2,0,0]=4 1175 B33R4.1583046163 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4(CCOCC4)C#N AIFCHEM-59960861514 [0,2,0,0,0,0|2,0,0]=4 1176 B31R4.16366173 COc1ccc(cc1OC)c2ccc3cc(nn3c2)NC(=O)C4CCCCC4 AIFCHEM-98027657624 [0,0,1,1,0,0|2,0,0]=4 1177 B31R4.16366173 COc1ccc(cc1OC)c2ccc3nc(cn3c2)NC(=O)C4CCCCC4 AIFCHEM-61907422390 [0,0,1,1,0,0|2,0,0]=4 1178 B31R4.16366083 COc1ccc(cc1OC)c2c[nH]c3c2cc(cn3)NC(=O)C4CCCCC4 AIFCHEM-61907243326 [0,0,1,1,0,0|0,0,2]=4 1179 B31R4.516118347 COc1ccc(cc1OC)c2cccn3c2cc(n3)NC(=O)C4CCCCC4 AIFCHEM-98027574429 [0,0,1,1,0,0|2,0,0]=4 1180 B31R4.139067658 COc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCCC4 AIFCHEM-48820626239 [0,0,1,1,0,0|2,0,0]=4 1181 B31R4.139067658 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCCC4 AIFCHEM-48822575483 [0,0,1,1,0,0|1,0,0]=3 1182 B31R4.139067658 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCOC4 AIFCHEM-51718653043 [0,0,1,1,0,0|2,0,0]=4 1183 B31R4.139067658 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C[C@@H]4CCOC4 AIFCHEM-51071591623 [0,0,1,1,0,0|2,0,0]=4 1184 B31R4.139067658 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)CC4CCCC4 AIFCHEM-48822419184 [0,0,1,1,0,0|2,0,0]=4 1185 B31R4.139067658 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCCC4 AIFCHEM-48820729142 [0,0,1,1,0,0|2,0,0]=4 1186 B31R4.139067658 COc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCCC4 AIFCHEM-48822338770 [0,0,1,1,0,0|2,0,0]=4 1187 B31R4.139067658 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCCC4 AIFCHEM-48822485403 [0,0,1,1,0,0|0,0,0]=2 1188 B31R4.139067658 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCOC4 AIFCHEM-51718496323 [0,0,1,1,0,0|1,0,0]=3 1189 B31R4.139067658 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C[C@@H]4CCOC4 AIFCHEM-51071501543 [0,0,1,1,0,0|1,0,0]=3 1190 B31R4.139067658 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)CC4CCCC4 AIFCHEM-48822875322 [0,0,1,1,0,0|1,0,0]=3 1191 B31R4.139067658 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)CC4CCOC4 AIFCHEM-51719212122 [0,0,1,1,0,0|2,0,0]=4 1192 B31R4.139067658 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C[C@@H]4CCOC4 AIFCHEM-51072439582 [0,0,1,1,0,0|2,0,0]=4 1193 B31R4.1170324347 COc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)CCC4CCC4 AIFCHEM-59998798670 [0,0,1,1,0,0|2,0,0]=4 1194 B31R4.1170324347 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)CCC4CCC4 AIFCHEM-60005400934 [0,0,1,1,0,0|1,0,0]=3 1195 B31R4.1170324347 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)CCC4CCC4 AIFCHEM-60005244615 [0,0,1,1,0,0|2,0,0]=4 1196 B31R4.1170324347 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)CCC4CCC4 AIFCHEM-59998967333 [0,0,1,1,0,0|2,0,0]=4 1197 B31R4.1170324347 COc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)CCC4CCC4 AIFCHEM-60005164201 [0,0,1,1,0,0|2,0,0]=4 1198 B31R4.1170324347 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)CCC4CCC4 AIFCHEM-60005310834 [0,0,1,1,0,0|0,0,0]=2 1199 B31R4.1170324347 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)CCC4CCC4 AIFCHEM-60007338393 [0,0,1,1,0,0|1,0,0]=3 1200 B31R4.1256973047 C#CCCCCC(=O)Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4 AIFCHEM-55109688566 [0,0,1,1,0,0|0,0,2]=4 1201 B31R4.1256973047 COCCOCC(=O)Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4 AIFCHEM-51596020149 [0,0,1,1,0,0|2,0,0]=4 1202 B31R4.1170324561 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CC(C4)OC AIFCHEM-56747048777 [0,0,1,1,0,0|2,0,0]=4 1203 B31R4.1170324561 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4C[C@@H](C4)OC AIFCHEM-50742868556 [0,0,1,1,0,0|2,0,0]=4 1204 B31R4.1170324561 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CC(C4)OC AIFCHEM-56746958697 [0,0,1,1,0,0|1,0,0]=3 1205 B31R4.1170324561 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4C[C@@H](C4)OC AIFCHEM-50742778476 [0,0,1,1,0,0|1,0,0]=3 1206 B31R4.1170324561 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CC(C4)OC AIFCHEM-56747848616 [0,0,1,1,0,0|2,0,0]=4 1207 B31R4.1170324561 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4C[C@@H](C4)OC AIFCHEM-50743733815 [0,0,1,1,0,0|2,0,0]=4 1208 B31R5.184061496 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)CCC4)C5CCCCO5 AIFCHEM-39086974994 [1,0,0,1,0,0|2,0,0]=4 1209 B31R5.184061496 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)CCC4)C5CCCOC5 AIFCHEM-44971852408 [1,0,0,1,0,0|2,0,0]=4 1210 B31R5.184061496 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)CCC4)C5CCOCC5 AIFCHEM-46592820748 [1,0,0,1,0,0|2,0,0]=4 1211 B31R5.184061496 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)CCC4)C5CCSCC5 AIFCHEM-39911636388 [1,0,0,1,0,0|2,0,0]=4 1212 B31R5.184061496 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)CCO4)C5CC=CCC5 AIFCHEM-60300184157 [1,0,0,1,0,0|0,0,2]=4 1213 B31R5.184061496 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)CCO4)C5CCCCC5 AIFCHEM-61904803930 [1,0,0,1,0,0|0,0,0]=2 1214 B31R5.184061496 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)CCO4)C5CCCCO5 AIFCHEM-57039619821 [1,0,0,1,0,0|1,0,0]=3 1215 B31R5.184061496 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)CCO4)C5CCCOC5 AIFCHEM-60360820981 [1,0,0,1,0,0|1,0,0]=3 1216 B31R5.184061496 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)CCO4)C5CCOCC5 AIFCHEM-57222523605 [1,0,0,1,0,0|1,0,0]=3 1217 B31R5.184061496 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)CCO4)C5CCSCC5 AIFCHEM-63309774217 [1,0,0,1,0,0|1,0,0]=3 1218 B31R5.184061496 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)CCO4)C5COCCO5 AIFCHEM-63284653013 [1,0,0,1,0,0|2,0,0]=4 1219 B31R5.184061496 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)CCO4)C5SCCCS5 AIFCHEM-53197032046 [1,0,0,1,0,0|2,0,0]=4 1220 B31R5.184061496 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)CCO4)[C@@H]5CC=CCC5 AIFCHEM-61352666959 [1,0,0,1,0,0|0,0,2]=4 1221 B31R5.184061496 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)CCO4)[C@@H]5COCCO5 AIFCHEM-54375106121 [1,0,0,1,0,0|2,0,0]=4 1222 B31R5.184061496 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)CCO4)[C@H]5CC=CCC5 AIFCHEM-61307685095 [1,0,0,1,0,0|0,0,2]=4 1223 B31R5.184061496 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)CCO4)[C@H]5COCCO5 AIFCHEM-52628993310 [1,0,0,1,0,0|2,0,0]=4 1224 B31R5.184061496 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCC4)C5CCCCC5 AIFCHEM-61904649778 [1,0,0,1,0,0|1,0,0]=3 1225 B31R5.184061496 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCC4)C5CCCCO5 AIFCHEM-57039403509 [1,0,0,1,0,0|2,0,0]=4 1226 B31R5.184061496 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCC4)C5CCCOC5 AIFCHEM-60360666829 [1,0,0,1,0,0|2,0,0]=4 1227 B31R5.184061496 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCC4)C5CCOCC5 AIFCHEM-57222369453 [1,0,0,1,0,0|2,0,0]=4 1228 B31R5.184061496 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCC4)C5CCSCC5 AIFCHEM-63309620065 [1,0,0,1,0,0|2,0,0]=4 1229 B31R5.184061496 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCO4)C5CC=CCC5 AIFCHEM-60299910370 [1,0,0,1,0,0|0,0,2]=4 1230 B31R5.184061496 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCO4)C5CCCCC5 AIFCHEM-61904530143 [1,0,0,1,0,0|0,0,0]=2 1231 B31R5.184061496 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCO4)C5CCCCO5 AIFCHEM-57039283874 [1,0,0,1,0,0|1,0,0]=3 1232 B31R5.184061496 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCO4)C5CCCOC5 AIFCHEM-60360547194 [1,0,0,1,0,0|1,0,0]=3 1233 B31R5.184061496 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCO4)C5CCOCC5 AIFCHEM-57222249818 [1,0,0,1,0,0|1,0,0]=3 1234 B31R5.184061496 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCO4)C5CCSCC5 AIFCHEM-63309500430 [1,0,0,1,0,0|1,0,0]=3 1235 B31R5.184061496 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCO4)C5COCCO5 AIFCHEM-63284268206 [1,0,0,1,0,0|2,0,0]=4 1236 B31R5.184061496 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCO4)C5SCCCS5 AIFCHEM-53196721619 [1,0,0,1,0,0|2,0,0]=4 1237 B31R5.184061496 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCO4)[C@@H]5CC=CCC5 AIFCHEM-61352393172 [1,0,0,1,0,0|0,0,2]=4 1238 B31R5.184061496 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCO4)[C@@H]5COCCO5 AIFCHEM-54374832334 [1,0,0,1,0,0|2,0,0]=4 1239 B31R5.184061496 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCO4)[C@H]5CC=CCC5 AIFCHEM-61307389268 [1,0,0,1,0,0|0,0,2]=4 1240 B31R5.184061496 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCO4)[C@H]5COCCO5 AIFCHEM-52628719523 [1,0,0,1,0,0|2,0,0]=4 1241 B31R5.184061496 O=C(Nc1n[nH]c2c1cc(cn2)c3ccc4c(c3)CCC4)C5CCCCC5 AIFCHEM-61909023366 [1,0,0,1,0,0|2,0,0]=4 1242 B31R5.184061496 O=C(Nc1n[nH]c2c1cc(cn2)c3ccc4c(c3)CCO4)C5CCCCC5 AIFCHEM-61907077969 [1,0,0,1,0,0|1,0,0]=3 1243 B31R5.184061496 O=C(Nc1n[nH]c2c1cc(cn2)c3ccc4c(c3)CCO4)C5CCCCO5 AIFCHEM-57040468540 [1,0,0,1,0,0|2,0,0]=4 1244 B31R5.184061496 O=C(Nc1n[nH]c2c1cc(cn2)c3ccc4c(c3)CCO4)C5CCCOC5 AIFCHEM-60363753749 [1,0,0,1,0,0|2,0,0]=4 1245 B31R5.184061496 O=C(Nc1n[nH]c2c1cc(cn2)c3ccc4c(c3)CCO4)C5CCOCC5 AIFCHEM-57224151144 [1,0,0,1,0,0|2,0,0]=4 1246 B31R5.184061496 O=C(Nc1n[nH]c2c1cc(cn2)c3ccc4c(c3)CCO4)C5CCSCC5 AIFCHEM-63310998476 [1,0,0,1,0,0|2,0,0]=4 1247 B31R5.184061496 O=C(Nc1n[nH]c2c1cc(cn2)c3ccc4c(c3)OCC4)C5CCCCC5 AIFCHEM-61909029709 [1,0,0,1,0,0|2,0,0]=4 1248 B31R5.184061496 O=C(Nc1n[nH]c2c1cc(cn2)c3ccc4c(c3)OCO4)C5CCCCC5 AIFCHEM-61904726774 [1,0,0,1,0,0|1,0,0]=3 1249 B31R5.184061496 O=C(Nc1n[nH]c2c1cc(cn2)c3ccc4c(c3)OCO4)C5CCCCO5 AIFCHEM-57039487145 [1,0,0,1,0,0|2,0,0]=4 1250 B31R5.184061496 O=C(Nc1n[nH]c2c1cc(cn2)c3ccc4c(c3)OCO4)C5CCCOC5 AIFCHEM-60360743825 [1,0,0,1,0,0|2,0,0]=4 1251 B31R5.184061496 O=C(Nc1n[nH]c2c1cc(cn2)c3ccc4c(c3)OCO4)C5CCOCC5 AIFCHEM-57222446449 [1,0,0,1,0,0|2,0,0]=4 1252 B31R5.82199861 O=C(c1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)N5CCCOC5 AIFCHEM-81026807610 [0,0,0,1,1,0|2,0,0]=4 1253 B31R5.350763249 CN1CCc2c1cc(cc2)c3cnc4[nH]cc(c4c3)NC(=O)C5CCCC5 AIFCHEM-72555570609 [0,0,0,1,1,0|2,0,0]=4 1254 B31R5.445048705 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)CCCO4)C5CCCC5 AIFCHEM-88710419302 [0,0,0,1,1,0|1,0,0]=3 1255 B31R5.445048705 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)CCCO4)C5CCCO5 AIFCHEM-88710337297 [0,0,0,1,1,0|2,0,0]=4 1256 B31R5.445048705 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)CCCO4)C5CCOC5 AIFCHEM-88710401913 [0,0,0,1,1,0|2,0,0]=4 1257 B31R5.445048705 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)CCCO4)[C@@H]5CCCO5 AIFCHEM-88710304037 [0,0,0,1,1,0|2,0,0]=4 1258 B31R5.445048705 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)CCCO4)[C@@H]5CCOC5 AIFCHEM-88710194428 [0,0,0,1,1,0|2,0,0]=4 1259 B31R5.445048705 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)CCCO4)[C@H]5CCCO5 AIFCHEM-88710518575 [0,0,0,1,1,0|2,0,0]=4 1260 B31R5.445048705 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)CCCO4)[C@H]5CCOC5 AIFCHEM-88710592824 [0,0,0,1,1,0|2,0,0]=4 1261 B31R5.445048705 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)NCCO4)C5CCCC5 AIFCHEM-91741870722 [0,0,0,1,1,0|1,0,0]=3 1262 B31R5.445048705 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)NCCO4)C5CCCO5 AIFCHEM-91741839237 [0,0,0,1,1,0|2,0,0]=4 1263 B31R5.445048705 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)NCCO4)C5CCOC5 AIFCHEM-91741862073 [0,0,0,1,1,0|2,0,0]=4 1264 B31R5.445048705 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)NCCO4)[C@@H]5CCCO5 AIFCHEM-91741827977 [0,0,0,1,1,0|2,0,0]=4 1265 B31R5.445048705 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)NCCO4)[C@@H]5CCOC5 AIFCHEM-91741791128 [0,0,0,1,1,0|2,0,0]=4 1266 B31R5.445048705 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)NCCO4)[C@H]5CCCO5 AIFCHEM-91741920235 [0,0,0,1,1,0|2,0,0]=4 1267 B31R5.445048705 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)NCCO4)[C@H]5CCOC5 AIFCHEM-91741974504 [0,0,0,1,1,0|2,0,0]=4 1268 B31R5.445048705 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCCN4)C5CCCC5 AIFCHEM-85315026166 [0,0,0,1,1,0|1,0,0]=3 1269 B31R5.445048705 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCCN4)C5CCCO5 AIFCHEM-85314909841 [0,0,0,1,1,0|2,0,0]=4 1270 B31R5.445048705 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCCN4)C5CCOC5 AIFCHEM-85314994237 [0,0,0,1,1,0|2,0,0]=4 1271 B31R5.445048705 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCCN4)[C@@H]5CCCO5 AIFCHEM-85314869161 [0,0,0,1,1,0|2,0,0]=4 1272 B31R5.445048705 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCCN4)[C@@H]5CCOC5 AIFCHEM-85314725732 [0,0,0,1,1,0|2,0,0]=4 1273 B31R5.445048705 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCCN4)[C@H]5CCCO5 AIFCHEM-85315211279 [0,0,0,1,1,0|2,0,0]=4 1274 B31R5.445048705 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCCN4)[C@H]5CCOC5 AIFCHEM-85315343968 [0,0,0,1,1,0|2,0,0]=4 1275 B31R5.445048705 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)C5CC=CC5 AIFCHEM-62558217111 [0,0,0,1,1,0|0,0,2]=4 1276 B31R5.445048705 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)C5CCCC5 AIFCHEM-81026743812 [0,0,0,1,1,0|0,0,0]=2 1277 B31R5.445048705 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)C5CCCO5 AIFCHEM-81026712327 [0,0,0,1,1,0|1,0,0]=3 1278 B31R5.445048705 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)C5CCCS5 AIFCHEM-52799536756 [0,0,0,1,1,0|1,0,0]=3 1279 B31R5.445048705 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)C5CCOC5 AIFCHEM-60895287651 [0,0,0,1,1,0|1,0,0]=3 1280 B31R5.445048705 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)[C@@H]5CCCO5 AIFCHEM-81026701067 [0,0,0,1,1,0|1,0,0]=3 1281 B31R5.445048705 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)[C@@H]5CCOC5 AIFCHEM-81026664218 [0,0,0,1,1,0|1,0,0]=3 1282 B31R5.445048705 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)[C@H]5CCCO5 AIFCHEM-63124656233 [0,0,0,1,1,0|1,0,0]=3 1283 B31R5.445048705 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)[C@H]5CCOC5 AIFCHEM-88934128093 [0,0,0,1,1,0|1,0,0]=3 1284 B31R5.445048705 O=C(Nc1c[nH]c2c1cc(cn2)c3cnc4c(c3)NCCO4)C5CCCC5 AIFCHEM-94319582400 [0,0,0,1,1,0|2,0,0]=4 1285 B31R5.445048705 O=C(Nc1n[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)C5CCCC5 AIFCHEM-55468685591 [0,0,0,1,1,0|1,0,0]=3 1286 B31R5.445048705 O=C(Nc1n[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)C5CCCO5 AIFCHEM-51941223448 [0,0,0,1,1,0|2,0,0]=4 1287 B31R5.445048705 O=C(Nc1n[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)C5CCCS5 AIFCHEM-52799360198 [0,0,0,1,1,0|2,0,0]=4 1288 B31R5.445048705 O=C(Nc1n[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)C5CCOC5 AIFCHEM-60895111093 [0,0,0,1,1,0|2,0,0]=4 1289 B31R5.445048705 O=C(Nc1n[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)[C@@H]5CCCO5 AIFCHEM-60337935652 [0,0,0,1,1,0|2,0,0]=4 1290 B31R5.445048705 O=C(Nc1n[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)[C@@H]5CCOC5 AIFCHEM-62193286574 [0,0,0,1,1,0|2,0,0]=4 1291 B31R5.445048705 O=C(Nc1n[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)[C@H]5CCCO5 AIFCHEM-63124479675 [0,0,0,1,1,0|2,0,0]=4 1292 B31R5.445048705 O=C(Nc1n[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)[C@H]5CCOC5 AIFCHEM-51922122047 [0,0,0,1,1,0|2,0,0]=4 1293 B31R5.49957316 O=C(Nc1c[nH]c2c1cc(cn2)c3scc4c3OCCO4)C5CCCCC5 AIFCHEM-61904954494 [0,0,0,1,1,0|1,0,0]=3 1294 B31R5.49957316 O=C(Nc1c[nH]c2c1cc(cn2)c3scc4c3OCCO4)C5CCCCO5 AIFCHEM-57039905985 [0,0,0,1,1,0|2,0,0]=4 1295 B31R5.49957316 O=C(Nc1c[nH]c2c1cc(cn2)c3scc4c3OCCO4)C5CCCOC5 AIFCHEM-60360971545 [0,0,0,1,1,0|2,0,0]=4 1296 B31R5.49957316 O=C(Nc1c[nH]c2c1cc(cn2)c3scc4c3OCCO4)C5CCOCC5 AIFCHEM-57222674169 [0,0,0,1,1,0|2,0,0]=4 1297 B31R5.49957316 O=C(Nc1n[nH]c2c1cc(cn2)c3scc4c3OCCO4)C5CCCCC5 AIFCHEM-61904846184 [0,0,0,1,1,0|2,0,0]=4 1298 B33R5.139213684 COc1cc(cnc1OC)c2cnc3cccc(c3c2)NC(=O)C4C5C4CCC5 AIFCHEM-68448263892 [0,0,0,1,0,1|2,0,0]=4 1299 B33R5.330122643 O=C(Nc1cccc2c1cc(cn2)c3ccc4c(c3)OCCO4)C5CCCCC5 AIFCHEM-12485931875 [0,0,0,1,0,1|1,0,0]=3 1300 B33R5.330122643 O=C(Nc1cccc2c1cc(cn2)c3ccc4c(c3)OCCO4)C5CCCCO5 AIFCHEM-9715469604 [0,0,0,1,0,1|2,0,0]=4 1301 B33R5.330122643 O=C(Nc1cccc2c1cc(cn2)c3ccc4c(c3)OCCO4)C5CCCOC5 AIFCHEM-13204564073 [0,0,0,1,0,1|2,0,0]=4 1302 B33R5.330122643 O=C(Nc1cccc2c1cc(cn2)c3ccc4c(c3)OCCO4)C5CCOCC5 AIFCHEM-14065570619 [0,0,0,1,0,1|2,0,0]=4 1303 B33R5.330122643 O=C(Nc1cccc2c1cc(cn2)c3ccc4c(c3)OCCO4)C5CCSCC5 AIFCHEM-11252000993 [0,0,0,1,0,1|2,0,0]=4 1304 B33R5.330122643 O=C(Nc1cccc2c1cc(cn2)c3ccc4c(c3)OCCO4)[C@H]5CCCOC5 AIFCHEM-12119065948 [0,0,0,1,0,1|2,0,0]=4 1305 B33R5.139213842 COc1cc(cnc1OC)c2cnc3ccc(cc3c2)NC(=O)C4C5C4CCC5 AIFCHEM-68448240785 [0,0,0,1,0,1|2,0,0]=4 1306 B33R5.139213842 COc1ccc(cc1OC)c2cnc3ccc(cc3c2)NC(=O)C4C5C4CCC5 AIFCHEM-68448229304 [0,0,0,1,0,1|1,0,0]=3 1307 B33R5.139213842 COc1ccc(cc1OC)c2cnc3ccc(cc3c2)NC(=O)[C@H]4[C@H]5[C@@H]4COC5 AIFCHEM-74761998362 [0,0,0,1,0,1|2,0,0]=4 1308 B33R5.327735176 O=C(CC1CCCCC1)Nc2c[nH]c3c2cc(cn3)c4ccc5c(c4)OCCO5 AIFCHEM-57210126653 [0,0,0,1,0,1|0,0,0]=2 1309 B33R5.327735176 O=C(CC1CCCCC1)Nc2n[nH]c3c2cc(cn3)c4ccc5c(c4)OCCO5 AIFCHEM-57209950095 [0,0,0,1,0,1|1,0,0]=3 1310 B33R5.327735176 O=C(CC1CCCCO1)Nc2c[nH]c3c2cc(cn3)c4ccc5c(c4)OCCO5 AIFCHEM-50899886215 [0,0,0,1,0,1|1,0,0]=3 1311 B33R5.327735176 O=C(CC1CCCCO1)Nc2n[nH]c3c2cc(cn3)c4ccc5c(c4)OCCO5 AIFCHEM-50899655537 [0,0,0,1,0,1|2,0,0]=4 1312 B33R5.327735176 O=C(CC1CCCOC1)Nc2c[nH]c3c2cc(cn3)c4ccc5c(c4)OCCO5 AIFCHEM-48015529535 [0,0,0,1,0,1|1,0,0]=3 1313 B33R5.327735176 O=C(CC1CCCOC1)Nc2n[nH]c3c2cc(cn3)c4ccc5c(c4)OCCO5 AIFCHEM-48015352977 [0,0,0,1,0,1|2,0,0]=4 1314 B33R5.327735176 O=C(CC1CCOCC1)Nc2c[nH]c3c2cc(cn3)c4ccc5c(c4)OCCO5 AIFCHEM-62896357958 [0,0,0,1,0,1|1,0,0]=3 1315 B33R5.327735176 O=C(CC1CCOCC1)Nc2n[nH]c3c2cc(cn3)c4ccc5c(c4)OCCO5 AIFCHEM-62896181400 [0,0,0,1,0,1|2,0,0]=4 1316 B33R5.327735176 O=C(CC1CCSCC1)Nc2c[nH]c3c2cc(cn3)c4ccc5c(c4)OCCO5 AIFCHEM-51529173279 [0,0,0,1,0,1|1,0,0]=3 1317 B33R5.327735176 O=C(CC1CCSCC1)Nc2n[nH]c3c2cc(cn3)c4ccc5c(c4)OCCO5 AIFCHEM-51528996721 [0,0,0,1,0,1|2,0,0]=4 1318 B33R5.22345455 Cn1nc(c2c1ncc(c2)c3ccc4c(c3)OCCO4)NC(=O)C5CCCCC5 AIFCHEM-78987667864 [0,1,0,1,0,0|1,0,0]=3 1319 B33R5.22345455 Cn1nc(c2c1ncc(c2)c3ccc4c(c3)OCCO4)NC(=O)C5CCCCO5 AIFCHEM-74247060260 [0,1,0,1,0,0|2,0,0]=4 1320 B33R5.22345455 Cn1nc(c2c1ncc(c2)c3ccc4c(c3)OCCO4)NC(=O)C5CCCOC5 AIFCHEM-77638034402 [0,1,0,1,0,0|2,0,0]=4 1321 B33R5.22345455 Cn1nc(c2c1ncc(c2)c3ccc4c(c3)OCCO4)NC(=O)C5CCOCC5 AIFCHEM-74495594608 [0,1,0,1,0,0|2,0,0]=4 1322 B33R5.22345455 Cn1nc(c2c1ncc(c2)c3ccc4c(c3)OCCO4)NC(=O)C5CCSCC5 AIFCHEM-78088723856 [0,1,0,1,0,0|2,0,0]=4 1323 B33R5.101402101 CC1=CCC(CC1)C(=O)Nc2c[nH]c3c2cc(cn3)c4ccc5c(c4)OCCO5 AIFCHEM-59963682262 [0,1,0,1,0,0|0,0,2]=4 1324 B33R5.101402101 CC1CCC(CC1)C(=O)Nc2c[nH]c3c2cc(cn3)c4ccc5c(c4)OCCO5 AIFCHEM-59993289539 [0,1,0,1,0,0|0,0,0]=2 1325 B33R5.101402101 CC1CCC(CC1)C(=O)Nc2n[nH]c3c2cc(cn3)c4ccc5c(c4)OCCO5 AIFCHEM-59993112981 [0,1,0,1,0,0|1,0,0]=3 1326 B33R5.101402101 C[C@H]1CC[C@@H](CC1)C(=O)Nc2c[nH]c3c2cc(cn3)c4ccc5c(c4)OCCO5 AIFCHEM-50898170514 [0,1,0,1,0,0|0,0,0]=2 1327 B33R5.101402101 C[C@H]1CC[C@@H](CC1)C(=O)Nc2n[nH]c3c2cc(cn3)c4ccc5c(c4)OCCO5 AIFCHEM-50897993956 [0,1,0,1,0,0|1,0,0]=3 1328 B33R5.101402101 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)CCCC4)C5CCC(CC5)O AIFCHEM-52078054992 [0,1,0,1,0,0|2,0,0]=4 1329 B33R5.101402101 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)CCCC4)[C@H]5CC[C@H](CC5)O AIFCHEM-59275617863 [0,1,0,1,0,0|2,0,0]=4 1330 B33R5.101402101 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)C5CCC(CC5)O AIFCHEM-52079553681 [0,1,0,1,0,0|0,0,0]=2 1331 B33R5.101402101 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)[C@H]5CC[C@H](CC5)O AIFCHEM-59280009672 [0,1,0,1,0,0|0,0,0]=2 1332 B33R5.101402101 O=C1CCC(CN1)C(=O)Nc2c[nH]c3c2cc(cn3)c4ccc5c(c4)OCCO5 AIFCHEM-53906604820 [0,1,0,1,0,0|1,0,1]=4 1333 B33R5.383267241 CC1CCC(CC1)C(=O)Nc2c[nH]c3c2cc(cn3)c4ccc5c(c4)N(CC5)C AIFCHEM-73501873527 [0,1,0,1,0,0|2,0,0]=4 1334 B33R5.383267241 CN1CCc2c1cc(cc2)c3cnc4[nH]cc(c4c3)NC(=O)[C@H]5CC[C@@H](CC5)C AIFCHEM-66423942099 [0,1,0,1,0,0|2,0,0]=4 1335 B33R5.1029504014 Cc1nn(c2c1cc(cc2)c3cnc4[nH]cc(c4c3)NC(=O)C5CCCCC5)C AIFCHEM-78987595380 [0,1,0,1,0,0|2,0,0]=4 1336 B33R5.71636958 CN1CCOc2c1ccc(c2)c3cnc4[nH]cc(c4c3)NC(=O)C5CCCCC5 AIFCHEM-78989554058 [0,1,0,1,0,0|1,0,0]=3 1337 B33R5.71636958 CN1CCOc2c1ccc(c2)c3cnc4[nH]cc(c4c3)NC(=O)C5CCCCO5 AIFCHEM-74251185454 [0,1,0,1,0,0|2,0,0]=4 1338 B33R5.71636958 CN1CCOc2c1ccc(c2)c3cnc4[nH]cc(c4c3)NC(=O)C5CCCOC5 AIFCHEM-77642094176 [0,1,0,1,0,0|2,0,0]=4 1339 B33R5.71636958 CN1CCOc2c1ccc(c2)c3cnc4[nH]cc(c4c3)NC(=O)C5CCOCC5 AIFCHEM-74499037462 [0,1,0,1,0,0|2,0,0]=4 1340 B33R5.71636958 CN1CCOc2c1ccc(c2)c3cnc4[nH]cc(c4c3)NC(=O)C5CCSCC5 AIFCHEM-78090884790 [0,1,0,1,0,0|2,0,0]=4 1341 B33R5.71636958 CN1CCOc2c1ccc(c2)c3cnc4[nH]nc(c4c3)NC(=O)C5CCCCC5 AIFCHEM-78987559046 [0,1,0,1,0,0|2,0,0]=4 1342 B33R5.70889348 Cc1c2cc(ccc2nn1C)c3cnc4[nH]cc(c4c3)NC(=O)C5CCCCC5 AIFCHEM-78987595246 [0,1,0,1,0,0|2,0,0]=4 1343 B33R5.116315033 COc1cc(cc2c1OCO2)c3ccc4[nH]nc(c4c3)NC(=O)C5CCCCC5 AIFCHEM-78987563209 [0,1,0,1,0,0|2,0,0]=4 1344 B33R5.517952512 O=C(Nc1n[nH]c2c1cc(cn2)c3ccc4c(c3)OCCCO4)C5CCCCC5 AIFCHEM-78987490007 [0,1,0,1,0,0|1,0,0]=3 1345 B33R5.517952512 O=C(Nc1n[nH]c2c1cc(cn2)c3ccc4c(c3)OCCCO4)C5CCCCO5 AIFCHEM-74246882403 [0,1,0,1,0,0|2,0,0]=4 1346 B33R5.517952512 O=C(Nc1n[nH]c2c1cc(cn2)c3ccc4c(c3)OCCCO4)C5CCCOC5 AIFCHEM-77637856545 [0,1,0,1,0,0|2,0,0]=4 1347 B33R5.517952512 O=C(Nc1n[nH]c2c1cc(cn2)c3ccc4c(c3)OCCCO4)C5CCOCC5 AIFCHEM-74495320471 [0,1,0,1,0,0|2,0,0]=4 1348 B33R5.517952512 O=C(Nc1n[nH]c2c1cc(cn2)c3ccc4c(c3)OCCCO4)C5CCSCC5 AIFCHEM-78088498699 [0,1,0,1,0,0|2,0,0]=4 1349 B33R5.43917745 O=C1COc2ccc(cc2N1)c3cnc4[nH]cc(c4c3)NC(=O)C5CCCCC5 AIFCHEM-78987244935 [0,1,0,1,0,0|1,0,1]=4 1350 B33R5.114725826 COc1ccc(c2c1OCO2)c3ccc4[nH]nc(c4c3)NC(=O)C5CCCCC5 AIFCHEM-78987611968 [0,1,0,1,0,0|2,0,0]=4 1351 B33R5.12112348 O=C(Nc1n[nH]c2c1cc(cc2)c3cc4c(cc3F)OCCO4)C5CCCCC5 AIFCHEM-88179470208 [0,1,0,1,0,0|2,0,0]=4 1352 B33R5.210330035 CC1CCCCC1C(=O)Nc2c[nH]c3c2cc(cn3)c4ccc5c(c4)OCCO5 AIFCHEM-61261604649 [0,1,0,1,0,0|0,0,0]=2 1353 B33R5.210330035 CC1CCCCC1C(=O)Nc2n[nH]c3c2cc(cn3)c4ccc5c(c4)OCCO5 AIFCHEM-61261303111 [0,1,0,1,0,0|1,0,0]=3 1354 B33R5.310203604 CC1CCCC(C1)C(=O)Nc2c[nH]c3c2cc(cn3)c4ccc5c(c4)OCCO5 AIFCHEM-51071252492 [0,1,0,1,0,0|0,0,0]=2 1355 B33R5.310203604 CC1CCCC(C1)C(=O)Nc2n[nH]c3c2cc(cn3)c4ccc5c(c4)OCCO5 AIFCHEM-51071054014 [0,1,0,1,0,0|1,0,0]=3 1356 B33R5.310203604 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)CCCC4)C5CCCC(C5)O AIFCHEM-57979725844 [0,1,0,1,0,0|2,0,0]=4 1357 B33R5.310203604 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)CCCC4)[C@H]5CCC[C@H](C5)O AIFCHEM-56105739250 [0,1,0,1,0,0|2,0,0]=4 1358 B33R5.310203604 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)C5CCCC(C5)O AIFCHEM-57982125153 [0,1,0,1,0,0|0,0,0]=2 1359 B33R5.310203604 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)[C@H]5CCC[C@H](C5)O AIFCHEM-56107262339 [0,1,0,1,0,0|0,0,0]=2 1360 B33R5.310203604 O=C(Nc1n[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)C5CCCC(C5)O AIFCHEM-57981948595 [0,1,0,1,0,0|1,0,0]=3 1361 B33R5.310203604 O=C(Nc1n[nH]c2c1cc(cn2)c3ccc4c(c3)OCCO4)[C@H]5CCC[C@H](C5)O AIFCHEM-56107085781 [0,1,0,1,0,0|1,0,0]=3 1362 B33R5.310203604 O=C1CCCC(C1)C(=O)Nc2c[nH]c3c2cc(cn3)c4ccc5c(c4)OCCO5 AIFCHEM-51700251390 [0,1,0,1,0,0|0,0,1]=3 1363 B33R5.484110388 CC1CCCC(C1)C(=O)Nc2c[nH]c3c2cc(cn3)c4ccc5c(c4)N(CC5)C AIFCHEM-66643296720 [0,1,0,1,0,0|2,0,0]=4 1364 B29R3.7165733300 COCCCNC(=O)c1c[nH]c2c1cc(cn2)c3ccc(c(c3)OC)OC AIFCHEM-82894632307 [0,0,1,0,1,0|2,0,0]=4 1365 B29R3.8343923145 COCCN(C)C(=O)c1c[nH]c2c1cc(cn2)c3ccc(c(c3)OC)OC AIFCHEM-82894913247 [0,0,1,0,1,0|2,0,0]=4 1366 B29R4.12371551 COc1ccc(cc1C)c2cnc3[nH]cc(c3c2)C(=O)N4CCCOC4 AIFCHEM-10011909319 [1,0,0,0,1,0|2,0,0]=4 1367 B29R4.12371551 COc1ccc(cc1C)c2cnc3[nH]cc(c3c2)C(=O)N4CCSCC4 AIFCHEM-7569127075 [1,0,0,0,1,0|2,0,0]=4 1368 B29R4.12371551 COc1ccc(cc1O)c2cnc3[nH]cc(c3c2)C(=O)N4CCCOC4 AIFCHEM-84301697840 [1,0,0,0,1,0|2,0,0]=4 1369 B29R4.12371562 COc1ccc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CC=CC4 AIFCHEM-62552916246 [1,0,0,0,1,0|0,0,2]=4 1370 B29R4.12371562 COc1ccc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC4 AIFCHEM-55466318164 [1,0,0,0,1,0|0,0,0]=2 1371 B29R4.12371562 COc1ccc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCO4 AIFCHEM-85116994987 [1,0,0,0,1,0|1,0,0]=3 1372 B29R4.12371562 COc1ccc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCS4 AIFCHEM-52794188891 [1,0,0,0,1,0|1,0,0]=3 1373 B29R4.12371562 COc1ccc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOC4 AIFCHEM-85117030343 [1,0,0,0,1,0|1,0,0]=3 1374 B29R4.12371562 COc1ccc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CCCO4 AIFCHEM-85980261854 [1,0,0,0,1,0|1,0,0]=3 1375 B29R4.12371562 COc1ccc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CCOC4 AIFCHEM-85980225005 [1,0,0,0,1,0|1,0,0]=3 1376 B29R4.12371562 COc1ccc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCCO4 AIFCHEM-63121571408 [1,0,0,0,1,0|1,0,0]=3 1377 B29R4.12371562 COc1ccc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCOC4 AIFCHEM-85117189514 [1,0,0,0,1,0|1,0,0]=3 1378 B29R4.12371562 COc1ccc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCC4 AIFCHEM-55466500248 [1,0,0,0,1,0|1,0,0]=3 1379 B29R4.12371562 COc1ccc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCO4 AIFCHEM-51939390065 [1,0,0,0,1,0|2,0,0]=4 1380 B29R4.12371562 COc1ccc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCS4 AIFCHEM-52794262695 [1,0,0,0,1,0|2,0,0]=4 1381 B29R4.12371562 COc1ccc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCOC4 AIFCHEM-60891389790 [1,0,0,0,1,0|2,0,0]=4 1382 B29R4.12371562 COc1ccc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)[C@@H]4CCCO4 AIFCHEM-60334743449 [1,0,0,0,1,0|2,0,0]=4 1383 B29R4.12371562 COc1ccc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)[C@@H]4CCOC4 AIFCHEM-62189453191 [1,0,0,0,1,0|2,0,0]=4 1384 B29R4.12371562 COc1ccc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CCCO4 AIFCHEM-63121645212 [1,0,0,0,1,0|2,0,0]=4 1385 B29R4.12371562 COc1ccc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CCOC4 AIFCHEM-51920810404 [1,0,0,0,1,0|2,0,0]=4 1386 B29R4.12371562 COc1ccc(cc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC4 AIFCHEM-86756767819 [1,0,0,0,1,0|1,0,0]=3 1387 B29R4.12371562 COc1ccc(cc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCO4 AIFCHEM-91682977969 [1,0,0,0,1,0|2,0,0]=4 1388 B29R4.12371562 COc1ccc(cc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOC4 AIFCHEM-86756743130 [1,0,0,0,1,0|2,0,0]=4 1389 B29R4.12371562 COc1ccc(cc1F)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CCCO4 AIFCHEM-91682956189 [1,0,0,0,1,0|2,0,0]=4 1390 B29R4.12371562 COc1ccc(cc1F)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CCOC4 AIFCHEM-86756539725 [1,0,0,0,1,0|2,0,0]=4 1391 B29R4.12371562 COc1ccc(cc1F)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCCO4 AIFCHEM-91683135267 [1,0,0,0,1,0|2,0,0]=4 1392 B29R4.12371562 COc1ccc(cc1F)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCOC4 AIFCHEM-91683206796 [1,0,0,0,1,0|2,0,0]=4 1393 B29R4.12371562 COc1ccc(cc1F)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCC4 AIFCHEM-55466060994 [1,0,0,0,1,0|2,0,0]=4 1394 B29R4.12371562 COc1ccc(cc1N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC4 AIFCHEM-79302097391 [1,0,0,0,1,0|1,0,0]=3 1395 B29R4.12371562 COc1ccc(cc1N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCO4 AIFCHEM-79302034606 [1,0,0,0,1,0|2,0,0]=4 1396 B29R4.12371562 COc1ccc(cc1N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOC4 AIFCHEM-79302079822 [1,0,0,0,1,0|2,0,0]=4 1397 B29R4.12371562 COc1ccc(cc1N)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CCCO4 AIFCHEM-79302015546 [1,0,0,0,1,0|2,0,0]=4 1398 B29R4.12371562 COc1ccc(cc1N)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CCOC4 AIFCHEM-79301978697 [1,0,0,0,1,0|2,0,0]=4 1399 B29R4.12371562 COc1ccc(cc1N)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCCO4 AIFCHEM-79302192404 [1,0,0,0,1,0|2,0,0]=4 1400 B29R4.12371562 COc1ccc(cc1N)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCOC4 AIFCHEM-79302262913 [1,0,0,0,1,0|2,0,0]=4 1401 B29R4.12371562 COc1ccc(cc1O)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCC4 AIFCHEM-86732842386 [1,0,0,0,1,0|2,0,0]=4 1402 B29R4.12371562 COc1ccc(cc1O)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC4 AIFCHEM-55466332419 [1,0,0,0,1,0|0,0,0]=2 1403 B29R4.12371562 COc1ccc(cc1O)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCO4 AIFCHEM-84301291917 [1,0,0,0,1,0|1,0,0]=3 1404 B29R4.12371562 COc1ccc(cc1O)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCS4 AIFCHEM-52794194786 [1,0,0,0,1,0|1,0,0]=3 1405 B29R4.12371562 COc1ccc(cc1O)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOC4 AIFCHEM-82648909237 [1,0,0,0,1,0|1,0,0]=3 1406 B29R4.12371562 COc1ccc(cc1O)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CCCO4 AIFCHEM-84301235677 [1,0,0,0,1,0|1,0,0]=3 1407 B29R4.12371562 COc1ccc(cc1O)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CCOC4 AIFCHEM-62189385282 [1,0,0,0,1,0|1,0,0]=3 1408 B29R4.12371562 COc1ccc(cc1O)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCCO4 AIFCHEM-82649083759 [1,0,0,0,1,0|1,0,0]=3 1409 B29R4.12371562 COc1ccc(cc1O)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCOC4 AIFCHEM-84301787284 [1,0,0,0,1,0|1,0,0]=3 1410 B29R4.12371562 COc1ccc(cc1O)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCC4 AIFCHEM-55466646368 [1,0,0,0,1,0|1,0,0]=3 1411 B29R4.12371562 COc1ncc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC4 AIFCHEM-88933780814 [1,0,0,0,1,0|1,0,0]=3 1412 B29R4.12371562 COc1ncc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCO4 AIFCHEM-82101634200 [1,0,0,0,1,0|2,0,0]=4 1413 B29R4.12371562 COc1ncc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCS4 AIFCHEM-52799391903 [1,0,0,0,1,0|2,0,0]=4 1414 B29R4.12371562 COc1ncc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOC4 AIFCHEM-82101691476 [1,0,0,0,1,0|2,0,0]=4 1415 B29R4.12371562 COc1ncc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CCCO4 AIFCHEM-82101600280 [1,0,0,0,1,0|2,0,0]=4 1416 B29R4.12371562 COc1ncc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CCOC4 AIFCHEM-82101479051 [1,0,0,0,1,0|2,0,0]=4 1417 B29R4.12371562 COc1ncc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCCO4 AIFCHEM-88933831247 [1,0,0,0,1,0|2,0,0]=4 1418 B29R4.12371562 COc1ncc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCOC4 AIFCHEM-82101929327 [1,0,0,0,1,0|2,0,0]=4 1419 B29R4.12371562 COc1ncc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCC4 AIFCHEM-55468513560 [1,0,0,0,1,0|2,0,0]=4 1420 B29R4.12371562 COc1ncc(cc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC4 AIFCHEM-80189146531 [1,0,0,0,1,0|2,0,0]=4 1421 B29R4.12371562 COc1ncc(cc1N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC4 AIFCHEM-85152215486 [1,0,0,0,1,0|2,0,0]=4 1422 B29R4.12371562 Cc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC4 AIFCHEM-85968366874 [1,0,0,0,1,0|2,0,0]=4 1423 B29R4.12371562 Cc1cc(ccc1C=O)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC4 AIFCHEM-91402132340 [1,0,0,0,1,0|2,0,0]=4 1424 B29R4.12371562 Cc1cc(ccc1CO)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC4 AIFCHEM-87258064562 [1,0,0,0,1,0|2,0,0]=4 1425 B29R4.12371562 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc(c(c3)O)CO)C4CCCC4 AIFCHEM-93584931477 [1,0,0,0,1,0|2,0,0]=4 1426 B29R4.13837961 COc1cc(ccc1C)c2cnc3[nH]cc(c3c2)C(=O)N4CCCOC4 AIFCHEM-84664086784 [1,0,0,0,1,0|2,0,0]=4 1427 B29R4.13837961 COc1cc(ccc1C)c2cnc3[nH]cc(c3c2)C(=O)N4CCSCC4 AIFCHEM-7568349966 [1,0,0,0,1,0|2,0,0]=4 1428 B29R4.13837961 COc1cc(ccc1O)c2cnc3[nH]cc(c3c2)C(=O)N4CCCOC4 AIFCHEM-81736065483 [1,0,0,0,1,0|2,0,0]=4 1429 B29R4.13837973 CCc1cc(ccc1O)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC4 AIFCHEM-95081750537 [1,0,0,0,1,0|1,0,0]=3 1430 B29R4.13837973 COc1cc(ccc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CC=CC4 AIFCHEM-62558022092 [1,0,0,0,1,0|0,0,2]=4 1431 B29R4.13837973 COc1cc(ccc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC4 AIFCHEM-84664022986 [1,0,0,0,1,0|0,0,0]=2 1432 B29R4.13837973 COc1cc(ccc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCO4 AIFCHEM-84663991501 [1,0,0,0,1,0|1,0,0]=3 1433 B29R4.13837973 COc1cc(ccc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCS4 AIFCHEM-52799468097 [1,0,0,0,1,0|1,0,0]=3 1434 B29R4.13837973 COc1cc(ccc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOC4 AIFCHEM-84664014337 [1,0,0,0,1,0|1,0,0]=3 1435 B29R4.13837973 COc1cc(ccc1C)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CCCO4 AIFCHEM-89902674048 [1,0,0,0,1,0|1,0,0]=3 1436 B29R4.13837973 COc1cc(ccc1C)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CCOC4 AIFCHEM-89902540779 [1,0,0,0,1,0|1,0,0]=3 1437 B29R4.13837973 COc1cc(ccc1C)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCCO4 AIFCHEM-84664072499 [1,0,0,0,1,0|1,0,0]=3 1438 B29R4.13837973 COc1cc(ccc1C)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCOC4 AIFCHEM-84664109408 [1,0,0,0,1,0|1,0,0]=3 1439 B29R4.13837973 COc1cc(ccc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCC4 AIFCHEM-55466583654 [1,0,0,0,1,0|1,0,0]=3 1440 B29R4.13837973 COc1cc(ccc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCO4 AIFCHEM-51939420511 [1,0,0,0,1,0|2,0,0]=4 1441 B29R4.13837973 COc1cc(ccc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCS4 AIFCHEM-52794293141 [1,0,0,0,1,0|2,0,0]=4 1442 B29R4.13837973 COc1cc(ccc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCOC4 AIFCHEM-60891420236 [1,0,0,0,1,0|2,0,0]=4 1443 B29R4.13837973 COc1cc(ccc1C)c2cnc3[nH]nc(c3c2)NC(=O)[C@@H]4CCCO4 AIFCHEM-60334773895 [1,0,0,0,1,0|2,0,0]=4 1444 B29R4.13837973 COc1cc(ccc1C)c2cnc3[nH]nc(c3c2)NC(=O)[C@@H]4CCOC4 AIFCHEM-62189483637 [1,0,0,0,1,0|2,0,0]=4 1445 B29R4.13837973 COc1cc(ccc1C)c2cnc3[nH]nc(c3c2)NC(=O)[C@H]4CCOC4 AIFCHEM-51920840850 [1,0,0,0,1,0|2,0,0]=4 1446 B29R4.13837973 COc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC4 AIFCHEM-82883066299 [1,0,0,0,1,0|1,0,0]=3 1447 B29R4.13837973 COc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCO4 AIFCHEM-86337588280 [1,0,0,0,1,0|2,0,0]=4 1448 B29R4.13837973 COc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCS4 AIFCHEM-52794421838 [1,0,0,0,1,0|2,0,0]=4 1449 B29R4.13837973 COc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOC4 AIFCHEM-82883045550 [1,0,0,0,1,0|2,0,0]=4 1450 B29R4.13837973 COc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CCCO4 AIFCHEM-86337569860 [1,0,0,0,1,0|2,0,0]=4 1451 B29R4.13837973 COc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CCOC4 AIFCHEM-82882921925 [1,0,0,0,1,0|2,0,0]=4 1452 B29R4.13837973 COc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCCO4 AIFCHEM-63121804355 [1,0,0,0,1,0|2,0,0]=4 1453 B29R4.13837973 COc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCOC4 AIFCHEM-51920969547 [1,0,0,0,1,0|2,0,0]=4 1454 B29R4.13837973 COc1cc(ccc1F)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCC4 AIFCHEM-55466297740 [1,0,0,0,1,0|2,0,0]=4 1455 B29R4.13837973 COc1cc(ccc1N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC4 AIFCHEM-88196956242 [1,0,0,0,1,0|1,0,0]=3 1456 B29R4.13837973 COc1cc(ccc1N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCO4 AIFCHEM-88196848837 [1,0,0,0,1,0|2,0,0]=4 1457 B29R4.13837973 COc1cc(ccc1N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOC4 AIFCHEM-88196926653 [1,0,0,0,1,0|2,0,0]=4 1458 B29R4.13837973 COc1cc(ccc1N)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CCCO4 AIFCHEM-88196806317 [1,0,0,0,1,0|2,0,0]=4 1459 B29R4.13837973 COc1cc(ccc1N)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CCOC4 AIFCHEM-88196668008 [1,0,0,0,1,0|2,0,0]=4 1460 B29R4.13837973 COc1cc(ccc1N)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCCO4 AIFCHEM-88197134755 [1,0,0,0,1,0|2,0,0]=4 1461 B29R4.13837973 COc1cc(ccc1N)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCOC4 AIFCHEM-88197275824 [1,0,0,0,1,0|2,0,0]=4 1462 B29R4.13837973 COc1cc(ccc1O)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCC4 AIFCHEM-86733126651 [1,0,0,0,1,0|2,0,0]=4 1463 B29R4.13837973 COc1cc(ccc1O)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC4 AIFCHEM-55470235126 [1,0,0,0,1,0|0,0,0]=2 1464 B29R4.13837973 COc1cc(ccc1O)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCO4 AIFCHEM-51941584203 [1,0,0,0,1,0|1,0,0]=3 1465 B29R4.13837973 COc1cc(ccc1O)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCS4 AIFCHEM-52801577813 [1,0,0,0,1,0|1,0,0]=3 1466 B29R4.13837973 COc1cc(ccc1O)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOC4 AIFCHEM-81735931896 [1,0,0,0,1,0|1,0,0]=3 1467 B29R4.13837973 COc1cc(ccc1O)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CCCO4 AIFCHEM-81735868940 [1,0,0,0,1,0|1,0,0]=3 1468 B29R4.13837973 COc1cc(ccc1O)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CCOC4 AIFCHEM-81735801151 [1,0,0,0,1,0|1,0,0]=3 1469 B29R4.13837973 COc1cc(ccc1O)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCCO4 AIFCHEM-90940093109 [1,0,0,0,1,0|1,0,0]=3 1470 B29R4.13837973 COc1cc(ccc1O)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCOC4 AIFCHEM-90940202998 [1,0,0,0,1,0|1,0,0]=3 1471 B29R4.13837973 COc1cc(ccc1O)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCC4 AIFCHEM-55469944078 [1,0,0,0,1,0|1,0,0]=3 1472 B29R4.13837973 COc1cc(cnc1N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC4 AIFCHEM-90539792417 [1,0,0,0,1,0|2,0,0]=4 1473 B29R4.13837973 Cc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC4 AIFCHEM-79366469340 [1,0,0,0,1,0|2,0,0]=4 1474 B29R4.13837973 Cc1ccc(cc1C=O)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC4 AIFCHEM-87918092642 [1,0,0,0,1,0|2,0,0]=4 1475 B29R4.13837973 Cc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCC4 AIFCHEM-93887175680 [1,0,0,0,1,0|2,0,0]=4 1476 B29R4.13837973 O=C(Nc1c[nH]c2c1cc(cn2)c3ccc(c(c3)CO)O)C4CCCC4 AIFCHEM-85287964092 [1,0,0,0,1,0|2,0,0]=4 1477 B29R4.12336250 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)C(=O)N4CCSC4 AIFCHEM-82894927365 [0,0,0,0,2,0|2,0,0]=4 1478 B29R4.1272860014 COc1cc(ccc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC4 AIFCHEM-99102413934 [0,0,0,0,2,0|2,0,0]=4 1479 B29R4.1272860014 COc1cc(ccc1C=O)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC4 AIFCHEM-96476776476 [0,0,0,0,2,0|2,0,0]=4 1480 B29R4.1272860014 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC4 AIFCHEM-94662452082 [0,0,0,0,2,0|1,0,0]=3 1481 B29R4.1272860014 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCO4 AIFCHEM-63022795755 [0,0,0,0,2,0|2,0,0]=4 1482 B29R4.1272860014 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4COC4 AIFCHEM-97003122460 [0,0,0,0,2,0|2,0,0]=4 1483 B29R4.1272860014 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CCO4 AIFCHEM-56492825808 [0,0,0,0,2,0|2,0,0]=4 1484 B29R4.1272860014 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCC4 AIFCHEM-97003143027 [0,0,0,0,2,0|2,0,0]=4 1485 B29R4.1272860014 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC4 AIFCHEM-98607370053 [0,0,0,0,2,0|2,0,0]=4 1486 B29R4.1272860014 COc1ccc(cc1C=O)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC4 AIFCHEM-95449112878 [0,0,0,0,2,0|2,0,0]=4 1487 B29R4.1272860014 COc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC4 AIFCHEM-99156981652 [0,0,0,0,2,0|2,0,0]=4 1488 B29R4.1272860014 COc1ccc(cc1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCC4 AIFCHEM-95390691161 [0,0,0,0,2,0|2,0,0]=4 1489 B29R4.1272860014 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC4 AIFCHEM-95390697646 [0,0,0,0,2,0|0,0,0]=2 1490 B29R4.1272860014 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCO4 AIFCHEM-63022705675 [0,0,0,0,2,0|1,0,0]=3 1491 B29R4.1272860014 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4COC4 AIFCHEM-95390688275 [0,0,0,0,2,0|1,0,0]=3 1492 B29R4.1272860014 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CCO4 AIFCHEM-56492719248 [0,0,0,0,2,0|1,0,0]=3 1493 B29R4.1272860014 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCC4 AIFCHEM-95390699542 [0,0,0,0,2,0|1,0,0]=3 1494 B29R4.1272860014 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCO4 AIFCHEM-63023763154 [0,0,0,0,2,0|2,0,0]=4 1495 B29R4.1272860014 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4COC4 AIFCHEM-95390688328 [0,0,0,0,2,0|2,0,0]=4 1496 B29R4.1272860014 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)[C@@H]4CCO4 AIFCHEM-56494070407 [0,0,0,0,2,0|2,0,0]=4 1497 B31R3.1439102005 CCCCOCC(=O)Nc1ccc2ncc(cc2c1)c3ccc(c(c3)OC)OC AIFCHEM-71197211978 [0,0,1,0,0,1|2,0,0]=4 1498 B31R3.1439102005 COc1ccc(cc1OC)c2cnc3ccc(cc3c2)NC(=O)CCCCCO AIFCHEM-65431364316 [0,0,1,0,0,1|2,0,0]=4 1499 B31R4.16433008 COc1ccc(cc1C)c2cnc3cccc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-57041702568 [1,0,0,0,0,1|2,0,0]=4 1500 B31R4.16433008 COc1ccc(cc1C)c2cnc3cccc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-60365820217 [1,0,0,0,0,1|2,0,0]=4 1501 B31R4.16433008 COc1ccc(cc1C)c2cnc3cccc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57224885172 [1,0,0,0,0,1|2,0,0]=4 1502 B31R4.16433008 COc1ccc(cc1O)c2cnc3cccc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-57040730655 [1,0,0,0,0,1|2,0,0]=4 1503 B31R4.16433008 COc1ccc(cc1O)c2cnc3cccc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-60364015864 [1,0,0,0,0,1|2,0,0]=4 1504 B31R4.16433008 COc1ccc(cc1O)c2cnc3cccc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57224413259 [1,0,0,0,0,1|2,0,0]=4 1505 B31R4.16433008 COc1ccc(cc1O)c2cnc3cccc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-63311329751 [1,0,0,0,0,1|2,0,0]=4 1506 B31R4.16433037 COc1ccc(cc1C)c2cnc3ccc(cc3c2)NC(=O)C4CCCCO4 AIFCHEM-57040478040 [1,0,0,0,0,1|2,0,0]=4 1507 B31R4.16433037 COc1ccc(cc1C)c2cnc3ccc(cc3c2)NC(=O)C4CCCOC4 AIFCHEM-60363763249 [1,0,0,0,0,1|2,0,0]=4 1508 B31R4.16433037 COc1ccc(cc1C)c2cnc3ccc(cc3c2)NC(=O)C4CCOCC4 AIFCHEM-57224160644 [1,0,0,0,0,1|2,0,0]=4 1509 B31R4.16433037 COc1ccc(cc1O)c2cnc3ccc(cc3c2)NC(=O)C4CCCCO4 AIFCHEM-57040957640 [1,0,0,0,0,1|2,0,0]=4 1510 B31R4.16433037 COc1ccc(cc1O)c2cnc3ccc(cc3c2)NC(=O)C4CCCOC4 AIFCHEM-60364242849 [1,0,0,0,0,1|2,0,0]=4 1511 B31R4.16433037 COc1ccc(cc1O)c2cnc3ccc(cc3c2)NC(=O)C4CCOCC4 AIFCHEM-57224640244 [1,0,0,0,0,1|2,0,0]=4 1512 B31R4.16433037 COc1ccc(cc1O)c2cnc3ccc(cc3c2)NC(=O)C4CCSCC4 AIFCHEM-63311556736 [1,0,0,0,0,1|2,0,0]=4 1513 B31R4.139475414 COc1ccc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCCCO4 AIFCHEM-50897276070 [1,0,0,0,0,1|1,0,0]=3 1514 B31R4.139475414 COc1ccc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCCOC4 AIFCHEM-48014089350 [1,0,0,0,0,1|1,0,0]=3 1515 B31R4.139475414 COc1ccc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCOCC4 AIFCHEM-62890636453 [1,0,0,0,0,1|1,0,0]=3 1516 B31R4.139475414 COc1ccc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)CC4CCCCC4 AIFCHEM-57208781592 [1,0,0,0,0,1|1,0,0]=3 1517 B31R4.139475414 COc1ccc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)CC4CCCCO4 AIFCHEM-50897349874 [1,0,0,0,0,1|2,0,0]=4 1518 B31R4.139475414 COc1ccc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)CC4CCCOC4 AIFCHEM-48014163154 [1,0,0,0,0,1|2,0,0]=4 1519 B31R4.139475414 COc1ccc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)CC4CCOCC4 AIFCHEM-62890710257 [1,0,0,0,0,1|2,0,0]=4 1520 B31R4.139475414 COc1ccc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)CC4CCSCC4 AIFCHEM-51527882378 [1,0,0,0,0,1|2,0,0]=4 1521 B31R4.139475414 COc1ccc(cc1F)c2cnc3[nH]nc(c3c2)NC(=O)CC4CCCCC4 AIFCHEM-57208605898 [1,0,0,0,0,1|2,0,0]=4 1522 B31R4.139475414 COc1ccc(cc1O)c2ccc3[nH]nc(c3c2)NC(=O)CC4CCCCC4 AIFCHEM-80809741868 [1,0,0,0,0,1|2,0,0]=4 1523 B31R4.139475414 COc1ccc(cc1O)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCSCC4 AIFCHEM-51527754289 [1,0,0,0,0,1|1,0,0]=3 1524 B31R4.139475414 COc1ccc(cc1O)c2cnc3[nH]nc(c3c2)NC(=O)CC4CCSCC4 AIFCHEM-51528004618 [1,0,0,0,0,1|2,0,0]=4 1525 B31R4.139475414 COc1ncc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCCCC4 AIFCHEM-57209981800 [1,0,0,0,0,1|1,0,0]=3 1526 B31R4.139475414 COc1ncc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCCCO4 AIFCHEM-50899716922 [1,0,0,0,0,1|2,0,0]=4 1527 B31R4.139475414 COc1ncc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCCOC4 AIFCHEM-48015384682 [1,0,0,0,0,1|2,0,0]=4 1528 B31R4.139475414 COc1ncc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCOCC4 AIFCHEM-62896213105 [1,0,0,0,0,1|2,0,0]=4 1529 B31R4.139475414 COc1ncc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)CC4CCCCC4 AIFCHEM-57209778064 [1,0,0,0,0,1|2,0,0]=4 1530 B31R4.1171452197 COc1ccc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCC=CCC4 AIFCHEM-53241796136 [1,0,0,0,0,1|1,0,1]=4 1531 B31R4.1171452197 COc1ccc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCCC4 AIFCHEM-51049962901 [1,0,0,0,0,1|1,0,0]=3 1532 B31R4.1171452197 COc1ccc(cc1F)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCCC4 AIFCHEM-51049787207 [1,0,0,0,0,1|2,0,0]=4 1533 B31R4.1171452197 COc1ccc(cc1O)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCCC4 AIFCHEM-86323366676 [1,0,0,0,0,1|2,0,0]=4 1534 B31R4.1171452197 COc1ccc(cc1O)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCCC4 AIFCHEM-51049894992 [1,0,0,0,0,1|0,0,0]=2 1535 B31R4.1171452197 COc1ncc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCC=CCC4 AIFCHEM-53244510604 [1,0,0,0,0,1|1,0,1]=4 1536 B31R4.1171452197 COc1ncc(cc1C)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCCC4 AIFCHEM-51051374469 [1,0,0,0,0,1|1,0,0]=3 1537 B31R4.1171452197 COc1ncc(cc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCCC4 AIFCHEM-51051170733 [1,0,0,0,0,1|2,0,0]=4 1538 B31R4.1171452197 Cc1cc(ccc1CO)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCCC4 AIFCHEM-51052599003 [1,0,0,0,0,1|2,0,0]=4 1539 B31R4.18384557 COc1cc(ccc1C)c2cnc3cccc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-57040880830 [1,0,0,0,0,1|2,0,0]=4 1540 B31R4.18384557 COc1cc(ccc1C)c2cnc3cccc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-60364166039 [1,0,0,0,0,1|2,0,0]=4 1541 B31R4.18384557 COc1cc(ccc1C)c2cnc3cccc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57224563434 [1,0,0,0,0,1|2,0,0]=4 1542 B31R4.18384557 COc1cc(ccc1O)c2cnc3cccc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-57040706228 [1,0,0,0,0,1|2,0,0]=4 1543 B31R4.18384557 COc1cc(ccc1O)c2cnc3cccc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-60363991437 [1,0,0,0,0,1|2,0,0]=4 1544 B31R4.18384557 COc1cc(ccc1O)c2cnc3cccc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57224388832 [1,0,0,0,0,1|2,0,0]=4 1545 B31R4.18384557 COc1cc(ccc1O)c2cnc3cccc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-63311305324 [1,0,0,0,0,1|2,0,0]=4 1546 B31R4.18384589 COc1cc(ccc1C)c2cnc3ccc(cc3c2)NC(=O)C4CCCCO4 AIFCHEM-57040533466 [1,0,0,0,0,1|2,0,0]=4 1547 B31R4.18384589 COc1cc(ccc1C)c2cnc3ccc(cc3c2)NC(=O)C4CCCOC4 AIFCHEM-60363818675 [1,0,0,0,0,1|2,0,0]=4 1548 B31R4.18384589 COc1cc(ccc1C)c2cnc3ccc(cc3c2)NC(=O)C4CCOCC4 AIFCHEM-57224216070 [1,0,0,0,0,1|2,0,0]=4 1549 B31R4.18384589 COc1cc(ccc1O)c2cnc3ccc(cc3c2)NC(=O)C4CCCCO4 AIFCHEM-57040489109 [1,0,0,0,0,1|2,0,0]=4 1550 B31R4.18384589 COc1cc(ccc1O)c2cnc3ccc(cc3c2)NC(=O)C4CCCOC4 AIFCHEM-60363774318 [1,0,0,0,0,1|2,0,0]=4 1551 B31R4.18384589 COc1cc(ccc1O)c2cnc3ccc(cc3c2)NC(=O)C4CCOCC4 AIFCHEM-57224171713 [1,0,0,0,0,1|2,0,0]=4 1552 B31R4.18384589 COc1cc(ccc1O)c2cnc3ccc(cc3c2)NC(=O)C4CCSCC4 AIFCHEM-63311032365 [1,0,0,0,0,1|2,0,0]=4 1553 B31R4.150726117 CCc1cc(ccc1O)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCSCC4 AIFCHEM-98481274789 [1,0,0,0,0,1|2,0,0]=4 1554 B31R4.150726117 COc1cc(ccc1C)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCCCO4 AIFCHEM-50899817556 [1,0,0,0,0,1|1,0,0]=3 1555 B31R4.150726117 COc1cc(ccc1C)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCCOC4 AIFCHEM-48015460876 [1,0,0,0,0,1|1,0,0]=3 1556 B31R4.150726117 COc1cc(ccc1C)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCOCC4 AIFCHEM-62896289299 [1,0,0,0,0,1|1,0,0]=3 1557 B31R4.150726117 COc1cc(ccc1C)c2cnc3[nH]nc(c3c2)NC(=O)CC4CCCCC4 AIFCHEM-57208812038 [1,0,0,0,0,1|1,0,0]=3 1558 B31R4.150726117 COc1cc(ccc1C)c2cnc3[nH]nc(c3c2)NC(=O)CC4CCCCO4 AIFCHEM-50897380320 [1,0,0,0,0,1|2,0,0]=4 1559 B31R4.150726117 COc1cc(ccc1C)c2cnc3[nH]nc(c3c2)NC(=O)CC4CCCOC4 AIFCHEM-48014193600 [1,0,0,0,0,1|2,0,0]=4 1560 B31R4.150726117 COc1cc(ccc1C)c2cnc3[nH]nc(c3c2)NC(=O)CC4CCOCC4 AIFCHEM-62890740703 [1,0,0,0,0,1|2,0,0]=4 1561 B31R4.150726117 COc1cc(ccc1C)c2cnc3[nH]nc(c3c2)NC(=O)CC4CCSCC4 AIFCHEM-51527937244 [1,0,0,0,0,1|2,0,0]=4 1562 B31R4.150726117 COc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCCCO4 AIFCHEM-50897509017 [1,0,0,0,0,1|2,0,0]=4 1563 B31R4.150726117 COc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCCOC4 AIFCHEM-48014322297 [1,0,0,0,0,1|2,0,0]=4 1564 B31R4.150726117 COc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCOCC4 AIFCHEM-62890878180 [1,0,0,0,0,1|2,0,0]=4 1565 B31R4.150726117 COc1cc(ccc1F)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCSCC4 AIFCHEM-51528131181 [1,0,0,0,0,1|2,0,0]=4 1566 B31R4.150726117 COc1cc(ccc1F)c2cnc3[nH]nc(c3c2)NC(=O)CC4CCCCC4 AIFCHEM-57208700324 [1,0,0,0,0,1|2,0,0]=4 1567 B31R4.150726117 COc1cc(ccc1O)c2ccc3[nH]nc(c3c2)NC(=O)CC4CCCCC4 AIFCHEM-80810382693 [1,0,0,0,0,1|2,0,0]=4 1568 B31R4.150726117 COc1cc(ccc1O)c2cnc3[nH]cc(c3c2)NC(=O)CC4CCSCC4 AIFCHEM-51529381176 [1,0,0,0,0,1|1,0,0]=3 1569 B31R4.150726117 COc1cc(ccc1O)c2cnc3[nH]nc(c3c2)NC(=O)CC4CCSCC4 AIFCHEM-51529239108 [1,0,0,0,0,1|2,0,0]=4 1570 B31R4.1200856427 COc1cc(ccc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCC=CCC4 AIFCHEM-53241849162 [1,0,0,0,0,1|1,0,1]=4 1571 B31R4.1200856427 COc1cc(ccc1C)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCCC4 AIFCHEM-51049993347 [1,0,0,0,0,1|1,0,0]=3 1572 B31R4.1200856427 COc1cc(ccc1F)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCCC4 AIFCHEM-51049881633 [1,0,0,0,0,1|2,0,0]=4 1573 B31R4.1200856427 COc1cc(ccc1O)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCCC4 AIFCHEM-86323734381 [1,0,0,0,0,1|2,0,0]=4 1574 B31R4.1200856427 COc1cc(ccc1O)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCCC4 AIFCHEM-51052641519 [1,0,0,0,0,1|0,0,0]=2 1575 B31R4.1200856427 Cc1ccc(cc1CO)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCCC4 AIFCHEM-51050088114 [1,0,0,0,0,1|2,0,0]=4 1576 B31R4.139061583 COc1cc(ccc1C#N)c2cnc3c(c[nH]c3c2)NC(=O)C4CCCCC4 AIFCHEM-78989997911 [0,0,0,0,1,1|2,0,0]=4 1577 B31R4.139061583 COc1cc(cnc1OC)c2ccc3c(n[nH]c3c2)NC(=O)C4CCCCC4 AIFCHEM-88178791914 [0,0,0,0,1,1|2,0,0]=4 1578 B31R4.139061583 COc1cc(cnc1OC)c2cnc3c(c[nH]c3c2)NC(=O)C4CCCCC4 AIFCHEM-78989838817 [0,0,0,0,1,1|1,0,0]=3 1579 B31R4.139061583 COc1cc(cnc1OC)c2cnc3c(c[nH]c3c2)NC(=O)C4CCCCO4 AIFCHEM-74251685593 [0,0,0,0,1,1|2,0,0]=4 1580 B31R4.139061583 COc1cc(cnc1OC)c2cnc3c(c[nH]c3c2)NC(=O)C4CCCOC4 AIFCHEM-77642563495 [0,0,0,0,1,1|2,0,0]=4 1581 B31R4.139061583 COc1cc(cnc1OC)c2cnc3c(c[nH]c3c2)NC(=O)C4CCOCC4 AIFCHEM-74499322221 [0,0,0,0,1,1|2,0,0]=4 1582 B31R4.139061583 COc1cc(cnc1OC)c2cnc3c(c[nH]c3c2)NC(=O)C4CCSCC4 AIFCHEM-78091470249 [0,0,0,0,1,1|2,0,0]=4 1583 B31R4.139061583 COc1cc(cnc1OC)c2cnc3c(n[nH]c3c2)NC(=O)C4CCCCC4 AIFCHEM-61909025034 [0,0,0,0,1,1|2,0,0]=4 1584 B31R4.139061583 COc1ccc(cc1C#N)c2cnc3c(c[nH]c3c2)NC(=O)C4CCCCC4 AIFCHEM-78989982196 [0,0,0,0,1,1|2,0,0]=4 1585 B31R4.139061583 COc1ccc(cc1CO)c2cnc3c(c[nH]c3c2)NC(=O)C4CCCCC4 AIFCHEM-78989751153 [0,0,0,0,1,1|2,0,0]=4 1586 B31R4.139061583 COc1ccc(cc1OC)c2ccn3c(cnc3c2)NC(=O)C4CCCCC4 AIFCHEM-78990009542 [0,0,0,0,1,1|1,0,1]=4 1587 B31R4.139061583 COc1ccc(cc1OC)c2cnc3c(c[nH]c3c2)NC(=O)C4CC=CCC4 AIFCHEM-73873384091 [0,0,0,0,1,1|0,0,2]=4 1588 B31R4.139061583 COc1ccc(cc1OC)c2cnc3c(c[nH]c3c2)NC(=O)C4CCCCC4 AIFCHEM-78989641179 [0,0,0,0,1,1|0,0,0]=2 1589 B31R4.139061583 COc1ccc(cc1OC)c2cnc3c(c[nH]c3c2)NC(=O)C4CCCCO4 AIFCHEM-74251339655 [0,0,0,0,1,1|1,0,0]=3 1590 B31R4.139061583 COc1ccc(cc1OC)c2cnc3c(c[nH]c3c2)NC(=O)C4CCCOC4 AIFCHEM-77642285817 [0,0,0,0,1,1|1,0,0]=3 1591 B31R4.139061583 COc1ccc(cc1OC)c2cnc3c(c[nH]c3c2)NC(=O)C4CCOCC4 AIFCHEM-74499124583 [0,0,0,0,1,1|1,0,0]=3 1592 B31R4.139061583 COc1ccc(cc1OC)c2cnc3c(c[nH]c3c2)NC(=O)C4CCSCC4 AIFCHEM-78091194611 [0,0,0,0,1,1|1,0,0]=3 1593 B31R4.139061583 COc1ccc(cc1OC)c2cnc3c(c[nH]c3c2)NC(=O)C4COCCO4 AIFCHEM-78131239175 [0,0,0,0,1,1|2,0,0]=4 1594 B31R4.139061583 COc1ccc(cc1OC)c2cnc3c(c[nH]c3c2)NC(=O)C4SCCCS4 AIFCHEM-69982249248 [0,0,0,0,1,1|2,0,0]=4 1595 B31R4.139061583 COc1ccc(cc1OC)c2cnc3c(c[nH]c3c2)NC(=O)[C@@H]4CC=CCC4 AIFCHEM-74867518466 [0,0,0,0,1,1|0,0,2]=4 1596 B31R4.139061583 COc1ccc(cc1OC)c2cnc3c(c[nH]c3c2)NC(=O)[C@@H]4COCCO4 AIFCHEM-69110207269 [0,0,0,0,1,1|2,0,0]=4 1597 B31R4.139061583 COc1ccc(cc1OC)c2cnc3c(c[nH]c3c2)NC(=O)[C@H]4CC=CCC4 AIFCHEM-74872654309 [0,0,0,0,1,1|0,0,2]=4 1598 B31R4.139061583 COc1ccc(cc1OC)c2cnc3c(c[nH]c3c2)NC(=O)[C@H]4COCCO4 AIFCHEM-69553486420 [0,0,0,0,1,1|2,0,0]=4 1599 B31R4.516118612 COc1cc(ccc1C#N)c2ccnc3c2c(c[nH]3)NC(=O)C4CCCCC4 AIFCHEM-61904683766 [0,0,0,0,1,1|2,0,0]=4 1600 B31R4.516118612 COc1cc(cnc1OC)c2ccnc3c2c(c[nH]3)NC(=O)C4CCCCC4 AIFCHEM-88178892621 [0,0,0,0,1,1|1,0,0]=3 1601 B31R4.516118612 COc1cc(cnc1OC)c2ccnc3c2c(c[nH]3)NC(=O)C4CCCCO4 AIFCHEM-90180698722 [0,0,0,0,1,1|2,0,0]=4 1602 B31R4.516118612 COc1cc(cnc1OC)c2ccnc3c2c(c[nH]3)NC(=O)C4CCCOC4 AIFCHEM-85437533172 [0,0,0,0,1,1|2,0,0]=4 1603 B31R4.516118612 COc1cc(cnc1OC)c2ccnc3c2c(c[nH]3)NC(=O)C4CCOCC4 AIFCHEM-81760335659 [0,0,0,0,1,1|2,0,0]=4 1604 B31R4.516118612 COc1cc(cnc1OC)c2ccnc3c2c(c[nH]3)NC(=O)C4CCSCC4 AIFCHEM-86080541798 [0,0,0,0,1,1|2,0,0]=4 1605 B31R4.516118612 COc1cc(cnc1OC)c2ccnc3c2c(c[nH]3)NC(=O)[C@H]4CCCOC4 AIFCHEM-82018687831 [0,0,0,0,1,1|2,0,0]=4 1606 B31R4.516118612 COc1ccc(cc1C#N)c2ccnc3c2c(c[nH]3)NC(=O)C4CCCCC4 AIFCHEM-61904809925 [0,0,0,0,1,1|2,0,0]=4 1607 B31R4.516118612 COc1ccc(cc1CO)c2ccnc3c2c(c[nH]3)NC(=O)C4CCCCC4 AIFCHEM-61904646490 [0,0,0,0,1,1|2,0,0]=4 1608 B31R4.516118612 COc1ccc(cc1OC)c2ccnc3c2c(c[nH]3)NC(=O)C4CC=CCC4 AIFCHEM-83059625818 [0,0,0,0,1,1|0,0,2]=4 1609 B31R4.516118612 COc1ccc(cc1OC)c2ccnc3c2c(c[nH]3)NC(=O)C4CCCCC4 AIFCHEM-88179026857 [0,0,0,0,1,1|0,0,0]=2 1610 B31R4.516118612 COc1ccc(cc1OC)c2ccnc3c2c(c[nH]3)NC(=O)C4CCCCO4 AIFCHEM-90180770098 [0,0,0,0,1,1|1,0,0]=3 1611 B31R4.516118612 COc1ccc(cc1OC)c2ccnc3c2c(c[nH]3)NC(=O)C4CCCOC4 AIFCHEM-85437671848 [0,0,0,0,1,1|1,0,0]=3 1612 B31R4.516118612 COc1ccc(cc1OC)c2ccnc3c2c(c[nH]3)NC(=O)C4CCOCC4 AIFCHEM-81760407035 [0,0,0,0,1,1|1,0,0]=3 1613 B31R4.516118612 COc1ccc(cc1OC)c2ccnc3c2c(c[nH]3)NC(=O)C4CCSCC4 AIFCHEM-86081020314 [0,0,0,0,1,1|1,0,0]=3 1614 B31R4.516118612 COc1ccc(cc1OC)c2ccnc3c2c(c[nH]3)NC(=O)C4COCCO4 AIFCHEM-93775458338 [0,0,0,0,1,1|2,0,0]=4 1615 B31R4.516118612 COc1ccc(cc1OC)c2ccnc3c2c(c[nH]3)NC(=O)C4SCCCS4 AIFCHEM-90029984312 [0,0,0,0,1,1|2,0,0]=4 1616 B31R4.516118612 COc1ccc(cc1OC)c2ccnc3c2c(c[nH]3)NC(=O)[C@@H]4CC=CCC4 AIFCHEM-92713197806 [0,0,0,0,1,1|0,0,2]=4 1617 B31R4.516118612 COc1ccc(cc1OC)c2ccnc3c2c(c[nH]3)NC(=O)[C@@H]4COCCO4 AIFCHEM-79420039233 [0,0,0,0,1,1|2,0,0]=4 1618 B31R4.516118612 COc1ccc(cc1OC)c2ccnc3c2c(c[nH]3)NC(=O)[C@H]4CC=CCC4 AIFCHEM-91194224686 [0,0,0,0,1,1|0,0,2]=4 1619 B31R4.516118612 COc1ccc(cc1OC)c2ccnc3c2c(c[nH]3)NC(=O)[C@H]4CCCOC4 AIFCHEM-82018921447 [0,0,0,0,1,1|1,0,0]=3 1620 B31R4.516118612 COc1ccc(cc1OC)c2ccnc3c2c(c[nH]3)NC(=O)[C@H]4COCCO4 AIFCHEM-89428156416 [0,0,0,0,1,1|2,0,0]=4 1621 B31R4.1170324391 COc1ccc(cc1OC)c2ccc3[nH]cc(c3c2)C(=O)N4CCCOCC4 AIFCHEM-16966896609 [0,0,0,0,1,1|2,0,0]=4 1622 B31R4.16366280 COc1cc(cnc1OC)c2cnc3cccc(c3c2)NC(=O)C4CCCC4 AIFCHEM-72552011194 [0,0,0,0,1,1|2,0,0]=4 1623 B31R4.16366310 COc1cc(cnc1OC)c2cnc3ccc(cc3c2)NC(=O)C4CCCC4 AIFCHEM-72551988087 [0,0,0,0,1,1|2,0,0]=4 1624 B31R4.16366310 COc1ccc(cc1OC)c2ccc3ncc(nc3c2)NC(=O)C4CCCC4 AIFCHEM-95081290556 [0,0,0,0,1,1|1,0,1]=4 1625 B31R4.16366310 COc1ccc(cc1OC)c2cnc3ccc(cc3c2)NC(=O)C4CCCO4 AIFCHEM-68548415335 [0,0,0,0,1,1|2,0,0]=4 1626 B31R4.16366310 COc1ccc(cc1OC)c2cnc3ccc(cc3c2)NC(=O)C4CCCS4 AIFCHEM-69600935888 [0,0,0,0,1,1|2,0,0]=4 1627 B31R4.16366310 COc1ccc(cc1OC)c2cnc3ccc(cc3c2)NC(=O)C4CCOC4 AIFCHEM-78100440760 [0,0,0,0,1,1|2,0,0]=4 1628 B31R4.16366310 COc1ccc(cc1OC)c2cnc3ccc(cc3c2)NC(=O)[C@@H]4CCCO4 AIFCHEM-77606502007 [0,0,0,0,1,1|2,0,0]=4 1629 B31R4.16366310 COc1ccc(cc1OC)c2cnc3ccc(cc3c2)NC(=O)[C@@H]4CCOC4 AIFCHEM-75953439922 [0,0,0,0,1,1|2,0,0]=4 1630 B31R4.16366310 COc1ccc(cc1OC)c2cnc3ccc(cc3c2)NC(=O)[C@H]4CCCO4 AIFCHEM-77582598227 [0,0,0,0,1,1|2,0,0]=4 1631 B31R4.16366310 COc1ccc(cc1OC)c2cnc3ccc(cc3c2)NC(=O)[C@H]4CCOC4 AIFCHEM-68602742674 [0,0,0,0,1,1|2,0,0]=4 1632 B31R4.19094658 COc1cc(cc(c1)c2cnc3[nH]cc(c3c2)NC(=O)C4CC=CCC4)OC AIFCHEM-60300103203 [0,0,0,0,1,1|0,0,2]=4 1633 B31R4.19094658 COc1cc(cc(c1)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCC4)C#N AIFCHEM-61904741569 [0,0,0,0,1,1|2,0,0]=4 1634 B31R4.19094658 COc1cc(cc(c1)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCC4)OC AIFCHEM-61904722976 [0,0,0,0,1,1|0,0,0]=2 1635 B31R4.19094658 COc1cc(cc(c1)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCO4)OC AIFCHEM-57039480367 [0,0,0,0,1,1|1,0,0]=3 1636 B31R4.19094658 COc1cc(cc(c1)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCO4)SC AIFCHEM-90180655568 [0,0,0,0,1,1|1,1,0]=4 1637 B31R4.19094658 COc1cc(cc(c1)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCOC4)OC AIFCHEM-60360740027 [0,0,0,0,1,1|1,0,0]=3 1638 B31R4.19094658 COc1cc(cc(c1)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCOC4)SC AIFCHEM-85437446358 [0,0,0,0,1,1|1,1,0]=4 1639 B31R4.19094658 COc1cc(cc(c1)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4)OC AIFCHEM-57222442651 [0,0,0,0,1,1|1,0,0]=3 1640 B31R4.19094658 COc1cc(cc(c1)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4)SC AIFCHEM-81760292505 [0,0,0,0,1,1|1,1,0]=4 1641 B31R4.19094658 COc1cc(cc(c1)c2cnc3[nH]cc(c3c2)NC(=O)C4CCSCC4)OC AIFCHEM-63309693263 [0,0,0,0,1,1|1,0,0]=3 1642 B31R4.19094658 COc1cc(cc(c1)c2cnc3[nH]cc(c3c2)NC(=O)C4COCCO4)OC AIFCHEM-63284572059 [0,0,0,0,1,1|2,0,0]=4 1643 B31R4.19094658 COc1cc(cc(c1)c2cnc3[nH]cc(c3c2)NC(=O)C4SCCCS4)OC AIFCHEM-53196914452 [0,0,0,0,1,1|2,0,0]=4 1644 B31R4.19094658 COc1cc(cc(c1)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CC=CCC4)OC AIFCHEM-61352586005 [0,0,0,0,1,1|0,0,2]=4 1645 B31R4.19094658 COc1cc(cc(c1)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4COCCO4)OC AIFCHEM-54375025167 [0,0,0,0,1,1|2,0,0]=4 1646 B31R4.19094658 COc1cc(cc(c1)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC=CCC4)OC AIFCHEM-61307582101 [0,0,0,0,1,1|0,0,2]=4 1647 B31R4.19094658 COc1cc(cc(c1)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CCCOC4)SC AIFCHEM-82018527557 [0,0,0,0,1,1|1,1,0]=4 1648 B31R4.19094658 COc1cc(cc(c1)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4COCCO4)OC AIFCHEM-52628912356 [0,0,0,0,1,1|2,0,0]=4 1649 B31R4.19094658 COc1cc(cc(c1)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4)OC AIFCHEM-61904712704 [0,0,0,0,1,1|1,0,0]=3 1650 B31R4.19094658 COc1cc(cc(c1)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4)SC AIFCHEM-88169527256 [0,0,0,0,1,1|1,1,0]=4 1651 B31R4.19094658 COc1cc(cc(c1)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCO4)OC AIFCHEM-57039466435 [0,0,0,0,1,1|2,0,0]=4 1652 B31R4.19094658 COc1cc(cc(c1)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCOC4)OC AIFCHEM-60360729755 [0,0,0,0,1,1|2,0,0]=4 1653 B31R4.19094658 COc1cc(cc(c1)c2cnc3[nH]nc(c3c2)NC(=O)C4CCOCC4)OC AIFCHEM-57222432379 [0,0,0,0,1,1|2,0,0]=4 1654 B31R4.19094658 COc1cc(cc(c1)c2cnc3[nH]nc(c3c2)NC(=O)C4CCSCC4)OC AIFCHEM-63309682991 [0,0,0,0,1,1|2,0,0]=4 1655 B31R4.113924338 COc1cccc(c1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CC=CCC4 AIFCHEM-60299955431 [0,0,0,0,1,1|0,0,2]=4 1656 B31R4.113924338 COc1cccc(c1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61904575204 [0,0,0,0,1,1|0,0,0]=2 1657 B31R4.113924338 COc1cccc(c1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-57039328935 [0,0,0,0,1,1|1,0,0]=3 1658 B31R4.113924338 COc1cccc(c1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-60360592255 [0,0,0,0,1,1|1,0,0]=3 1659 B31R4.113924338 COc1cccc(c1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57222294879 [0,0,0,0,1,1|1,0,0]=3 1660 B31R4.113924338 COc1cccc(c1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-63309545491 [0,0,0,0,1,1|1,0,0]=3 1661 B31R4.113924338 COc1cccc(c1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4COCCO4 AIFCHEM-63284352987 [0,0,0,0,1,1|2,0,0]=4 1662 B31R4.113924338 COc1cccc(c1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4SCCCS4 AIFCHEM-53196766680 [0,0,0,0,1,1|2,0,0]=4 1663 B31R4.113924338 COc1cccc(c1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CC=CCC4 AIFCHEM-61352438233 [0,0,0,0,1,1|0,0,2]=4 1664 B31R4.113924338 COc1cccc(c1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4COCCO4 AIFCHEM-54374877395 [0,0,0,0,1,1|2,0,0]=4 1665 B31R4.113924338 COc1cccc(c1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC=CCC4 AIFCHEM-61307434329 [0,0,0,0,1,1|0,0,2]=4 1666 B31R4.113924338 COc1cccc(c1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4COCCO4 AIFCHEM-52628764584 [0,0,0,0,1,1|2,0,0]=4 1667 B31R4.113924338 COc1cccc(c1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61904955617 [0,0,0,0,1,1|1,0,0]=3 1668 B31R4.113924338 COc1cccc(c1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-57039908028 [0,0,0,0,1,1|2,0,0]=4 1669 B31R4.113924338 COc1cccc(c1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-60360972668 [0,0,0,0,1,1|2,0,0]=4 1670 B31R4.113924338 COc1cccc(c1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57222675292 [0,0,0,0,1,1|2,0,0]=4 1671 B31R4.113924338 COc1cccc(c1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-63309925904 [0,0,0,0,1,1|2,0,0]=4 1672 B31R4.113924338 COc1nccc(c1OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-98027264254 [0,0,0,0,1,1|2,0,0]=4 1673 B31R4.113924338 COc1nccc(c1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CC=CCC4 AIFCHEM-73875286382 [0,0,0,0,1,1|0,0,2]=4 1674 B31R4.113924338 COc1nccc(c1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-78990077150 [0,0,0,0,1,1|0,0,0]=2 1675 B31R4.113924338 COc1nccc(c1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-74253006186 [0,0,0,0,1,1|1,0,0]=3 1676 B31R4.113924338 COc1nccc(c1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-77644623228 [0,0,0,0,1,1|1,0,0]=3 1677 B31R4.113924338 COc1nccc(c1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-74500087554 [0,0,0,0,1,1|1,0,0]=3 1678 B31R4.113924338 COc1nccc(c1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-78092693302 [0,0,0,0,1,1|1,0,0]=3 1679 B31R4.113924338 COc1nccc(c1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4COCCO4 AIFCHEM-78133162946 [0,0,0,0,1,1|2,0,0]=4 1680 B31R4.113924338 COc1nccc(c1OC)c2cnc3[nH]cc(c3c2)NC(=O)C4SCCCS4 AIFCHEM-69983587599 [0,0,0,0,1,1|2,0,0]=4 1681 B31R4.113924338 COc1nccc(c1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CC=CCC4 AIFCHEM-74869439397 [0,0,0,0,1,1|0,0,2]=4 1682 B31R4.113924338 COc1nccc(c1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4COCCO4 AIFCHEM-69111754420 [0,0,0,0,1,1|2,0,0]=4 1683 B31R4.113924338 COc1nccc(c1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC=CCC4 AIFCHEM-74873901920 [0,0,0,0,1,1|0,0,2]=4 1684 B31R4.113924338 COc1nccc(c1OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4COCCO4 AIFCHEM-69556507191 [0,0,0,0,1,1|2,0,0]=4 1685 B31R4.113924338 COc1nccc(c1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61904632150 [0,0,0,0,1,1|1,0,0]=3 1686 B31R4.113924338 COc1nccc(c1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-57039385881 [0,0,0,0,1,1|2,0,0]=4 1687 B31R4.113924338 COc1nccc(c1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-60360649201 [0,0,0,0,1,1|2,0,0]=4 1688 B31R4.113924338 COc1nccc(c1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57222351825 [0,0,0,0,1,1|2,0,0]=4 1689 B31R4.113924338 COc1nccc(c1OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-63309602437 [0,0,0,0,1,1|2,0,0]=4 1690 B31R4.116086055 COc1cc(ccc1c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCC4)C#N AIFCHEM-61904817470 [0,0,0,0,1,1|2,0,0]=4 1691 B31R4.116086055 COc1cc(ccc1c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCC4)CO AIFCHEM-61904731282 [0,0,0,0,1,1|2,0,0]=4 1692 B31R4.116086055 COc1ccc(c(c1)OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CC=CCC4 AIFCHEM-60303327583 [0,0,0,0,1,1|0,0,2]=4 1693 B31R4.116086055 COc1ccc(c(c1)OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61907215256 [0,0,0,0,1,1|0,0,0]=2 1694 B31R4.116086055 COc1ccc(c(c1)OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-57040605827 [0,0,0,0,1,1|1,0,0]=3 1695 B31R4.116086055 COc1ccc(c(c1)OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-60363891036 [0,0,0,0,1,1|1,0,0]=3 1696 B31R4.116086055 COc1ccc(c(c1)OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57224288431 [0,0,0,0,1,1|1,0,0]=3 1697 B31R4.116086055 COc1ccc(c(c1)OC)c2cnc3[nH]cc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-63311204923 [0,0,0,0,1,1|1,0,0]=3 1698 B31R4.116086055 COc1ccc(c(c1)OC)c2cnc3[nH]cc(c3c2)NC(=O)C4COCCO4 AIFCHEM-63288600139 [0,0,0,0,1,1|2,0,0]=4 1699 B31R4.116086055 COc1ccc(c(c1)OC)c2cnc3[nH]cc(c3c2)NC(=O)C4SCCCS4 AIFCHEM-53198571632 [0,0,0,0,1,1|2,0,0]=4 1700 B31R4.116086055 COc1ccc(c(c1)OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4CC=CCC4 AIFCHEM-61356479905 [0,0,0,0,1,1|0,0,2]=4 1701 B31R4.116086055 COc1ccc(c(c1)OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@@H]4COCCO4 AIFCHEM-54376655967 [0,0,0,0,1,1|2,0,0]=4 1702 B31R4.116086055 COc1ccc(c(c1)OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4CC=CCC4 AIFCHEM-61310306781 [0,0,0,0,1,1|0,0,2]=4 1703 B31R4.116086055 COc1ccc(c(c1)OC)c2cnc3[nH]cc(c3c2)NC(=O)[C@H]4COCCO4 AIFCHEM-52631233456 [0,0,0,0,1,1|2,0,0]=4 1704 B31R4.116086055 COc1ccc(c(c1)OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61907453932 [0,0,0,0,1,1|1,0,0]=3 1705 B31R4.116086055 COc1ccc(c(c1)OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-57040844503 [0,0,0,0,1,1|2,0,0]=4 1706 B31R4.116086055 COc1ccc(c(c1)OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-60364129712 [0,0,0,0,1,1|2,0,0]=4 1707 B31R4.116086055 COc1ccc(c(c1)OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57224527107 [0,0,0,0,1,1|2,0,0]=4 1708 B31R4.116086055 COc1ccc(c(c1)OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-63311443599 [0,0,0,0,1,1|2,0,0]=4 1709 B31R4.116086055 COc1ccc(c(n1)OC)c2ccc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-88169277601 [0,0,0,0,1,1|2,0,0]=4 1710 B31R4.116086055 COc1ccc(c(n1)OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61908972445 [0,0,0,0,1,1|1,0,0]=3 1711 B31R4.116086055 COc1ccc(c(n1)OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCO4 AIFCHEM-57041671756 [0,0,0,0,1,1|2,0,0]=4 1712 B31R4.116086055 COc1ccc(c(n1)OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCOC4 AIFCHEM-60365789405 [0,0,0,0,1,1|2,0,0]=4 1713 B31R4.116086055 COc1ccc(c(n1)OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCOCC4 AIFCHEM-57224854360 [0,0,0,0,1,1|2,0,0]=4 1714 B31R4.116086055 COc1ccc(c(n1)OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCSCC4 AIFCHEM-63311770852 [0,0,0,0,1,1|2,0,0]=4 1715 B31R4.116086055 COc1ncc(c(n1)OC)c2cnc3[nH]nc(c3c2)NC(=O)C4CCCCC4 AIFCHEM-61904603688 [0,0,0,0,1,1|2,0,0]=4 1716 B33R4.121324919 COc1ccc(cc1OC)c2cnc3ccc(cc3c2)NC(=O)CC4CCCCO4 AIFCHEM-66495928623 [0,0,0,0,0,2|2,0,0]=4 1717 B33R4.121324919 COc1ccc(cc1OC)c2cnc3ccc(cc3c2)NC(=O)CC4CCCOC4 AIFCHEM-64164729093 [0,0,0,0,0,2|2,0,0]=4 1718 B33R4.121324919 COc1ccc(cc1OC)c2cnc3ccc(cc3c2)NC(=O)CC4CCOCC4 AIFCHEM-77332022034 [0,0,0,0,0,2|2,0,0]=4 1719 B33R4.121328680 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C#CC4CCCCC4 AIFCHEM-59969763166 [0,0,0,0,0,2|1,0,0]=3 1720 B33R4.121328680 COc1cc(cnc1OC)c2cnc3[nH]cc(c3c2)NC(=O)CCC4CCCCC4 AIFCHEM-58801218044 [0,0,0,0,0,2|1,0,0]=3 1721 B33R4.121328680 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)C#CC4CCCCC4 AIFCHEM-59969437907 [0,0,0,0,0,2|2,0,0]=4 1722 B33R4.121328680 COc1cc(cnc1OC)c2cnc3[nH]nc(c3c2)NC(=O)CCC4CCCCC4 AIFCHEM-58801061745 [0,0,0,0,0,2|2,0,0]=4 1723 B33R4.121328680 COc1ccc(cc1C#N)c2cnc3[nH]cc(c3c2)NC(=O)C#CC4CCCCC4 AIFCHEM-59966268225 [0,0,0,0,0,2|2,0,0]=4 1724 B33R4.121328680 COc1ccc(cc1OC)c2cnc3[nH]cc(c3c2)NC(=O)C#CC4CCCCC4 AIFCHEM-59969552946 [0,0,0,0,0,2|0,0,0]=2 1725 B33R4.121328680 COc1ccc(cc1OC)c2cnc3[nH]nc(c3c2)NC(=O)CCC4CCCCC4 AIFCHEM-58802041603 [0,0,0,0,0,2|1,0,0]=3