0 B14R1.423 CC(C)CCC(=O)Nc1ccccc1 AIFCHEM-94552045876 [0,0,0,0,0,0|2,0,0]=2 1 B14R1.423 CC(C)CNC(=O)Cc1ccccn1 AIFCHEM-94576235871 [0,0,0,0,0,0|2,0,0]=2 2 B14R1.423 CN(C)CCC(=O)Nc1cccnc1 AIFCHEM-94531015275 [0,0,0,0,0,0|4,0,0]=4 3 B14R1.423 O=C(Cc1ccccn1)NCC(F)F AIFCHEM-94576238556 [0,0,0,0,0,0|4,0,0]=4 4 B13R1.44 CCCCC(=O)Nc1ccccn1 AIFCHEM-94586363259 [1,0,0,0,0,0|3,0,0]=4 5 B13R1.44 CCCCC(=O)Nc1ccncc1 AIFCHEM-94534099520 [1,0,0,0,0,0|3,0,0]=4 6 B13R1.44 CCCCN(C)Cc1ccccc1 AIFCHEM-94536079434 [1,0,0,0,0,0|3,0,0]=4 7 B13R1.44 CCCNC(=O)Cc1ncccn1 AIFCHEM-94521379928 [1,0,0,0,0,0|3,0,0]=4 8 B13R1.337 CC(C)NCCCc1ccccc1 AIFCHEM-94520536453 [1,0,0,0,0,0|2,0,1]=4 9 B15R1.111 CC(C)CCC(=O)Nc1ccc(=O)[nH]c1 AIFCHEM-5999825884 [0,1,0,0,0,0|3,0,0]=4 10 B15R1.111 CC(C)CNC(=O)Cc1ccc(cc1)Cl AIFCHEM-94563728617 [0,1,0,0,0,0|1,0,0]=2 11 B15R1.111 CC(C)CNC(=O)Cc1ccc(cn1)O AIFCHEM-6123065252 [0,1,0,0,0,0|2,0,0]=3 12 B15R1.111 CC(C)OCC(=O)Nc1ccc(cc1)F AIFCHEM-94540072368 [0,1,0,0,0,0|3,0,0]=4 13 B15R1.111 CC(C)OCC(=O)Nc1ccc(cc1)I AIFCHEM-6111723582 [0,1,0,0,0,0|3,0,0]=4 14 B15R1.111 CC(C)SCC(=O)Nc1ccc(cc1)O AIFCHEM-94574887434 [0,1,0,0,0,0|3,0,0]=4 15 B15R1.111 CN(C)CCC(=O)Nc1ccc(cc1)Br AIFCHEM-94608727788 [0,1,0,0,0,0|3,0,0]=4 16 B15R1.111 Cc1ccc(cc1)NC(=O)CCC(C)C AIFCHEM-94584238624 [0,1,0,0,0,0|2,0,0]=3 17 B15R1.111 Cc1ccc(cc1)NC(=O)COC(C)C AIFCHEM-94584236414 [0,1,0,0,0,0|3,0,0]=4 18 B15R1.120 CC(C)CCC(=O)Nc1cccc(c1)Br AIFCHEM-94552712941 [0,1,0,0,0,0|2,0,0]=3 19 B15R1.120 CC(C)CCC(=O)Nc1cccc(c1)Cl AIFCHEM-94523501308 [0,1,0,0,0,0|2,0,0]=3 20 B15R1.120 CC(C)CCN(C)Cc1cccc(c1)Br AIFCHEM-6096442749 [0,1,0,0,0,0|3,0,0]=4 21 B15R1.120 CC(C)CNC(=O)Cc1cccc(c1)O AIFCHEM-6179570320 [0,1,0,0,0,0|1,0,0]=2 22 B15R1.120 CC(C)CNC(=O)Cc1cccc(n1)F AIFCHEM-94563725326 [0,1,0,0,0,0|2,0,0]=3 23 B15R1.120 CC(C)CNC(=O)Cc1cccc(n1)O AIFCHEM-94563734646 [0,1,0,0,0,0|2,0,0]=3 24 B15R1.120 CC(C)CNC(=O)Cc1ccnc(c1)Br AIFCHEM-6179745985 [0,1,0,0,0,0|2,0,0]=3 25 B15R1.120 CC(C)CNC(=O)Cc1ccnc(c1)Cl AIFCHEM-94563734232 [0,1,0,0,0,0|2,0,0]=3 26 B15R1.120 Cc1cccc(c1)NC(=O)COC(C)C AIFCHEM-94565754804 [0,1,0,0,0,0|3,0,0]=4 27 B15R1.120 Cc1ccnc(c1)NC(=O)CCC(C)C AIFCHEM-5859978047 [0,1,0,0,0,0|3,0,0]=4 28 B15R1.256 CC(=O)CNC(=O)Cc1ccccc1Br AIFCHEM-6038494314 [0,1,0,0,0,0|2,0,1]=4 29 B15R1.256 CC(=O)CNC(=O)Cc1ccccc1F AIFCHEM-6012929567 [0,1,0,0,0,0|2,0,1]=4 30 B15R1.256 CC(=O)CNC(=O)Cc1ccccc1I AIFCHEM-6039741741 [0,1,0,0,0,0|2,0,1]=4 31 B15R1.256 CC(C)CCN(C)Cc1ccccc1F AIFCHEM-6149216723 [0,1,0,0,0,0|3,0,0]=4 32 B15R1.256 CC(C)CCN(C)Cc1ccccc1O AIFCHEM-94532463159 [0,1,0,0,0,0|3,0,0]=4 33 B15R1.256 CC(C)OCC(=O)Nc1ccccc1F AIFCHEM-94582112189 [0,1,0,0,0,0|3,0,0]=4 34 B15R1.256 CC(C)SCC(=O)Nc1ccccc1Cl AIFCHEM-94556557408 [0,1,0,0,0,0|3,0,0]=4 35 B15R1.256 CC(C)SCC(=O)Nc1ccccc1I AIFCHEM-5921758989 [0,1,0,0,0,0|3,0,0]=4 36 B15R1.256 Cc1ccccc1CN(C)CCC(C)C AIFCHEM-6180032051 [0,1,0,0,0,0|3,0,0]=4 37 B15R1.256 Cc1ccccc1NC(=O)CSC(C)C AIFCHEM-5921307341 [0,1,0,0,0,0|3,0,0]=4 38 B15R1.496 CC(C)CN(C)C(=O)Cc1ccccn1 AIFCHEM-5782349429 [0,1,0,0,0,0|2,0,0]=3 39 B15R1.964 CC(C#N)CNC(=O)Cc1ccccn1 AIFCHEM-94576240352 [0,1,0,0,0,0|2,0,1]=4 40 B15R1.964 CCC(C)CCC(=O)Nc1ccccn1 AIFCHEM-5962217347 [0,1,0,0,0,0|3,0,0]=4 41 B15R1.964 CCC(C)CNC(=O)Cc1ccncc1 AIFCHEM-94534481126 [0,1,0,0,0,0|2,0,0]=3 42 B15R1.964 CCC(C)CNC(=O)Cc1cncnc1 AIFCHEM-94534482896 [0,1,0,0,0,0|3,0,0]=4 43 B15R1.964 COC(C)CNC(=O)Cc1cncnc1 AIFCHEM-5789710575 [0,1,0,0,0,0|3,0,0]=4 44 B15R1.964 COC(C)CNC(=O)Cc1ncccn1 AIFCHEM-5874258275 [0,1,0,0,0,0|3,0,0]=4 45 B15R1.964 CO[C@@H](C)CNC(=O)Cc1cncnc1 AIFCHEM-5930888581 [0,1,0,0,0,0|3,0,0]=4 46 B15R1.964 CO[C@@H](C)CNC(=O)Cc1ncccn1 AIFCHEM-94588793718 [0,1,0,0,0,0|3,0,0]=4 47 B15R1.964 CO[C@H](C)CNC(=O)Cc1cncnc1 AIFCHEM-94608848812 [0,1,0,0,0,0|3,0,0]=4 48 B15R1.964 CO[C@H](C)CNC(=O)Cc1ncccn1 AIFCHEM-94608849812 [0,1,0,0,0,0|3,0,0]=4 49 B15R1.1078 CC(C)CCC(=O)N(C)c1ccccc1 AIFCHEM-94545189378 [0,1,0,0,0,0|2,0,0]=3 50 B15R1.3675 CC(C)C(C)NC(=O)Cc1ccncc1 AIFCHEM-6191050616 [0,1,0,0,0,0|2,0,0]=3 51 B15R1.3675 CC(C)[C@@H](C)NC(=O)Cc1ccncc1 AIFCHEM-94576831407 [0,1,0,0,0,0|2,0,0]=3 52 B15R1.9108 CC(C)(C)C#CC(=O)Nc1ccccc1 AIFCHEM-94577035229 [0,1,0,0,0,0|2,0,1]=4 53 B15R1.9108 CC(C)(C)CNC(=O)Cc1cnccn1 AIFCHEM-94570504852 [0,1,0,0,0,0|3,0,0]=4 54 B15R1.9108 CC(C)(F)CNC(=O)Cc1cccnc1 AIFCHEM-5770919436 [0,1,0,0,0,0|2,0,0]=3 55 B15R2.491 C[C@@H]1C[C@H]1NC(=O)Cc2ccncc2 AIFCHEM-94559019544 [0,0,0,1,0,0|2,0,0]=3 56 B15R2.596 CC1CC(C1)C(=O)Nc2ccccn2 AIFCHEM-5968895832 [0,0,0,1,0,0|3,0,0]=4 57 B15R2.596 CC1CN(C1)C(=O)Cc2ccncn2 AIFCHEM-5982460887 [0,0,0,1,0,0|3,0,0]=4 58 B15R2.596 O=C(Nc1ccccc1)C2CC(C2)O AIFCHEM-94552041848 [0,0,0,1,0,0|3,0,0]=4 59 B15R2.596 O=C(Nc1ccccc1)[C@H]2C[C@@H](C2)O AIFCHEM-94577030103 [0,0,0,1,0,0|3,0,0]=4 60 B15R2.596 O=C(Nc1ccccc1)[C@H]2C[C@H](C2)O AIFCHEM-94552045208 [0,0,0,1,0,0|3,0,0]=4 61 B15R2.993 CC(C)CN1c2ccccc2CC1C AIFCHEM-94572983761 [0,0,0,1,0,0|2,0,1]=4 62 B15R2.1256 O=C(Cc1cnccn1)NCC2CC2 AIFCHEM-5944467405 [0,0,0,1,0,0|3,0,0]=4 63 B15R2.1256 O=C(Cc1ncccn1)NCC2CC2 AIFCHEM-5974427592 [0,0,0,1,0,0|3,0,0]=4 64 B13R1.45 CC(C)CNC(=O)c1cccnc1 AIFCHEM-6179646778 [0,0,0,0,1,0|2,0,0]=3 65 B13R1.45 CC(C)CNC(=O)c1ccncn1 AIFCHEM-6146598324 [0,0,0,0,1,0|3,0,0]=4 66 B13R1.45 CC(C)CNC(=O)c1ccnnc1 AIFCHEM-6144617235 [0,0,0,0,1,0|3,0,0]=4 67 B13R1.45 CC(C)CNC(=O)c1cnccn1 AIFCHEM-94563734852 [0,0,0,0,1,0|3,0,0]=4 68 B13R1.344 CC(C)CNC(=O)Cc1ccc[nH]1 AIFCHEM-94563733602 [0,0,0,0,1,0|2,0,0]=3 69 B13R1.344 CC(C)CNC(=O)Cn1cccn1 AIFCHEM-94563727928 [0,0,0,0,1,0|3,0,0]=4 70 B13R1.344 CC(C)CNC(=O)Cn1ccnc1 AIFCHEM-6179478995 [0,0,0,0,1,0|3,0,0]=4 71 B13R1.348 CC(C)CC(=O)Nc1ccccn1 AIFCHEM-5962320555 [0,0,0,0,1,0|2,0,0]=3 72 B13R1.348 CC(C)CC(=O)Nc1ccnnc1 AIFCHEM-5599030483 [0,0,0,0,1,0|3,0,0]=4 73 B13R1.348 CC(C)CN(C)Cc1cccnc1 AIFCHEM-5722438368 [0,0,0,0,1,0|3,0,0]=4 74 B13R1.348 CC(C)NC(=O)Cc1ccncn1 AIFCHEM-94520548109 [0,0,0,0,1,0|3,0,0]=4 75 B13R1.348 CC(C)NC(=O)Cc1cnccn1 AIFCHEM-94520544962 [0,0,0,0,1,0|3,0,0]=4 76 B13R1.348 CC(C)NC(=O)Cc1ncccn1 AIFCHEM-94520550543 [0,0,0,0,1,0|3,0,0]=4 77 B15R1.1081 CC(C)COCC(=O)Nc1ccccc1 AIFCHEM-94552042751 [0,0,0,0,0,1|1,0,0]=2 78 B15R1.1081 CC(C)COCC(=O)Nc1ccncc1 AIFCHEM-6172473925 [0,0,0,0,0,1|2,0,0]=3 79 B15R1.5919 CC(C)CNC(=O)CCc1ccccc1 AIFCHEM-94563731673 [0,0,0,0,0,1|1,0,0]=2 80 B15R1.5919 CC(C)CNC(=O)CCc1ccncc1 AIFCHEM-6144403566 [0,0,0,0,0,1|2,0,0]=3 81 B15R1.5919 CC(C)CNC(=O)CSc1ncccn1 AIFCHEM-94568044658 [0,0,0,0,0,1|3,0,0]=4 82 B15R1.5919 CC(C)OCC(=O)NCc1ccccc1 AIFCHEM-94554639947 [0,0,0,0,0,1|2,0,0]=3 83 B15R1.5919 CC(C)OCC(=O)NCc1ccncc1 AIFCHEM-5828849454 [0,0,0,0,0,1|3,0,0]=4 84 B15R1.5919 CC(C)SCC(=O)NCc1ccccc1 AIFCHEM-5794768640 [0,0,0,0,0,1|2,0,0]=3 85 B15R1.5919 CC(C)SCC(=O)NCc1cccnc1 AIFCHEM-6238933991 [0,0,0,0,0,1|3,0,0]=4 86 B15R1.5919 CC(C)SCC(=O)NCc1ccncc1 AIFCHEM-5828173720 [0,0,0,0,0,1|3,0,0]=4 87 B15R1.5919 O=C(COc1ccccc1)NCC(F)F AIFCHEM-5987787411 [0,0,0,0,0,1|3,0,0]=4 88 B12R1.32 O=C(CCO)Nc1ccccc1 AIFCHEM-94552044770 [2,0,0,0,0,0|2,0,0]=4 89 B14R1.33 CCCCC(=O)Nc1ccc(cc1)Br AIFCHEM-94608720893 [1,1,0,0,0,0|2,0,0]=4 90 B14R1.33 CCCCC(=O)Nc1ccc(cc1)I AIFCHEM-94534108884 [1,1,0,0,0,0|2,0,0]=4 91 B14R1.33 CCCNC(=O)Cc1ccc(cc1)Br AIFCHEM-94521375627 [1,1,0,0,0,0|1,0,0]=3 92 B14R1.33 CCCNC(=O)Cc1ccc(cc1)C AIFCHEM-94521379642 [1,1,0,0,0,0|1,0,0]=3 93 B14R1.33 CCCNC(=O)Cc1ccc(cc1)O AIFCHEM-94521374824 [1,1,0,0,0,0|1,0,0]=3 94 B14R1.33 CCCNC(=O)Cc1ccc(nc1)Cl AIFCHEM-94521378090 [1,1,0,0,0,0|2,0,0]=4 95 B14R1.34 CCCNC(=O)Cc1cccc(n1)Cl AIFCHEM-94521381156 [1,1,0,0,0,0|2,0,0]=4 96 B14R1.158 COCCNC(=O)Cc1ccncc1 AIFCHEM-94603098759 [1,1,0,0,0,0|2,0,0]=4 97 B14R1.158 CSCCNC(=O)Cc1cccnc1 AIFCHEM-94598931452 [1,1,0,0,0,0|2,0,0]=4 98 B14R1.166 CCCCC(=O)N(C)c1ccccc1 AIFCHEM-94534075227 [1,1,0,0,0,0|2,0,0]=4 99 B14R1.166 CCCNC(=O)C(O)c1ccccc1 AIFCHEM-5875709630 [1,1,0,0,0,0|1,0,0]=3 100 B14R1.166 CCCNC(=O)[C@@H](O)c1ccccc1 AIFCHEM-94521375229 [1,1,0,0,0,0|1,0,0]=3 101 B14R1.166 CCCNC(=O)[C@H](O)c1ccccc1 AIFCHEM-94521379556 [1,1,0,0,0,0|1,0,0]=3 102 B14R1.946 CCCCC(=O)Nc1ccccc1O AIFCHEM-94534110253 [1,1,0,0,0,0|2,0,0]=4 103 B14R1.946 CCCNC(=O)Cc1ccccc1Br AIFCHEM-94521375596 [1,1,0,0,0,0|1,0,0]=3 104 B14R1.946 CCCNC(=O)Cc1ccccc1I AIFCHEM-94521375595 [1,1,0,0,0,0|1,0,0]=3 105 B14R1.946 CCCNC(=O)Cn1ccccc1=O AIFCHEM-5815202370 [1,1,0,0,0,0|2,0,0]=4 106 B14R1.946 O=C(Cc1ccccc1O)NCCF AIFCHEM-5802585226 [1,1,0,0,0,0|2,0,0]=4 107 B14R1.148 CC(C)CCNCc1cccc(c1)I AIFCHEM-6094180307 [1,1,0,0,0,0|2,0,0]=4 108 B14R1.148 CC(C)CCNCc1cccc(c1)O AIFCHEM-6184058654 [1,1,0,0,0,0|2,0,0]=4 109 B14R1.159 CC(C)CCNCc1ccccc1F AIFCHEM-6120953609 [1,1,0,0,0,0|2,0,0]=4 110 B14R1.159 CC(C)CCNCc1ccccc1O AIFCHEM-94532466780 [1,1,0,0,0,0|2,0,0]=4 111 B14R1.677 CC(C)CNCCc1ccc(cc1)Cl AIFCHEM-6162018382 [1,1,0,0,0,0|1,0,1]=4 112 B14R1.677 Cc1ccc(cc1)CNCCC(C)C AIFCHEM-6120772359 [1,1,0,0,0,0|2,0,0]=4 113 B14R1.3331 CC(C)(C)CCNCc1ccccc1 AIFCHEM-94539147833 [1,1,0,0,0,0|2,0,0]=4 114 B14R1.160 CC(C)CNC(=O)c1c[nH]ccc1=O AIFCHEM-94563732532 [0,1,0,0,1,0|2,0,0]=4 115 B14R1.160 CC(C)CNC(=O)c1ccc[nH]c1=O AIFCHEM-6162856171 [0,1,0,0,1,0|2,0,0]=4 116 B14R1.160 CC(C)CNC(=O)c1ccccc1Cl AIFCHEM-94562158514 [0,1,0,0,1,0|1,0,0]=3 117 B14R1.160 CC(C)CNC(=O)c1ccccc1I AIFCHEM-94563734091 [0,1,0,0,1,0|1,0,0]=3 118 B14R1.160 CC(C)CNC(=O)c1ccncc1I AIFCHEM-94563732317 [0,1,0,0,1,0|2,0,0]=4 119 B14R1.160 Cc1cccnc1C(=O)NCC(C)C AIFCHEM-94563726548 [0,1,0,0,1,0|2,0,0]=4 120 B14R1.160 Cc1ncccc1C(=O)NCC(C)C AIFCHEM-94563730459 [0,1,0,0,1,0|2,0,0]=4 121 B14R1.163 CC(C#N)CNC(=O)c1ccccc1 AIFCHEM-94565586155 [0,1,0,0,1,0|1,0,1]=4 122 B14R1.163 COC(C)CNC(=O)c1ccccc1 AIFCHEM-94565583674 [0,1,0,0,1,0|1,0,0]=3 123 B14R1.163 CO[C@@H](C)CNC(=O)c1ccccc1 AIFCHEM-94565585501 [0,1,0,0,1,0|1,0,0]=3 124 B14R1.163 CO[C@H](C)CNC(=O)c1ccccc1 AIFCHEM-94608849716 [0,1,0,0,1,0|1,0,0]=3 125 B14R1.417 CC(C)CN(C)C(=O)c1ccccn1 AIFCHEM-94578923325 [0,1,0,0,1,0|2,0,0]=4 126 B14R1.678 CC(C)CNC(=O)c1ccc(cn1)Br AIFCHEM-94563730347 [0,1,0,0,1,0|2,0,0]=4 127 B14R1.678 CC(C)CNC(=O)c1ccc(cn1)Cl AIFCHEM-94563733981 [0,1,0,0,1,0|2,0,0]=4 128 B14R1.678 CC(C)CNC(=O)c1ccc(cn1)I AIFCHEM-6179479297 [0,1,0,0,1,0|2,0,0]=4 129 B14R1.678 Cc1ccc(nc1)C(=O)NCC(C)C AIFCHEM-94527139816 [0,1,0,0,1,0|2,0,0]=4 130 B14R1.3098 CC(C)(C)CNC(=O)c1cccnc1 AIFCHEM-5909607595 [0,1,0,0,1,0|2,0,0]=4 131 B14R1.129 CC(C)CNC(=O)Cc1cc(cs1)Br AIFCHEM-94563727974 [0,1,0,0,1,0|2,0,0]=4 132 B14R1.129 CC(C)CNC(=O)Cc1ccc(s1)Cl AIFCHEM-94563727174 [0,1,0,0,1,0|2,0,0]=4 133 B14R1.416 CC(C)CN(C)C(=O)Cc1ccc[nH]1 AIFCHEM-94593337092 [0,1,0,0,1,0|2,0,0]=4 134 B14R1.416 CC(C)CN(C)C(=O)Cc1cccs1 AIFCHEM-5737119165 [0,1,0,0,1,0|2,0,0]=4 135 B14R1.731 CCC(C)CNC(=O)Cc1ccc[nH]1 AIFCHEM-94534484578 [0,1,0,0,1,0|2,0,0]=4 136 B14R1.731 CO[C@@H](C)CNC(=O)Cc1ccco1 AIFCHEM-94588790872 [0,1,0,0,1,0|2,0,0]=4 137 B14R1.731 CO[C@H](C)CNC(=O)Cc1ccco1 AIFCHEM-94608846966 [0,1,0,0,1,0|2,0,0]=4 138 B14R1.6470 CC(C)(F)CNC(=O)Cc1ccc[nH]1 AIFCHEM-94593339296 [0,1,0,0,1,0|2,0,0]=4 139 B14R1.6470 CC(C)(F)CNC(=O)Cn1cccc1 AIFCHEM-5742615398 [0,1,0,0,1,0|2,0,0]=4 140 B14R1.337 CC(C)CC(=O)Nc1ccc[nH]c1=O AIFCHEM-94549277101 [0,1,0,0,1,0|2,0,0]=4 141 B14R1.337 CC(C)CC(=O)Nc1ccncc1Br AIFCHEM-5789873726 [0,1,0,0,1,0|2,0,0]=4 142 B14R1.337 CC(C)CN(C)Cc1ccccc1O AIFCHEM-94534575895 [0,1,0,0,1,0|2,0,0]=4 143 B14R1.337 CC(C)NC(=O)Cc1cccnc1Cl AIFCHEM-94520550204 [0,1,0,0,1,0|2,0,0]=4 144 B14R1.337 CC(C)NC(=O)Cc1ncccc1Br AIFCHEM-94520550716 [0,1,0,0,1,0|2,0,0]=4 145 B14R1.337 CC(C)NC(=O)Cc1ncccc1Cl AIFCHEM-94520551768 [0,1,0,0,1,0|2,0,0]=4 146 B14R1.337 Cc1ccccc1CC(=O)NC(C)C AIFCHEM-94520550415 [0,1,0,0,1,0|1,0,0]=3 147 B14R1.337 Cc1ccccc1NC(=O)CC(C)C AIFCHEM-5892461333 [0,1,0,0,1,0|1,0,0]=3 148 B14R1.337 Cc1cccnc1NC(=O)CC(C)C AIFCHEM-6049868327 [0,1,0,0,1,0|2,0,0]=4 149 B14R1.425 CC(C)C(C)C(=O)Nc1cccnc1 AIFCHEM-94531010027 [0,1,0,0,1,0|2,0,0]=4 150 B14R1.425 CC(C)C(O)C(=O)Nc1ccccn1 AIFCHEM-94586368599 [0,1,0,0,1,0|2,0,0]=4 151 B14R1.425 CC(C)C(O)C(=O)Nc1ccncc1 AIFCHEM-94533900851 [0,1,0,0,1,0|2,0,0]=4 152 B14R1.425 CC(C)N(C)C(=O)Cc1ccncc1 AIFCHEM-94547946722 [0,1,0,0,1,0|2,0,0]=4 153 B14R1.425 CC(C)[C@@H](O)C(=O)Nc1ccccn1 AIFCHEM-94586365745 [0,1,0,0,1,0|2,0,0]=4 154 B14R1.425 CC(C)[C@@H](O)C(=O)Nc1ccncc1 AIFCHEM-94533897997 [0,1,0,0,1,0|2,0,0]=4 155 B14R1.425 CC(C)[C@H](O)C(=O)Nc1ccccn1 AIFCHEM-94586365744 [0,1,0,0,1,0|2,0,0]=4 156 B14R1.425 CC(C)[C@H](O)C(=O)Nc1ccncc1 AIFCHEM-94533897996 [0,1,0,0,1,0|2,0,0]=4 157 B14R1.433 CC(C)(Cl)CC(=O)Nc1ccccc1 AIFCHEM-94604515586 [0,1,0,0,1,0|1,0,0]=3 158 B14R1.433 CC(C)(Cl)CC(=O)Nc1ccncc1 AIFCHEM-94533902245 [0,1,0,0,1,0|2,0,0]=4 159 B14R1.433 CC(C)(O)CC(=O)Nc1ccncc1 AIFCHEM-94533902368 [0,1,0,0,1,0|2,0,0]=4 160 B14R1.698 CC(C)CC(=O)Nc1ccc(cn1)Br AIFCHEM-5726684306 [0,1,0,0,1,0|2,0,0]=4 161 B14R1.698 CC(C)CN(C)Cc1ccc(cc1)Br AIFCHEM-5736479595 [0,1,0,0,1,0|2,0,0]=4 162 B14R1.698 CC(C)CN(C)Cc1ccc(cc1)Cl AIFCHEM-94572983444 [0,1,0,0,1,0|2,0,0]=4 163 B14R1.698 CC(C)CN(C)Cc1ccc(cc1)O AIFCHEM-94572984781 [0,1,0,0,1,0|2,0,0]=4 164 B14R1.698 CC(C)NC(=O)Cc1ccc(cc1)F AIFCHEM-94520548779 [0,1,0,0,1,0|1,0,0]=3 165 B14R1.698 CC(C)NC(=O)Cc1ccc(cc1)O AIFCHEM-94520545439 [0,1,0,0,1,0|1,0,0]=3 166 B14R1.698 CC(C)NC(=O)Cc1ccc(cn1)Cl AIFCHEM-94520542951 [0,1,0,0,1,0|2,0,0]=4 167 B14R1.698 CC(C)NC(=O)Cn1ccc(=O)cc1 AIFCHEM-94520549058 [0,1,0,0,1,0|2,0,0]=4 168 B14R1.698 Cc1ccc(cc1)CC(=O)NC(C)C AIFCHEM-94520550257 [0,1,0,0,1,0|1,0,0]=3 169 B14R1.5978 CC(C)CC(=O)Nc1cccc(c1)O AIFCHEM-94542290054 [0,1,0,0,1,0|1,0,0]=3 170 B14R1.5978 CC(C)CC(=O)Nc1cccc(n1)O AIFCHEM-94555800439 [0,1,0,0,1,0|2,0,0]=4 171 B14R1.5978 CC(C)CN(C)Cc1cccc(c1)O AIFCHEM-94572973057 [0,1,0,0,1,0|2,0,0]=4 172 B14R1.5978 CC(C)NC(=O)Cc1cccc(c1)Br AIFCHEM-94520546241 [0,1,0,0,1,0|1,0,0]=3 173 B14R1.5978 CC(C)NC(=O)Cc1ccnc(c1)Cl AIFCHEM-94520551855 [0,1,0,0,1,0|2,0,0]=4 174 B14R1.5978 CC(O)CC(=O)Nc1cccc(c1)F AIFCHEM-94579360197 [0,1,0,0,1,0|2,0,0]=4 175 B14R1.5978 C[C@@H](O)CC(=O)Nc1cccc(c1)F AIFCHEM-94579362559 [0,1,0,0,1,0|2,0,0]=4 176 B14R1.5978 C[C@H](O)CC(=O)Nc1cccc(c1)F AIFCHEM-94579362498 [0,1,0,0,1,0|2,0,0]=4 177 B14R1.5978 Cc1cccc(c1)NC(=O)CC(C)O AIFCHEM-94565754498 [0,1,0,0,1,0|2,0,0]=4 178 B14R1.5978 Cc1cccc(c1)NC(=O)C[C@@H](C)O AIFCHEM-94565756860 [0,1,0,0,1,0|2,0,0]=4 179 B14R1.5978 Cc1cccc(c1)NC(=O)C[C@H](C)O AIFCHEM-94565756799 [0,1,0,0,1,0|2,0,0]=4 180 B16R1.613 CC(=CCNC(=O)C(C)c1ccccc1)C AIFCHEM-94550258285 [0,1,0,0,0,1|1,0,1]=4 181 B16R1.613 CC(=CCNC(=O)C(O)c1ccccc1)C AIFCHEM-5944374964 [0,1,0,0,0,1|1,0,1]=4 182 B16R1.613 CC(=CCNC(=O)[C@@H](C)c1ccccc1)C AIFCHEM-94550260228 [0,1,0,0,0,1|1,0,1]=4 183 B16R1.613 CC(=CCNC(=O)[C@@H](O)c1ccccc1)C AIFCHEM-94550254921 [0,1,0,0,0,1|1,0,1]=4 184 B16R1.613 CC(=CCNC(=O)[C@H](C)c1ccccc1)C AIFCHEM-5944186209 [0,1,0,0,0,1|1,0,1]=4 185 B16R1.613 CC(=CCNC(=O)[C@H](O)c1ccccc1)C AIFCHEM-94550259248 [0,1,0,0,0,1|1,0,1]=4 186 B16R1.613 CC(C)CCNC(=O)[C@@H](C)c1ccccc1 AIFCHEM-6098753438 [0,1,0,0,0,1|1,0,0]=3 187 B16R1.613 CC(C)CNCC(=O)N(C)c1ccccc1 AIFCHEM-94572973453 [0,1,0,0,0,1|2,0,0]=4 188 B16R1.613 CC(C)COCC(=O)N(C)c1ccccc1 AIFCHEM-94545186253 [0,1,0,0,0,1|1,0,0]=3 189 B16R1.1067 CC(=CCNC(=O)Cc1ccc(cc1)C)C AIFCHEM-94550259334 [0,1,0,0,0,1|1,0,1]=4 190 B16R1.1067 CC(=CCNC(=O)Cc1ccc(cc1)I)C AIFCHEM-5968973500 [0,1,0,0,0,1|1,0,1]=4 191 B16R1.1067 CC(C)CCCC(=O)Nc1ccc(cc1)F AIFCHEM-94540074441 [0,1,0,0,0,1|2,0,0]=4 192 B16R1.1067 CN(C)CCNC(=O)Cc1ccc(cc1)F AIFCHEM-94537684386 [0,1,0,0,0,1|2,0,0]=4 193 B16R1.1067 CN(C)CCNC(=O)Cc1ccc(cc1)I AIFCHEM-5962321528 [0,1,0,0,0,1|2,0,0]=4 194 B16R1.1067 Cc1ccc(cc1)NC(=O)CCCC(C)C AIFCHEM-94584238487 [0,1,0,0,0,1|2,0,0]=4 195 B16R1.1067 Cc1ccc(nc1)CC(=O)NCCC(C)C AIFCHEM-6094414080 [0,1,0,0,0,1|2,0,0]=4 196 B16R1.7414 CC(=CCNC(=O)Cc1ccccc1Br)C AIFCHEM-94550255288 [0,1,0,0,0,1|1,0,1]=4 197 B16R1.7414 CC(=CCNC(=O)Cc1ccccc1F)C AIFCHEM-5944030352 [0,1,0,0,0,1|1,0,1]=4 198 B16R1.7414 CC(C)CCCC(=O)Nc1ccccc1I AIFCHEM-5899673340 [0,1,0,0,0,1|2,0,0]=4 199 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1F AIFCHEM-6098415413 [0,1,0,0,0,1|1,0,0]=3 200 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1I AIFCHEM-6132347021 [0,1,0,0,0,1|1,0,0]=3 201 B16R1.7414 CC(C)CCNC(=O)Cc1ncccc1Cl AIFCHEM-6135262449 [0,1,0,0,0,1|2,0,0]=4 202 B16R1.7414 CC(C)COCC(=O)Nc1ccncc1F AIFCHEM-5910367485 [0,1,0,0,0,1|2,0,0]=4 203 B16R1.7414 CC(C)COCC(=O)Nc1cnccc1Br AIFCHEM-5929250680 [0,1,0,0,0,1|2,0,0]=4 204 B16R1.7414 CN(C)CCNC(=O)Cc1ccccc1Cl AIFCHEM-94537682953 [0,1,0,0,0,1|2,0,0]=4 205 B16R1.7414 CN(C)CCNC(=O)Cc1ccccc1F AIFCHEM-94537684624 [0,1,0,0,0,1|2,0,0]=4 206 B16R1.7414 CN(C)CCNC(=O)Cc1ccccc1O AIFCHEM-5916620778 [0,1,0,0,0,1|2,0,0]=4 207 B16R1.7414 Cc1ccccc1NC(=O)CCCC(C)C AIFCHEM-5945722048 [0,1,0,0,0,1|2,0,0]=4 208 B16R1.7414 Cc1ccccc1NC(=O)CNCC(C)C AIFCHEM-94572975614 [0,1,0,0,0,1|2,0,0]=4 209 B16R1.11236 CC(=CCNC(=O)Cc1cccc(c1)Cl)C AIFCHEM-5944139105 [0,1,0,0,0,1|1,0,1]=4 210 B16R1.11236 CC(=CCNC(=O)Cc1cccc(c1)F)C AIFCHEM-5962220987 [0,1,0,0,0,1|1,0,1]=4 211 B16R1.11236 CC(C)CCNC(=O)Cc1ccnc(c1)Cl AIFCHEM-6132338138 [0,1,0,0,0,1|2,0,0]=4 212 B16R1.11236 CC(C)COCC(=O)Nc1cc(ccn1)Cl AIFCHEM-5905273204 [0,1,0,0,0,1|2,0,0]=4 213 B16R1.11236 CC(C)COCC(=O)Nc1cc(ccn1)I AIFCHEM-6070519725 [0,1,0,0,0,1|2,0,0]=4 214 B16R1.11236 CC(C)COCC(=O)Nc1cccc(c1)Cl AIFCHEM-94552612281 [0,1,0,0,0,1|1,0,0]=3 215 B16R1.11236 CC(C)COCC(=O)Nc1cncc(c1)Br AIFCHEM-6236249146 [0,1,0,0,0,1|2,0,0]=4 216 B16R1.11236 CC(C)COCC(=O)Nc1cncc(c1)O AIFCHEM-94532893934 [0,1,0,0,0,1|2,0,0]=4 217 B16R1.11236 CN(C)CCNC(=O)Cc1cccc(c1)Cl AIFCHEM-5895867288 [0,1,0,0,0,1|2,0,0]=4 218 B16R1.11236 Cc1cc(ccn1)NC(=O)COCC(C)C AIFCHEM-5813191653 [0,1,0,0,0,1|2,0,0]=4 219 B16R1.11236 Cc1cccc(c1)NC(=O)COCC(C)C AIFCHEM-6128845598 [0,1,0,0,0,1|1,0,0]=3 220 B16R1.11236 Cc1cccc(n1)NC(=O)COCC(C)C AIFCHEM-6191904659 [0,1,0,0,0,1|2,0,0]=4 221 B16R1.11236 Cc1ccnc(c1)NC(=O)COCC(C)C AIFCHEM-5859653033 [0,1,0,0,0,1|2,0,0]=4 222 B16R1.59031 CC(C)(C)CCNC(=O)Cc1ccccn1 AIFCHEM-6202221919 [0,1,0,0,0,1|2,0,0]=4 223 B16R1.400 CC(C)CCC(=O)NCc1ccccc1O AIFCHEM-94592073601 [0,1,0,0,0,1|1,0,0]=3 224 B16R1.400 CC(C)CCC(=O)NCc1ccncc1F AIFCHEM-94598685591 [0,1,0,0,0,1|2,0,0]=4 225 B16R1.400 CC(C)OCC(=O)NCc1ccccc1O AIFCHEM-94592071391 [0,1,0,0,0,1|2,0,0]=4 226 B16R1.400 CC(C)SCC(=O)NCc1ccccc1F AIFCHEM-94520802216 [0,1,0,0,0,1|2,0,0]=4 227 B16R1.400 CC(C)SCC(=O)NCc1ccccc1O AIFCHEM-94592070314 [0,1,0,0,0,1|2,0,0]=4 228 B16R1.400 CN(C)CCC(=O)NCc1ccccc1O AIFCHEM-94592068410 [0,1,0,0,0,1|2,0,0]=4 229 B16R1.400 Cc1ccccc1C#CC(=O)NCC(C)C AIFCHEM-6162937157 [0,1,0,0,0,1|1,0,1]=4 230 B16R1.1061 CC(C)CNC(=O)C#Cc1ccc(cc1)Cl AIFCHEM-6144580322 [0,1,0,0,0,1|1,0,1]=4 231 B16R1.1061 CC(C)CNC(=O)CCc1ccc(cc1)I AIFCHEM-94563728047 [0,1,0,0,0,1|1,0,0]=3 232 B16R1.1061 CC(C)CNC(=O)COc1ccc(cc1)O AIFCHEM-94590261360 [0,1,0,0,0,1|1,0,0]=3 233 B16R1.1061 CC(C)CNC(=O)COc1ccc(cn1)Br AIFCHEM-6164035201 [0,1,0,0,0,1|2,0,0]=4 234 B16R1.1061 CC(C)CNC(=O)CSc1ccc(cc1)Cl AIFCHEM-6145055981 [0,1,0,0,0,1|1,0,0]=3 235 B16R1.1061 CC(C)OCC(=O)NCc1ccc(cc1)I AIFCHEM-94549227729 [0,1,0,0,0,1|2,0,0]=4 236 B16R1.1061 CC(C)OCC(=O)NCc1ccc(cc1)O AIFCHEM-94544423380 [0,1,0,0,0,1|2,0,0]=4 237 B16R1.1061 CN(C)CCC(=O)NCc1ccc(cc1)Br AIFCHEM-94592191715 [0,1,0,0,0,1|2,0,0]=4 238 B16R1.1061 CN(C)CCC(=O)NCc1ccc(cc1)I AIFCHEM-94548661136 [0,1,0,0,0,1|2,0,0]=4 239 B16R1.1343 CC(C#N)CNC(=O)COc1ccccc1 AIFCHEM-6017324313 [0,1,0,0,0,1|1,0,1]=4 240 B16R1.1343 CCC(C)CCC(=O)NCc1ccccn1 AIFCHEM-5708412557 [0,1,0,0,0,1|2,0,0]=4 241 B16R1.1343 CCC(C)CNC(=O)COc1ccccc1 AIFCHEM-94534477427 [0,1,0,0,0,1|1,0,0]=3 242 B16R1.1343 CCC(F)CNC(=O)CCc1ccccc1 AIFCHEM-5870432149 [0,1,0,0,0,1|2,0,0]=4 243 B16R1.1343 COC(C)CNC(=O)COc1ccccn1 AIFCHEM-5789278435 [0,1,0,0,0,1|2,0,0]=4 244 B16R1.1343 COC(C)CNC(=O)COc1cccnc1 AIFCHEM-5790083566 [0,1,0,0,0,1|2,0,0]=4 245 B16R1.1343 CO[C@@H](C)CNC(=O)CCc1cccnc1 AIFCHEM-94588791684 [0,1,0,0,0,1|2,0,0]=4 246 B16R1.1343 CO[C@@H](C)CNC(=O)COc1ccccn1 AIFCHEM-5898836311 [0,1,0,0,0,1|2,0,0]=4 247 B16R1.1343 CO[C@@H](C)CNC(=O)COc1cccnc1 AIFCHEM-94588794761 [0,1,0,0,0,1|2,0,0]=4 248 B16R1.1343 CO[C@H](C)CNC(=O)CCc1cccnc1 AIFCHEM-94608847778 [0,1,0,0,0,1|2,0,0]=4 249 B16R1.1343 CO[C@H](C)CNC(=O)COc1cccnc1 AIFCHEM-94608850855 [0,1,0,0,0,1|2,0,0]=4 250 B16R1.4122 CC(C)C(C)NC(=O)CCc1ccccn1 AIFCHEM-6190824065 [0,1,0,0,0,1|2,0,0]=4 251 B16R1.4122 CC(C)C(C)NC(=O)CCc1cccnc1 AIFCHEM-6215245649 [0,1,0,0,0,1|2,0,0]=4 252 B16R1.4122 CC(C)C(C)NC(=O)CCc1ccncc1 AIFCHEM-6211600601 [0,1,0,0,0,1|2,0,0]=4 253 B16R1.4122 CC(C)C(C)NC(=O)COc1ccccn1 AIFCHEM-6190557790 [0,1,0,0,0,1|2,0,0]=4 254 B16R1.4122 CC(C)[C@@H](C)NC(=O)C#Cc1ccccc1 AIFCHEM-94576831262 [0,1,0,0,0,1|1,0,1]=4 255 B16R1.4122 CC(C)[C@@H](C)NC(=O)CCc1ccccn1 AIFCHEM-94576826236 [0,1,0,0,0,1|2,0,0]=4 256 B16R1.4122 CC(C)[C@@H](C)NC(=O)CCc1cccnc1 AIFCHEM-94576829391 [0,1,0,0,0,1|2,0,0]=4 257 B16R1.4122 CC(C)[C@@H](C)NC(=O)CCc1ccncc1 AIFCHEM-94576831209 [0,1,0,0,0,1|2,0,0]=4 258 B16R1.6944 CC(C)CN(C)C(=O)CCc1ccccn1 AIFCHEM-5768855206 [0,1,0,0,0,1|2,0,0]=4 259 B16R1.6944 CC(C)CN(C)C(=O)CSc1ccncc1 AIFCHEM-94591223144 [0,1,0,0,0,1|2,0,0]=4 260 B16R1.7611 CC(C)CCC(=O)N[C@@H](C)c1cccnc1 AIFCHEM-94593294803 [0,1,0,0,0,1|2,0,0]=4 261 B16R1.7611 CC(C)CCC(=O)N[C@H](C)c1cccnc1 AIFCHEM-94529458388 [0,1,0,0,0,1|2,0,0]=4 262 B16R1.7611 CC(C)CNC(=O)CC(C)c1ccccc1 AIFCHEM-94563731432 [0,1,0,0,0,1|1,0,0]=3 263 B16R1.7611 CC(C)CNC(=O)CC(C)c1cccnc1 AIFCHEM-94589258996 [0,1,0,0,0,1|2,0,0]=4 264 B16R1.7611 CC(C)CNC(=O)CC(O)c1ccccc1 AIFCHEM-94563730690 [0,1,0,0,0,1|1,0,0]=3 265 B16R1.7611 CC(C)CNC(=O)C[C@@H](C)c1ccccc1 AIFCHEM-6123763368 [0,1,0,0,0,1|1,0,0]=3 266 B16R1.7611 CC(C)CNC(=O)C[C@H](C)c1ccccc1 AIFCHEM-94574436096 [0,1,0,0,0,1|1,0,0]=3 267 B16R1.11227 CC(C)CCC(=O)NCc1cc(ccn1)Cl AIFCHEM-5748154429 [0,1,0,0,0,1|2,0,0]=4 268 B16R1.11227 CC(C)CNC(=O)C#Cc1cccc(c1)Cl AIFCHEM-94563733319 [0,1,0,0,0,1|1,0,1]=4 269 B16R1.11227 CC(C)CNC(=O)COc1cccc(c1)F AIFCHEM-94563731151 [0,1,0,0,0,1|1,0,0]=3 270 B16R1.11227 Cc1cccc(c1)CNC(=O)COC(C)C AIFCHEM-5758289949 [0,1,0,0,0,1|2,0,0]=4 271 B16R1.11227 Cc1cccc(c1)OCC(=O)NCC(C)C AIFCHEM-6123199358 [0,1,0,0,0,1|1,0,0]=3 272 B16R1.22556 CC(C)(C)CNC(=O)CCc1ccccn1 AIFCHEM-5977738890 [0,1,0,0,0,1|2,0,0]=4 273 B16R1.22556 CC(C)(C)CNC(=O)CCc1cccnc1 AIFCHEM-94570508399 [0,1,0,0,0,1|2,0,0]=4 274 B16R1.22556 CC(C)(C)CNC(=O)COc1ccccc1 AIFCHEM-5928031193 [0,1,0,0,0,1|1,0,0]=3 275 B16R1.22556 CC(C)(C)CNC(=O)CSc1ccccc1 AIFCHEM-94570503050 [0,1,0,0,0,1|1,0,0]=3 276 B16R1.22556 CC(C)(F)CNC(=O)COc1ccccn1 AIFCHEM-5783276728 [0,1,0,0,0,1|2,0,0]=4 277 B16R1.22556 CC(C)(F)CNC(=O)COc1cccnc1 AIFCHEM-5771030855 [0,1,0,0,0,1|2,0,0]=4 278 B16R1.22556 CC(C)(F)CNC(=O)CSc1ccccc1 AIFCHEM-5771069887 [0,1,0,0,0,1|1,0,0]=3 279 B16R1.22556 CC(F)(F)CCC(=O)NCc1ccccc1 AIFCHEM-94539152644 [0,1,0,0,0,1|2,0,0]=4 280 B16R1.4 CC(C)CNC(=O)Cc1ccc(cc1)C#N AIFCHEM-6162506004 [0,2,0,0,0,0|1,0,0]=3 281 B16R1.1027 CC(C)CCC(=O)N(C)c1ccc(cc1)F AIFCHEM-5880933643 [0,2,0,0,0,0|2,0,0]=4 282 B16R1.1027 CC(C)CNC(=O)C(O)c1ccc(cc1)Cl AIFCHEM-6145354161 [0,2,0,0,0,0|1,0,0]=3 283 B16R1.1027 CC(C)CNC(=O)[C@@H](O)c1ccc(cc1)Cl AIFCHEM-94563733448 [0,2,0,0,0,0|1,0,0]=3 284 B16R1.1027 CC(C)CNC(=O)[C@H](O)c1ccc(cc1)Cl AIFCHEM-6146174014 [0,2,0,0,0,0|1,0,0]=3 285 B16R1.1036 CC(C)CCC(=O)Nc1ccc(c(c1)Br)Br AIFCHEM-5792007604 [0,2,0,0,0,0|2,0,0]=4 286 B16R1.1036 CC(C)CNC(=O)Cc1ccc(c(c1)O)O AIFCHEM-94563725469 [0,2,0,0,0,0|1,0,0]=3 287 B16R1.1065 CC(C)CN(C)C(=O)Cc1ccc(nc1)Cl AIFCHEM-5782443130 [0,2,0,0,0,0|2,0,0]=4 288 B16R1.1066 CC(C)C(C)NC(=O)Cc1ccc(cc1)Cl AIFCHEM-6211634841 [0,2,0,0,0,0|1,0,0]=3 289 B16R1.1066 CC(C)C(C)NC(=O)Cc1ccc(cc1)I AIFCHEM-6215506874 [0,2,0,0,0,0|1,0,0]=3 290 B16R1.1066 CC(C)C(C)NC(=O)Cc1ccc(cn1)F AIFCHEM-6190800983 [0,2,0,0,0,0|2,0,0]=4 291 B16R1.1066 CC(C)[C@@H](C)NC(=O)Cc1ccc(cc1)Cl AIFCHEM-94576827122 [0,2,0,0,0,0|1,0,0]=3 292 B16R1.1066 CC(C)[C@@H](C)NC(=O)Cc1ccc(cc1)I AIFCHEM-94576826908 [0,2,0,0,0,0|1,0,0]=3 293 B16R1.1066 CC(C)[C@@H](C)NC(=O)Cc1ccc(cn1)F AIFCHEM-94576823830 [0,2,0,0,0,0|2,0,0]=4 294 B16R1.1066 Cc1ccc(cc1)CC(=O)NC(C)C(C)C AIFCHEM-6191065441 [0,2,0,0,0,0|1,0,0]=3 295 B16R1.1066 Cc1ccc(cc1)CC(=O)N[C@H](C)C(C)C AIFCHEM-94576831139 [0,2,0,0,0,0|1,0,0]=3 296 B16R1.1066 Cc1ccc(cn1)CC(=O)NC(C)C(C)C AIFCHEM-6211880518 [0,2,0,0,0,0|2,0,0]=4 297 B16R1.1066 Cc1ccc(cn1)CC(=O)N[C@H](C)C(C)C AIFCHEM-94576827341 [0,2,0,0,0,0|2,0,0]=4 298 B16R1.1147 CCC(C)CCC(=O)Nc1ccc(cc1)Cl AIFCHEM-94586014799 [0,2,0,0,0,0|2,0,0]=4 299 B16R1.1147 CCC(C)CCC(=O)Nc1ccc(cc1)O AIFCHEM-94574885736 [0,2,0,0,0,0|2,0,0]=4 300 B16R1.1147 CCC(C)CNC(=O)Cc1ccc(cc1)Cl AIFCHEM-94534479593 [0,2,0,0,0,0|1,0,0]=3 301 B16R1.1147 CCC(F)CNC(=O)Cc1ccc(cc1)O AIFCHEM-5839473742 [0,2,0,0,0,0|2,0,0]=4 302 B16R1.1147 COC(C)CNC(=O)Cc1ccc(cc1)I AIFCHEM-5874505850 [0,2,0,0,0,0|1,0,0]=3 303 B16R1.1147 COC(C)CNC(=O)Cc1ccc(cc1)O AIFCHEM-5787822825 [0,2,0,0,0,0|1,0,0]=3 304 B16R1.1147 COC(C)CNC(=O)Cc1ccc(cn1)C AIFCHEM-5811921543 [0,2,0,0,0,0|2,0,0]=4 305 B16R1.1147 COC(C)CNC(=O)Cc1ccc(cn1)Cl AIFCHEM-5787569354 [0,2,0,0,0,0|2,0,0]=4 306 B16R1.1147 COC(C)CNC(=O)Cc1ccc(nc1)C AIFCHEM-5787964352 [0,2,0,0,0,0|2,0,0]=4 307 B16R1.1147 CO[C@@H](C)CNC(=O)Cc1ccc(cc1)I AIFCHEM-5945155302 [0,2,0,0,0,0|1,0,0]=3 308 B16R1.1147 CO[C@@H](C)CNC(=O)Cc1ccc(cc1)O AIFCHEM-94588788614 [0,2,0,0,0,0|1,0,0]=3 309 B16R1.1147 CO[C@@H](C)CNC(=O)Cc1ccc(cn1)C AIFCHEM-5899383237 [0,2,0,0,0,0|2,0,0]=4 310 B16R1.1147 CO[C@@H](C)CNC(=O)Cc1ccc(cn1)Cl AIFCHEM-5944631387 [0,2,0,0,0,0|2,0,0]=4 311 B16R1.1147 CO[C@@H](C)CNC(=O)Cc1ccc(nc1)C AIFCHEM-94588789634 [0,2,0,0,0,0|2,0,0]=4 312 B16R1.1147 CO[C@H](C)CNC(=O)Cc1ccc(cc1)I AIFCHEM-94608845295 [0,2,0,0,0,0|1,0,0]=3 313 B16R1.1147 CO[C@H](C)CNC(=O)Cc1ccc(cc1)O AIFCHEM-94608844708 [0,2,0,0,0,0|1,0,0]=3 314 B16R1.1147 CO[C@H](C)CNC(=O)Cc1ccc(cn1)C AIFCHEM-94608843182 [0,2,0,0,0,0|2,0,0]=4 315 B16R1.1147 CO[C@H](C)CNC(=O)Cc1ccc(cn1)Cl AIFCHEM-94608842220 [0,2,0,0,0,0|2,0,0]=4 316 B16R1.1147 CO[C@H](C)CNC(=O)Cc1ccc(nc1)C AIFCHEM-94608845728 [0,2,0,0,0,0|2,0,0]=4 317 B16R1.11390 CC(C)CCC(=O)Nc1ccc(cc1Cl)Cl AIFCHEM-94582912904 [0,2,0,0,0,0|2,0,0]=4 318 B16R1.11390 CC(C)CNC(=O)Cc1ccc(cc1F)Cl AIFCHEM-6163306436 [0,2,0,0,0,0|1,0,0]=3 319 B16R1.11390 CC(C)CNC(=O)Cc1ccc(cc1F)F AIFCHEM-6144413596 [0,2,0,0,0,0|1,0,0]=3 320 B16R1.11390 CC(C)CNC(=O)Cc1ccc(nc1Cl)Cl AIFCHEM-94563732738 [0,2,0,0,0,0|2,0,0]=4 321 B16R1.11390 CC(C)CNC(=O)Cc1ncc(cc1F)Br AIFCHEM-94563726342 [0,2,0,0,0,0|2,0,0]=4 322 B16R1.16566 CC(C)(C)CNC(=O)Cc1ccc(cc1)Br AIFCHEM-5958677787 [0,2,0,0,0,0|1,0,0]=3 323 B16R1.16566 CC(C)(C)CNC(=O)Cc1ccc(cc1)Cl AIFCHEM-94570506130 [0,2,0,0,0,0|1,0,0]=3 324 B16R1.16566 CC(C)(C)CNC(=O)Cc1ccc(cc1)F AIFCHEM-94570508669 [0,2,0,0,0,0|1,0,0]=3 325 B16R1.16566 CC(C)(C)CNC(=O)Cc1ccc(cn1)Br AIFCHEM-94570506238 [0,2,0,0,0,0|2,0,0]=4 326 B16R1.16566 CC(C)(C)CNC(=O)Cn1ccc(=O)cc1 AIFCHEM-5958541543 [0,2,0,0,0,0|2,0,0]=4 327 B16R1.16566 CC(F)(F)CNC(=O)Cc1ccc(cc1)F AIFCHEM-5925227947 [0,2,0,0,0,0|2,0,0]=4 328 B16R1.16566 CC(F)(F)CNC(=O)Cc1ccc(cc1)O AIFCHEM-5902316099 [0,2,0,0,0,0|2,0,0]=4 329 B16R1.41 CC(C)CCC(=O)Nc1cccc(c1)C#N AIFCHEM-94571682375 [0,2,0,0,0,0|2,0,0]=4 330 B16R1.41 COc1cccc(c1)CC(=O)NCC(C)C AIFCHEM-94563728404 [0,2,0,0,0,0|1,0,0]=3 331 B16R1.85 CC(C)CNC(=O)Cc1cccc(c1Br)Cl AIFCHEM-94563726730 [0,2,0,0,0,0|1,0,0]=3 332 B16R1.85 CC(C)CNC(=O)Cc1cccc(c1Cl)Cl AIFCHEM-94563725491 [0,2,0,0,0,0|1,0,0]=3 333 B16R1.85 Cc1cccc(c1C)NC(=O)CCC(C)C AIFCHEM-5939481850 [0,2,0,0,0,0|2,0,0]=4 334 B16R1.1148 CCC(C)CCC(=O)Nc1cccc(c1)Cl AIFCHEM-94552610421 [0,2,0,0,0,0|2,0,0]=4 335 B16R1.1148 CCC(C)CCC(=O)Nc1cccc(c1)F AIFCHEM-5710428829 [0,2,0,0,0,0|2,0,0]=4 336 B16R1.1148 CCC(C)CCC(=O)Nc1cccc(c1)I AIFCHEM-5642892567 [0,2,0,0,0,0|2,0,0]=4 337 B16R1.1148 CCC(C)CCC(=O)Nc1cccc(c1)O AIFCHEM-94552455347 [0,2,0,0,0,0|2,0,0]=4 338 B16R1.1148 CCC(C)CNC(=O)Cc1cccc(n1)F AIFCHEM-94534476302 [0,2,0,0,0,0|2,0,0]=4 339 B16R1.1148 CCC(C)CNC(=O)Cc1cccc(n1)O AIFCHEM-94534485622 [0,2,0,0,0,0|2,0,0]=4 340 B16R1.1148 CCC(F)CNC(=O)Cc1cccc(c1)Br AIFCHEM-5859718376 [0,2,0,0,0,0|2,0,0]=4 341 B16R1.1148 CCC(F)CNC(=O)Cc1cccc(c1)Cl AIFCHEM-5839300845 [0,2,0,0,0,0|2,0,0]=4 342 B16R1.1148 CCC(F)CNC(=O)Cc1cccc(c1)F AIFCHEM-5802229105 [0,2,0,0,0,0|2,0,0]=4 343 B16R1.1148 CCC(F)CNC(=O)Cc1cccc(c1)I AIFCHEM-5879515377 [0,2,0,0,0,0|2,0,0]=4 344 B16R1.1148 COC(C)CNC(=O)Cc1cccc(c1)Br AIFCHEM-5788089394 [0,2,0,0,0,0|1,0,0]=3 345 B16R1.1148 COC(C)CNC(=O)Cc1cccc(c1)Cl AIFCHEM-5851331672 [0,2,0,0,0,0|1,0,0]=3 346 B16R1.1148 COC(C)CNC(=O)Cc1cccc(c1)O AIFCHEM-5874239390 [0,2,0,0,0,0|1,0,0]=3 347 B16R1.1148 COC(C)CNC(=O)Cc1cccc(n1)Br AIFCHEM-5812091972 [0,2,0,0,0,0|2,0,0]=4 348 B16R1.1148 CO[C@@H](C)CNC(=O)Cc1cccc(c1)Br AIFCHEM-94588789416 [0,2,0,0,0,0|1,0,0]=3 349 B16R1.1148 CO[C@@H](C)CNC(=O)Cc1cccc(c1)Cl AIFCHEM-94588789414 [0,2,0,0,0,0|1,0,0]=3 350 B16R1.1148 CO[C@@H](C)CNC(=O)Cc1cccc(c1)O AIFCHEM-5898974510 [0,2,0,0,0,0|1,0,0]=3 351 B16R1.1148 CO[C@@H](C)CNC(=O)Cc1cccc(n1)Br AIFCHEM-94588786608 [0,2,0,0,0,0|2,0,0]=4 352 B16R1.1148 CO[C@H](C)CNC(=O)Cc1cccc(c1)Br AIFCHEM-94608845510 [0,2,0,0,0,0|1,0,0]=3 353 B16R1.1148 CO[C@H](C)CNC(=O)Cc1cccc(c1)Cl AIFCHEM-94608845508 [0,2,0,0,0,0|1,0,0]=3 354 B16R1.1148 CO[C@H](C)CNC(=O)Cc1cccc(c1)O AIFCHEM-94608849521 [0,2,0,0,0,0|1,0,0]=3 355 B16R1.1148 CO[C@H](C)CNC(=O)Cc1cccc(n1)Br AIFCHEM-94608842702 [0,2,0,0,0,0|2,0,0]=4 356 B16R1.7301 CC(C)(C)CNC(=O)Cc1cccc(c1)O AIFCHEM-5909908785 [0,2,0,0,0,0|1,0,0]=3 357 B16R1.7301 CC(C)(C)CNC(=O)Cc1ccnc(c1)Cl AIFCHEM-5977801484 [0,2,0,0,0,0|2,0,0]=4 358 B16R1.7301 CC(C)(F)CNC(=O)Cc1cccc(c1)Cl AIFCHEM-5760796342 [0,2,0,0,0,0|1,0,0]=3 359 B16R1.7301 CC(C)(F)CNC(=O)Cc1cccc(n1)F AIFCHEM-5770921544 [0,2,0,0,0,0|2,0,0]=4 360 B16R1.7301 CC(F)(F)CNC(=O)Cc1cccc(c1)Br AIFCHEM-5902095245 [0,2,0,0,0,0|2,0,0]=4 361 B16R1.7301 CC(F)(F)CNC(=O)Cc1cccc(c1)F AIFCHEM-5981439083 [0,2,0,0,0,0|2,0,0]=4 362 B16R1.7488 CC(C)CNC(=O)Cc1cc(ccc1Br)Br AIFCHEM-94563729002 [0,2,0,0,0,0|1,0,0]=3 363 B16R1.7488 CC(C)CNC(=O)Cc1cc(ccc1Cl)F AIFCHEM-94563728353 [0,2,0,0,0,0|1,0,0]=3 364 B16R1.7488 CC(C)CNC(=O)Cc1cc(ccc1F)O AIFCHEM-94563727637 [0,2,0,0,0,0|1,0,0]=3 365 B16R1.7488 CC(C)CNC(=O)Cc1cc(ccc1O)O AIFCHEM-6145227417 [0,2,0,0,0,0|1,0,0]=3 366 B16R1.11187 CC(C)CNC(=O)C(C)c1cccc(c1)Br AIFCHEM-94563731951 [0,2,0,0,0,0|1,0,0]=3 367 B16R1.11187 CC(C)CNC(=O)[C@@H](C)c1cccc(c1)Br AIFCHEM-94563726002 [0,2,0,0,0,0|1,0,0]=3 368 B16R1.11234 CC(C)CC(O)C(=O)Nc1cccc(c1)F AIFCHEM-94579361522 [0,2,0,0,0,0|2,0,0]=4 369 B16R1.11234 CC(C)CN(C)C(=O)Cc1ccnc(c1)Br AIFCHEM-5739713231 [0,2,0,0,0,0|2,0,0]=4 370 B16R1.11234 CC(C)CN(C)C(=O)Cc1cncc(c1)Br AIFCHEM-5711321039 [0,2,0,0,0,0|2,0,0]=4 371 B16R1.11234 CC(C)C[C@@H](O)C(=O)Nc1cccc(c1)F AIFCHEM-94579358910 [0,2,0,0,0,0|2,0,0]=4 372 B16R1.11234 CC(C)C[C@H](O)C(=O)Nc1cccc(c1)F AIFCHEM-94591604818 [0,2,0,0,0,0|2,0,0]=4 373 B16R1.11235 CC(C)C(C)NC(=O)Cc1cccc(c1)Br AIFCHEM-6212050181 [0,2,0,0,0,0|1,0,0]=3 374 B16R1.11235 CC(C)C(C)NC(=O)Cc1cccc(c1)Cl AIFCHEM-6213698860 [0,2,0,0,0,0|1,0,0]=3 375 B16R1.11235 CC(C)C(C)NC(=O)Cc1cccc(c1)I AIFCHEM-6215304188 [0,2,0,0,0,0|1,0,0]=3 376 B16R1.11235 CC(C)C(C)NC(=O)Cc1cccc(n1)Cl AIFCHEM-6232219451 [0,2,0,0,0,0|2,0,0]=4 377 B16R1.11235 CC(C)C(C)NC(=O)Cc1cccc(n1)F AIFCHEM-6211634297 [0,2,0,0,0,0|2,0,0]=4 378 B16R1.11235 CC(C)C(C)NC(=O)Cc1cccc(n1)O AIFCHEM-6232715365 [0,2,0,0,0,0|2,0,0]=4 379 B16R1.11235 CC(C)C(C)NC(=O)Cc1ccnc(c1)Cl AIFCHEM-6232717928 [0,2,0,0,0,0|2,0,0]=4 380 B16R1.11235 CC(C)[C@@H](C)NC(=O)Cc1cccc(c1)Br AIFCHEM-94576827123 [0,2,0,0,0,0|1,0,0]=3 381 B16R1.11235 CC(C)[C@@H](C)NC(=O)Cc1cccc(c1)Cl AIFCHEM-94576827121 [0,2,0,0,0,0|1,0,0]=3 382 B16R1.11235 CC(C)[C@@H](C)NC(=O)Cc1cccc(c1)I AIFCHEM-94576827125 [0,2,0,0,0,0|1,0,0]=3 383 B16R1.11235 CC(C)[C@@H](C)NC(=O)Cc1cccc(n1)Cl AIFCHEM-94576832653 [0,2,0,0,0,0|2,0,0]=4 384 B16R1.11235 CC(C)[C@@H](C)NC(=O)Cc1cccc(n1)F AIFCHEM-94576823831 [0,2,0,0,0,0|2,0,0]=4 385 B16R1.11235 CC(C)[C@@H](C)NC(=O)Cc1cccc(n1)O AIFCHEM-94576833151 [0,2,0,0,0,0|2,0,0]=4 386 B16R1.11235 CC(C)[C@@H](C)NC(=O)Cc1ccnc(c1)Cl AIFCHEM-94576832737 [0,2,0,0,0,0|2,0,0]=4 387 B16R1.1369 CCc1ccccc1NC(=O)CCC(C)C AIFCHEM-94590693541 [0,2,0,0,0,0|2,0,0]=4 388 B16R1.7412 CC(C)CN(C)C(=O)Cc1ccccc1Cl AIFCHEM-5768560281 [0,2,0,0,0,0|1,0,0]=3 389 B16R1.7413 CC(C)C(C)NC(=O)Cn1ccccc1=O AIFCHEM-6214747466 [0,2,0,0,0,0|2,0,0]=4 390 B16R1.7413 CC(C)[C@@H](C)NC(=O)Cn1ccccc1=O AIFCHEM-94576830719 [0,2,0,0,0,0|2,0,0]=4 391 B16R1.7424 CC(C)(C)CNC(=O)Cc1ccccc1Br AIFCHEM-94570506101 [0,2,0,0,0,0|1,0,0]=3 392 B16R1.7424 CC(C)(C)CNC(=O)Cc1ccccc1I AIFCHEM-5927883595 [0,2,0,0,0,0|1,0,0]=3 393 B16R1.7424 CC(C)(F)CNC(=O)Cc1ccccc1Cl AIFCHEM-5691890839 [0,2,0,0,0,0|1,0,0]=3 394 B16R1.7424 CC(C)(F)CNC(=O)Cc1ncccc1Cl AIFCHEM-5783380218 [0,2,0,0,0,0|2,0,0]=4 395 B16R1.7424 Cc1ccccc1CC(=O)NCC(C)(C)C AIFCHEM-5965534991 [0,2,0,0,0,0|1,0,0]=3 396 B16R1.7424 Cc1ccccc1CC(=O)NCC(C)(C)F AIFCHEM-5760748090 [0,2,0,0,0,0|1,0,0]=3 397 B16R1.7458 CCC(C)CCC(=O)Nc1ccccc1C AIFCHEM-5938318697 [0,2,0,0,0,0|2,0,0]=4 398 B16R1.7458 CCC(C)CCC(=O)Nc1ccccc1F AIFCHEM-6046074811 [0,2,0,0,0,0|2,0,0]=4 399 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1Br AIFCHEM-94534479564 [0,2,0,0,0,0|1,0,0]=3 400 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1Cl AIFCHEM-94534480699 [0,2,0,0,0,0|1,0,0]=3 401 B16R1.7458 COC(C)CNC(=O)Cc1ccccc1I AIFCHEM-5789472843 [0,2,0,0,0,0|1,0,0]=3 402 B16R1.7458 COC(C)CNC(=O)Cc1cccnc1Cl AIFCHEM-5787433245 [0,2,0,0,0,0|2,0,0]=4 403 B16R1.7458 COC(C)CNC(=O)Cn1ccccc1=O AIFCHEM-5851073176 [0,2,0,0,0,0|2,0,0]=4 404 B16R1.7458 CO[C@@H](C)CNC(=O)Cc1ccccc1I AIFCHEM-5930783087 [0,2,0,0,0,0|1,0,0]=3 405 B16R1.7458 CO[C@@H](C)CNC(=O)Cc1cccnc1Cl AIFCHEM-94588793379 [0,2,0,0,0,0|2,0,0]=4 406 B16R1.7458 CO[C@@H](C)CNC(=O)Cn1ccccc1=O AIFCHEM-5930333936 [0,2,0,0,0,0|2,0,0]=4 407 B16R1.7458 CO[C@H](C)CNC(=O)Cc1ccccc1I AIFCHEM-94608845479 [0,2,0,0,0,0|1,0,0]=3 408 B16R1.7458 CO[C@H](C)CNC(=O)Cc1cccnc1Cl AIFCHEM-94608849473 [0,2,0,0,0,0|2,0,0]=4 409 B16R1.7458 CO[C@H](C)CNC(=O)Cn1ccccc1=O AIFCHEM-94608849106 [0,2,0,0,0,0|2,0,0]=4 410 B16R1.10818 CC(C)CNC(=O)C(C)c1ccccc1Cl AIFCHEM-6145526701 [0,2,0,0,0,0|1,0,0]=3 411 B16R1.10818 Cc1ccccc1C(C)C(=O)NCC(C)C AIFCHEM-94601539154 [0,2,0,0,0,0|1,0,0]=3 412 B16R1.11232 Cc1cccc(c1CC(=O)NCC(C)C)C AIFCHEM-94563734649 [0,2,0,0,0,0|1,0,0]=3 413 B16R1.4134 CC(C)C(C)N(C)C(=O)Cc1ccncc1 AIFCHEM-94550008771 [0,2,0,0,0,0|2,0,0]=4 414 B16R1.2925 CC(C#N)CNC(=O)C(C)c1ccccc1 AIFCHEM-6038630629 [0,2,0,0,0,0|1,0,1]=4 415 B16R1.2925 CC(C#N)CNC(=O)[C@@H](C)c1ccccc1 AIFCHEM-6057234988 [0,2,0,0,0,0|1,0,1]=4 416 B16R1.2925 CC(C#N)CNC(=O)[C@H](C)c1ccccc1 AIFCHEM-6017431643 [0,2,0,0,0,0|1,0,1]=4 417 B16R1.2925 CCC(C)CNC(=O)C(C)c1ccccc1 AIFCHEM-94534482561 [0,2,0,0,0,0|1,0,0]=3 418 B16R1.2925 CCC(C)CNC(=O)[C@@H](C)c1ccccc1 AIFCHEM-94534484504 [0,2,0,0,0,0|1,0,0]=3 419 B16R1.2925 CCC(C)CNC(=O)[C@H](C)c1ccccc1 AIFCHEM-94534484505 [0,2,0,0,0,0|1,0,0]=3 420 B16R1.2925 COC(C)CNC(=O)[C@@H](C)c1ccccc1 AIFCHEM-5811911968 [0,2,0,0,0,0|1,0,0]=3 421 B16R1.2925 COC(C)CNC(=O)[C@H](C)c1ccccc1 AIFCHEM-5811685019 [0,2,0,0,0,0|1,0,0]=3 422 B16R1.2925 CO[C@@H](C)CNC(=O)C(C)c1ccccc1 AIFCHEM-94588792383 [0,2,0,0,0,0|1,0,0]=3 423 B16R1.2925 CO[C@@H](C)CNC(=O)[C@@H](C)c1ccccc1 AIFCHEM-94588794326 [0,2,0,0,0,0|1,0,0]=3 424 B16R1.2925 CO[C@@H](C)CNC(=O)[C@H](C)c1ccccc1 AIFCHEM-94588794327 [0,2,0,0,0,0|1,0,0]=3 425 B16R1.2925 CO[C@H](C)CNC(=O)C(C)c1ccccc1 AIFCHEM-94608848477 [0,2,0,0,0,0|1,0,0]=3 426 B16R1.2925 CO[C@H](C)CNC(=O)[C@@H](C)c1ccccc1 AIFCHEM-94608850420 [0,2,0,0,0,0|1,0,0]=3 427 B16R1.2925 CO[C@H](C)CNC(=O)[C@H](C)c1ccccc1 AIFCHEM-94608850421 [0,2,0,0,0,0|1,0,0]=3 428 B16R1.616 CC(C(=O)NCC(C)(C)C)c1ccccc1 AIFCHEM-94570509098 [0,2,0,0,0,0|1,0,0]=3 429 B16R1.616 C[C@@H](C(=O)NCC(C)(C)C)c1ccccc1 AIFCHEM-94570511042 [0,2,0,0,0,0|1,0,0]=3 430 B16R1.616 C[C@H](C(=O)NCC(C)(C)C)c1ccccc1 AIFCHEM-94570511041 [0,2,0,0,0,0|1,0,0]=3 431 B16R1.1673 CCC(C(=O)NCC(C)C)c1ccccc1 AIFCHEM-94563734351 [0,2,0,0,0,0|1,0,0]=3 432 B16R1.1673 CC[C@@H](C(=O)NCC(C)C)c1ccccc1 AIFCHEM-94563734650 [0,2,0,0,0,0|1,0,0]=3 433 B16R1.1673 CC[C@H](C(=O)NCC(C)C)c1ccccc1 AIFCHEM-94563731274 [0,2,0,0,0,0|1,0,0]=3 434 B16R1.1673 COC(C(=O)NCC(C)C)c1ccccc1 AIFCHEM-6163965651 [0,2,0,0,0,0|1,0,0]=3 435 B16R1.1673 CO[C@@H](C(=O)NCC(C)C)c1ccccc1 AIFCHEM-6179333759 [0,2,0,0,0,0|1,0,0]=3 436 B16R1.1673 CO[C@H](C(=O)NCC(C)C)c1ccccc1 AIFCHEM-94563729927 [0,2,0,0,0,0|1,0,0]=3 437 B14R2.343 CC1CC1C(=O)Nc2ccccc2 AIFCHEM-94577033582 [1,0,0,1,0,0|2,0,0]=4 438 B14R2.343 C[C@@H]1C[C@H]1C(=O)Nc2ccccc2 AIFCHEM-94552045696 [1,0,0,1,0,0|2,0,0]=4 439 B14R2.343 C[C@H]1C[C@@H]1C(=O)Nc2ccccc2 AIFCHEM-94577030883 [1,0,0,1,0,0|2,0,0]=4 440 B14R2.9589 O=C(Cc1cccnc1)N2CCC2 AIFCHEM-6079217797 [1,0,0,1,0,0|2,0,0]=4 441 B14R2.352 C[C@@H]1C[C@H]1NC(=O)c2ccccn2 AIFCHEM-94578926625 [0,0,0,1,1,0|2,0,0]=4 442 B14R2.352 C[C@@H]1C[C@H]1NC(=O)c2cccnc2 AIFCHEM-94559019052 [0,0,0,1,1,0|2,0,0]=4 443 B14R2.352 O=C(NC1CC1F)c2ccccc2 AIFCHEM-94597371394 [0,0,0,1,1,0|2,0,0]=4 444 B14R2.352 O=C(N[C@@H]1C[C@@H]1F)c2ccccc2 AIFCHEM-94565576051 [0,0,0,1,1,0|2,0,0]=4 445 B14R2.352 O=C(N[C@@H]1C[C@H]1F)c2ccccc2 AIFCHEM-94565573687 [0,0,0,1,1,0|2,0,0]=4 446 B14R2.352 O=C(N[C@H]1C[C@@H]1F)c2ccccc2 AIFCHEM-94565577041 [0,0,0,1,1,0|2,0,0]=4 447 B14R2.352 O=C(N[C@H]1C[C@H]1F)c2ccccc2 AIFCHEM-94565576050 [0,0,0,1,1,0|2,0,0]=4 448 B14R2.422 CC1CN(C1)C(=O)c2ccncc2 AIFCHEM-5908308278 [0,0,0,1,1,0|2,0,0]=4 449 B14R2.428 CC1CN(C1)C(=O)Cc2ccco2 AIFCHEM-5973895167 [0,0,0,1,1,0|2,0,0]=4 450 B14R2.428 CC1CN(C1)C(=O)Cn2cccc2 AIFCHEM-5911140709 [0,0,0,1,1,0|2,0,0]=4 451 B14R2.9599 O=C(Cn1cccc1)NCC2CC2 AIFCHEM-94592478566 [0,0,0,1,1,0|2,0,0]=4 452 B16R2.3190 C[C@@H]1C[C@H]1CNC(=O)Cc2ccncc2 AIFCHEM-94599427618 [0,0,0,1,0,1|2,0,0]=4 453 B16R2.3334 CC1CC(C1)NC(=O)Cc2ccccn2 AIFCHEM-6177631910 [0,0,0,1,0,1|2,0,0]=4 454 B16R2.10947 O=C(Cc1ccccn1)NCCC2CC2 AIFCHEM-94576239539 [0,0,0,1,0,1|2,0,0]=4 455 B16R2.3193 C[C@@H]1C[C@H]1NC(=O)COc2ccccc2 AIFCHEM-94559013093 [0,0,0,1,0,1|1,0,0]=3 456 B16R2.3193 C[C@@H]1C[C@H]1NC(=O)CSc2ccncc2 AIFCHEM-94591226444 [0,0,0,1,0,1|2,0,0]=4 457 B16R2.3322 CC1CC(C1)C(=O)NCc2ccncc2 AIFCHEM-5871574479 [0,0,0,1,0,1|2,0,0]=4 458 B16R2.3322 O=C(NCc1ccccc1)C2CC(C2)F AIFCHEM-94539152514 [0,0,0,1,0,1|2,0,0]=4 459 B16R2.44153 O=C(CCC1CC1)NCc2ccccc2 AIFCHEM-94554641547 [0,0,0,1,0,1|1,0,0]=3 460 B16R2.44153 O=C(CCc1ccccn1)NCC2CC2 AIFCHEM-94592477589 [0,0,0,1,0,1|2,0,0]=4 461 B16R2.44153 O=C(CSc1ccccc1)NCC2CC2 AIFCHEM-5944563426 [0,0,0,1,0,1|1,0,0]=3 462 B16R2.1134 CC1CC(C1)C(=O)Nc2ccc(cc2)Br AIFCHEM-94608727373 [0,1,0,1,0,0|2,0,0]=4 463 B16R2.1134 CC1CN(C1)C(=O)Cc2ccc(cn2)Cl AIFCHEM-5907924101 [0,1,0,1,0,0|2,0,0]=4 464 B16R2.1134 CC1CN(C1)C(=O)Cc2ccc(cn2)O AIFCHEM-5930778276 [0,1,0,1,0,0|2,0,0]=4 465 B16R2.1136 C[C@@H]1C[C@H]1NC(=O)Cc2ccc(cn2)Br AIFCHEM-94559015367 [0,1,0,1,0,0|2,0,0]=4 466 B16R2.1136 C[C@@H]1C[C@H]1NC(=O)Cc2ccc(nc2)Cl AIFCHEM-94559017724 [0,1,0,1,0,0|2,0,0]=4 467 B16R2.1136 O=C(Cc1ccc(cc1)F)NC2CC2F AIFCHEM-5872893654 [0,1,0,1,0,0|2,0,0]=4 468 B16R2.1136 O=C(Cc1ccc(cc1)F)N[C@@H]2C[C@@H]2F AIFCHEM-6086367502 [0,1,0,1,0,0|2,0,0]=4 469 B16R2.1136 O=C(Cc1ccc(cc1)F)N[C@@H]2C[C@H]2F AIFCHEM-5838244013 [0,1,0,1,0,0|2,0,0]=4 470 B16R2.1136 O=C(Cc1ccc(cc1)F)N[C@H]2C[C@@H]2F AIFCHEM-6028687140 [0,1,0,1,0,0|2,0,0]=4 471 B16R2.33345 Cc1ccc(cc1)NC(=O)CCC2CC2 AIFCHEM-94547765292 [0,1,0,1,0,0|2,0,0]=4 472 B16R2.33345 O=C(Cc1ccc(cc1)Cl)NCC2CC2 AIFCHEM-94592478475 [0,1,0,1,0,0|1,0,0]=3 473 B16R2.33352 CC1(CC1C(=O)Nc2ccc(cc2)I)C AIFCHEM-6110377636 [0,1,0,1,0,0|2,0,0]=4 474 B16R2.33352 CC1(C[C@@H]1C(=O)Nc2ccc(cc2)I)C AIFCHEM-6151528381 [0,1,0,1,0,0|2,0,0]=4 475 B16R2.33352 Cc1ccc(cc1)NC(=O)C2CC2(C)C AIFCHEM-94584239235 [0,1,0,1,0,0|2,0,0]=4 476 B16R2.33352 Cc1ccc(cc1)NC(=O)[C@H]2CC2(C)C AIFCHEM-94584233376 [0,1,0,1,0,0|2,0,0]=4 477 B16R2.25765 CC1CC(C1)C(=O)Nc2cccc(c2)Cl AIFCHEM-94523500775 [0,1,0,1,0,0|2,0,0]=4 478 B16R2.25765 CC1CN(C1)C(=O)Cc2cccc(c2)O AIFCHEM-5907974868 [0,1,0,1,0,0|1,0,0]=3 479 B16R2.25765 CC1CN(C1)C(=O)Cc2cccc(n2)Br AIFCHEM-5908388465 [0,1,0,1,0,0|2,0,0]=4 480 B16R2.25765 CC1CN(C1)C(=O)Cc2cccc(n2)Cl AIFCHEM-5973842436 [0,1,0,1,0,0|2,0,0]=4 481 B16R2.25765 CC1CN(C1)C(=O)Cc2cccc(n2)O AIFCHEM-5973845123 [0,1,0,1,0,0|2,0,0]=4 482 B16R2.25765 CC1CN(C1)C(=O)Cc2cncc(c2)F AIFCHEM-5908022957 [0,1,0,1,0,0|2,0,0]=4 483 B16R2.25765 O=C(Cc1cccc(c1)Cl)N2CC(C2)F AIFCHEM-5600995121 [0,1,0,1,0,0|2,0,0]=4 484 B16R2.25765 O=C(Cc1cccc(c1)O)N2CC(C2)F AIFCHEM-5600735686 [0,1,0,1,0,0|2,0,0]=4 485 B16R2.136607 O=C(CCC1CC1)Nc2cccc(c2)Cl AIFCHEM-94552614796 [0,1,0,1,0,0|2,0,0]=4 486 B16R2.136607 O=C(Cc1cccc(c1)Cl)NCC2CC2 AIFCHEM-5959917349 [0,1,0,1,0,0|1,0,0]=3 487 B16R2.136607 O=C(Cc1ccnc(c1)Br)NCC2CC2 AIFCHEM-5889128292 [0,1,0,1,0,0|2,0,0]=4 488 B16R2.136607 O=C(Cc1cncc(c1)F)NCC2CC2 AIFCHEM-94592480813 [0,1,0,1,0,0|2,0,0]=4 489 B16R2.136612 CC1(CC1C(=O)Nc2cccc(c2)I)C AIFCHEM-5676932855 [0,1,0,1,0,0|2,0,0]=4 490 B16R2.136612 CC1(C[C@@H]1C(=O)Nc2cccc(c2)I)C AIFCHEM-5651341501 [0,1,0,1,0,0|2,0,0]=4 491 B16R2.12426 CC1CC(C1)C(=O)Nc2ccccc2Br AIFCHEM-94569947448 [0,1,0,1,0,0|2,0,0]=4 492 B16R2.12426 CC1CC(C1)C(=O)Nc2ccccc2O AIFCHEM-94591830334 [0,1,0,1,0,0|2,0,0]=4 493 B16R2.12426 CC1CN(C1)C(=O)Cc2ccccc2Cl AIFCHEM-5909563816 [0,1,0,1,0,0|1,0,0]=3 494 B16R2.12426 CC1CN(C1)C(=O)Cc2ncccc2Br AIFCHEM-5931223420 [0,1,0,1,0,0|2,0,0]=4 495 B16R2.12426 CC1CN(C1)C(=O)Cn2ccccc2=O AIFCHEM-5982448332 [0,1,0,1,0,0|2,0,0]=4 496 B16R2.12471 C[C@@H]1C[C@H]1NC(=O)Cc2ccccc2Br AIFCHEM-94559015230 [0,1,0,1,0,0|1,0,0]=3 497 B16R2.12471 C[C@@H]1C[C@H]1NC(=O)Cc2ccccc2F AIFCHEM-94559018036 [0,1,0,1,0,0|1,0,0]=3 498 B16R2.12471 C[C@@H]1C[C@H]1NC(=O)Cc2ccccc2O AIFCHEM-94559019215 [0,1,0,1,0,0|1,0,0]=3 499 B16R2.12471 O=C(Cc1ccccc1Br)NC2CC2F AIFCHEM-94597367158 [0,1,0,1,0,0|2,0,0]=4 500 B16R2.12471 O=C(Cc1ccccc1Br)N[C@@H]2C[C@@H]2F AIFCHEM-6011101016 [0,1,0,1,0,0|2,0,0]=4 501 B16R2.12471 O=C(Cc1ccccc1Br)N[C@@H]2C[C@H]2F AIFCHEM-5838013678 [0,1,0,1,0,0|2,0,0]=4 502 B16R2.12471 O=C(Cc1ccccc1Br)N[C@H]2C[C@@H]2F AIFCHEM-94589289266 [0,1,0,1,0,0|2,0,0]=4 503 B16R2.12471 O=C(Cc1ccccc1F)NC2CC2F AIFCHEM-5872602466 [0,1,0,1,0,0|2,0,0]=4 504 B16R2.12471 O=C(Cc1ccccc1F)N[C@@H]2C[C@@H]2F AIFCHEM-6011088895 [0,1,0,1,0,0|2,0,0]=4 505 B16R2.12471 O=C(Cc1ccccc1F)N[C@@H]2C[C@H]2F AIFCHEM-5808978409 [0,1,0,1,0,0|2,0,0]=4 506 B16R2.12471 O=C(Cc1ccccc1F)N[C@H]2C[C@@H]2F AIFCHEM-6022758221 [0,1,0,1,0,0|2,0,0]=4 507 B16R2.24867 Cc1ccccc1NC(=O)CCC2CC2 AIFCHEM-5892448740 [0,1,0,1,0,0|2,0,0]=4 508 B16R2.24867 O=C(CCC1CC1)Nc2ccccc2Br AIFCHEM-94569947371 [0,1,0,1,0,0|2,0,0]=4 509 B16R2.24867 O=C(Cc1ccccc1Br)NCC2CC2 AIFCHEM-94592478446 [0,1,0,1,0,0|1,0,0]=3 510 B16R2.24867 O=C(Cc1ncccc1Cl)NCC2CC2 AIFCHEM-94592484003 [0,1,0,1,0,0|2,0,0]=4 511 B16R2.27733 CC1(CN(C1)C(=O)Cc2ccccn2)C AIFCHEM-5698910735 [0,1,0,1,0,0|2,0,0]=4 512 B16R2.27766 CN(CC1CC1)C(=O)Cc2ccccn2 AIFCHEM-94576232074 [0,1,0,1,0,0|2,0,0]=4 513 B16R2.27766 O=C(Nc1ccccc1)[C@H](O)CC2CC2 AIFCHEM-94552041354 [0,1,0,1,0,0|2,0,0]=4 514 B16R2.10948 O=C(Cc1ccccn1)NCC2CCO2 AIFCHEM-94567682776 [0,1,0,1,0,0|2,0,0]=4 515 B16R2.10948 O=C(Cc1ccccn1)NCC2COC2 AIFCHEM-5895920974 [0,1,0,1,0,0|2,0,0]=4 516 B16R2.10948 O=C(Cc1ccccn1)NC[C@@H]2CCO2 AIFCHEM-5863878438 [0,1,0,1,0,0|2,0,0]=4 517 B16R2.10948 O=C(Cc1ccccn1)NC[C@H]2CCO2 AIFCHEM-5694905996 [0,1,0,1,0,0|2,0,0]=4 518 B16R2.10948 O=C(Cc1cccnc1)NCC2CCO2 AIFCHEM-94567687589 [0,1,0,1,0,0|2,0,0]=4 519 B16R2.10948 O=C(Cc1cccnc1)NC[C@@H]2CCO2 AIFCHEM-5882015324 [0,1,0,1,0,0|2,0,0]=4 520 B16R2.10948 O=C(Cc1cccnc1)NC[C@H]2CCO2 AIFCHEM-94529322699 [0,1,0,1,0,0|2,0,0]=4 521 B16R2.10948 O=C(Cc1ccncc1)NCC2CCC2 AIFCHEM-94603107466 [0,1,0,1,0,0|2,0,0]=4 522 B16R2.10948 O=C(Cc1ccncc1)NCC2COC2 AIFCHEM-5942175971 [0,1,0,1,0,0|2,0,0]=4 523 B16R2.147271 O=C(Cc1ccncc1)NCC2(CC2)F AIFCHEM-5710428759 [0,1,0,1,0,0|2,0,0]=4 524 B16R2.5858 O=C(NC1CC1F)C(O)c2ccccc2 AIFCHEM-94597372922 [0,1,0,1,0,0|2,0,0]=4 525 B16R2.5858 O=C(NC1CC1F)[C@@H](O)c2ccccc2 AIFCHEM-94597366791 [0,1,0,1,0,0|2,0,0]=4 526 B16R2.5858 O=C(NC1CC1F)[C@H](O)c2ccccc2 AIFCHEM-94597371118 [0,1,0,1,0,0|2,0,0]=4 527 B16R2.5858 O=C(N[C@H]1C[C@@H]1F)C(O)c2ccccc2 AIFCHEM-94589295030 [0,1,0,1,0,0|2,0,0]=4 528 B16R2.5858 O=C(N[C@H]1C[C@@H]1F)[C@@H](O)c2ccccc2 AIFCHEM-94589288899 [0,1,0,1,0,0|2,0,0]=4 529 B16R2.5858 O=C(N[C@H]1C[C@@H]1F)[C@H](O)c2ccccc2 AIFCHEM-94589293226 [0,1,0,1,0,0|2,0,0]=4 530 B16R2.27769 CC(NC(=O)Cc1ccccn1)C2CC2 AIFCHEM-94576235380 [0,1,0,1,0,0|2,0,0]=4 531 B16R2.27769 C[C@@H](NC(=O)Cc1ccccn1)C2CC2 AIFCHEM-94576232227 [0,1,0,1,0,0|2,0,0]=4 532 B16R2.27769 C[C@H](NC(=O)Cc1ccccn1)C2CC2 AIFCHEM-94533998424 [0,1,0,1,0,0|2,0,0]=4 533 B12R1.30 CCCNC(=O)c1ccccc1 AIFCHEM-94565582226 [1,0,0,0,1,0|1,0,0]=3 534 B12R1.53 CCCNC(=O)Cc1cccs1 AIFCHEM-5791342008 [1,0,0,0,1,0|2,0,0]=4 535 B12R1.252 CC(C)CNCc1ccccn1 AIFCHEM-94572980232 [1,0,0,0,1,0|2,0,0]=4 536 B12R1.54 CC(C)CNC(=O)c1cc[nH]c1 AIFCHEM-94563734593 [0,0,0,0,2,0|2,0,0]=4 537 B12R1.54 CC(C)CNC(=O)c1ccco1 AIFCHEM-6162410015 [0,0,0,0,2,0|2,0,0]=4 538 B12R1.260 CC(C)NC(=O)Cc1ccc[nH]1 AIFCHEM-94520551225 [0,0,0,0,2,0|2,0,0]=4 539 B12R1.43 CC(C)C(=O)Nc1ccncc1 AIFCHEM-94545049393 [0,0,0,0,2,0|2,0,0]=4 540 B14R1.156 CCCNC(=O)COc1ccccn1 AIFCHEM-5815026704 [1,0,0,0,0,1|2,0,0]=4 541 B14R1.156 CCCNC(=O)CSc1ccccc1 AIFCHEM-94521372545 [1,0,0,0,0,1|1,0,0]=3 542 B14R1.422 CC(C)NCCOCc1ccccc1 AIFCHEM-94520541129 [1,0,0,0,0,1|2,0,0]=4 543 B14R1.810 CC(C)CCNC(=O)Cc1cccs1 AIFCHEM-6095350108 [0,0,0,0,1,1|2,0,0]=4 544 B16R1.608 CC(=CCNC(=O)CSc1ccccc1)C AIFCHEM-5944594439 [0,0,0,0,0,2|1,0,1]=4 545 B16R1.608 CC(C)CCCC(=O)NCc1cccnc1 AIFCHEM-6238931173 [0,0,0,0,0,2|2,0,0]=4 546 B16R1.608 CC(C)CCNC(=O)CCc1ccccn1 AIFCHEM-6098877906 [0,0,0,0,0,2|2,0,0]=4 547 B16R1.608 CC(C)CCNC(=O)CCc1cccnc1 AIFCHEM-6184262660 [0,0,0,0,0,2|2,0,0]=4 548 B16R1.608 CC(C)CCNC(=O)CCc1ccncc1 AIFCHEM-6098597245 [0,0,0,0,0,2|2,0,0]=4 549 B16R1.608 CC(C)COCC(=O)NCc1ccccn1 AIFCHEM-5686871956 [0,0,0,0,0,2|1,0,0]=3 550 B16R1.610 CC(C)OCCNC(=O)Cc1ccccn1 AIFCHEM-94576238662 [0,0,0,0,0,2|2,0,0]=4 551 B16R1.610 CC(C)OCCNC(=O)Cc1ccncc1 AIFCHEM-94603109815 [0,0,0,0,0,2|2,0,0]=4